Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:20:20 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./HfNCl.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 83 50 15 1855 851 138 Max 84 51 16 1858 871 139 Sum 3023 1803 547 66861 30929 4997 bravais-lattice index = 14 lattice parameter (alat) = 17.8678 a.u. unit-cell volume = 687.8151 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 17.867779 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.928669 celldm(5)= 0.928669 celldm(6)= 0.928669 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.928669 0.370910 0.000000 ) a(3) = ( 0.928669 0.178596 0.325081 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -2.503759 -1.481193 ) b(2) = ( 0.000000 2.696073 -1.481193 ) b(3) = ( 0.000000 0.000000 3.076157 ) PseudoPot. # 1 for Hf read from file: /users/gautes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1271 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Hf 12.00 178.49000 Hf( 1.00) Cl 7.00 35.45300 Cl( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 325 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 2) = ( 0.0096154 -0.0240746 -0.0142422), wk = 0.0030769 k( 3) = ( 0.0192308 -0.0481492 -0.0284845), wk = 0.0030769 k( 4) = ( 0.0288462 -0.0722238 -0.0427267), wk = 0.0030769 k( 5) = ( 0.0384615 -0.0962984 -0.0569690), wk = 0.0030769 k( 6) = ( 0.0480769 -0.1203730 -0.0712112), wk = 0.0030769 k( 7) = ( 0.0576923 -0.1444476 -0.0854534), wk = 0.0030769 k( 8) = ( 0.0673077 -0.1685222 -0.0996957), wk = 0.0030769 k( 9) = ( 0.0769231 -0.1925968 -0.1139379), wk = 0.0030769 k( 10) = ( 0.0865385 -0.2166714 -0.1281802), wk = 0.0030769 k( 11) = ( 0.0961538 -0.2407460 -0.1424224), wk = 0.0030769 k( 12) = ( 0.1057692 -0.2648206 -0.1566646), wk = 0.0030769 k( 13) = ( 0.1153846 -0.2888952 -0.1709069), wk = 0.0030769 k( 14) = ( 0.1250000 -0.3129698 -0.1851491), wk = 0.0030769 k( 15) = ( 0.1346154 -0.3370444 -0.1993914), wk = 0.0030769 k( 16) = ( 0.1442308 -0.3611190 -0.2136336), wk = 0.0030769 k( 17) = ( 0.1538461 -0.3851936 -0.2278758), wk = 0.0030769 k( 18) = ( 0.1634615 -0.4092682 -0.2421181), wk = 0.0030769 k( 19) = ( 0.1730769 -0.4333428 -0.2563603), wk = 0.0030769 k( 20) = ( 0.1826923 -0.4574174 -0.2706026), wk = 0.0030769 k( 21) = ( 0.1923077 -0.4814920 -0.2848448), wk = 0.0030769 k( 22) = ( 0.2019231 -0.5055666 -0.2990871), wk = 0.0030769 k( 23) = ( 0.2115385 -0.5296412 -0.3133293), wk = 0.0030769 k( 24) = ( 0.2211539 -0.5537158 -0.3275715), wk = 0.0030769 k( 25) = ( 0.2307692 -0.5777904 -0.3418138), wk = 0.0030769 k( 26) = ( 0.2403846 -0.6018651 -0.3560560), wk = 0.0030769 k( 27) = ( 0.2500000 -0.6259396 -0.3702983), wk = 0.0030769 k( 28) = ( 0.2596154 -0.6500142 -0.3845405), wk = 0.0030769 k( 29) = ( 0.2692308 -0.6740888 -0.3987827), wk = 0.0030769 k( 30) = ( 0.2788462 -0.6981634 -0.4130250), wk = 0.0030769 k( 31) = ( 0.2884615 -0.7222381 -0.4272672), wk = 0.0030769 k( 32) = ( 0.2980769 -0.7463126 -0.4415095), wk = 0.0030769 k( 33) = ( 0.3076923 -0.7703873 -0.4557517), wk = 0.0030769 k( 34) = ( 0.3173077 -0.7944619 -0.4699939), wk = 0.0030769 k( 35) = ( 0.3269231 -0.8185365 -0.4842362), wk = 0.0030769 k( 36) = ( 0.3365385 -0.8426111 -0.4984784), wk = 0.0030769 k( 37) = ( 0.3461538 -0.8666857 -0.5127207), wk = 0.0030769 k( 38) = ( 0.3557692 -0.8907603 -0.5269629), wk = 0.0030769 k( 39) = ( 0.3653846 -0.9148349 -0.5412052), wk = 0.0030769 k( 40) = ( 0.3750000 -0.9389095 -0.5554474), wk = 0.0030769 k( 41) = ( 0.3846154 -0.9629841 -0.5696896), wk = 0.0030769 k( 42) = ( 0.3942308 -0.9870587 -0.5839319), wk = 0.0030769 k( 43) = ( 0.4038462 -1.0111333 -0.5981741), wk = 0.0030769 k( 44) = ( 0.4134615 -1.0352079 -0.6124164), wk = 0.0030769 k( 45) = ( 0.4230769 -1.0592825 -0.6266586), wk = 0.0030769 k( 46) = ( 0.4326923 -1.0833571 -0.6409008), wk = 0.0030769 k( 47) = ( 0.4423077 -1.1074317 -0.6551431), wk = 0.0030769 k( 48) = ( 0.4519231 -1.1315063 -0.6693853), wk = 0.0030769 k( 49) = ( 0.4615385 -1.1555809 -0.6836276), wk = 0.0030769 k( 50) = ( 0.4711538 -1.1796555 -0.6978698), wk = 0.0030769 k( 51) = ( 0.4807692 -1.2037301 -0.7121120), wk = 0.0030769 k( 52) = ( 0.4903846 -1.2278047 -0.7263543), wk = 0.0030769 k( 53) = ( 0.5000000 -1.2518793 -0.7405965), wk = 0.0030769 k( 54) = ( 0.5000000 -1.2518793 -0.7405965), wk = 0.0030769 k( 55) = ( 0.5000000 -1.2366606 -0.7663218), wk = 0.0030769 k( 56) = ( 0.5000000 -1.2214418 -0.7920469), wk = 0.0030769 k( 57) = ( 0.5000000 -1.2062231 -0.8177722), wk = 0.0030769 k( 58) = ( 0.5000000 -1.1910044 -0.8434974), wk = 0.0030769 k( 59) = ( 0.5000000 -1.1757857 -0.8692226), wk = 0.0030769 k( 60) = ( 0.5000000 -1.1605669 -0.8949478), wk = 0.0030769 k( 61) = ( 0.5000000 -1.1453482 -0.9206730), wk = 0.0030769 k( 62) = ( 0.5000000 -1.1301295 -0.9463983), wk = 0.0030769 k( 63) = ( 0.5000000 -1.1149107 -0.9721235), wk = 0.0030769 k( 64) = ( 0.5000000 -1.0996920 -0.9978487), wk = 0.0030769 k( 65) = ( 0.5000000 -1.0844733 -1.0235739), wk = 0.0030769 k( 66) = ( 0.5000000 -1.0692546 -1.0492992), wk = 0.0030769 k( 67) = ( 0.5000000 -1.0540359 -1.0750244), wk = 0.0030769 k( 68) = ( 0.5000000 -1.0388171 -1.1007496), wk = 0.0030769 k( 69) = ( 0.5000000 -1.0235984 -1.1264748), wk = 0.0030769 k( 70) = ( 0.5000000 -1.0083797 -1.1522000), wk = 0.0030769 k( 71) = ( 0.5000000 -0.9931609 -1.1779253), wk = 0.0030769 k( 72) = ( 0.5000000 -0.9779422 -1.2036505), wk = 0.0030769 k( 73) = ( 0.5000000 -0.9627235 -1.2293757), wk = 0.0030769 k( 74) = ( 0.5000000 -0.9475048 -1.2551009), wk = 0.0030769 k( 75) = ( 0.5000000 -0.9322860 -1.2808261), wk = 0.0030769 k( 76) = ( 0.5000000 -0.9170673 -1.3065514), wk = 0.0030769 k( 77) = ( 0.5000000 -0.9018486 -1.3322766), wk = 0.0030769 k( 78) = ( 0.5000000 -0.8866299 -1.3580018), wk = 0.0030769 k( 79) = ( 0.5000000 -0.8714111 -1.3837270), wk = 0.0030769 k( 80) = ( 0.5000000 -0.8561924 -1.4094522), wk = 0.0030769 k( 81) = ( 0.5000000 -0.8409737 -1.4351775), wk = 0.0030769 k( 82) = ( 0.5000000 -0.8257549 -1.4609027), wk = 0.0030769 k( 83) = ( 0.5000000 -0.8105362 -1.4866279), wk = 0.0030769 k( 84) = ( 0.5000000 -0.7953175 -1.5123531), wk = 0.0030769 k( 85) = ( 0.5000000 -0.7800988 -1.5380784), wk = 0.0030769 k( 86) = ( 0.8250119 -0.7175944 -1.4243077), wk = 0.0030769 k( 87) = ( 0.8194083 -0.7035643 -1.3987699), wk = 0.0030769 k( 88) = ( 0.8138046 -0.6895341 -1.3732321), wk = 0.0030769 k( 89) = ( 0.8082010 -0.6755039 -1.3476943), wk = 0.0030769 k( 90) = ( 0.8025973 -0.6614737 -1.3221565), wk = 0.0030769 k( 91) = ( 0.7969937 -0.6474435 -1.2966187), wk = 0.0030769 k( 92) = ( 0.7913900 -0.6334133 -1.2710809), wk = 0.0030769 k( 93) = ( 0.7857864 -0.6193831 -1.2455431), wk = 0.0030769 k( 94) = ( 0.7801827 -0.6053529 -1.2200053), wk = 0.0030769 k( 95) = ( 0.7745791 -0.5913227 -1.1944675), wk = 0.0030769 k( 96) = ( 0.7689754 -0.5772925 -1.1689296), wk = 0.0030769 k( 97) = ( 0.7633717 -0.5632623 -1.1433918), wk = 0.0030769 k( 98) = ( 0.7577681 -0.5492321 -1.1178540), wk = 0.0030769 k( 99) = ( 0.7521644 -0.5352019 -1.0923162), wk = 0.0030769 k( 100) = ( 0.7465608 -0.5211717 -1.0667784), wk = 0.0030769 k( 101) = ( 0.7409571 -0.5071415 -1.0412406), wk = 0.0030769 k( 102) = ( 0.7353535 -0.4931113 -1.0157028), wk = 0.0030769 k( 103) = ( 0.7297498 -0.4790811 -0.9901650), wk = 0.0030769 k( 104) = ( 0.7241462 -0.4650509 -0.9646271), wk = 0.0030769 k( 105) = ( 0.7185425 -0.4510207 -0.9390894), wk = 0.0030769 k( 106) = ( 0.7129389 -0.4369905 -0.9135515), wk = 0.0030769 k( 107) = ( 0.7073352 -0.4229603 -0.8880137), wk = 0.0030769 k( 108) = ( 0.7017315 -0.4089301 -0.8624759), wk = 0.0030769 k( 109) = ( 0.6961279 -0.3948999 -0.8369381), wk = 0.0030769 k( 110) = ( 0.6905242 -0.3808697 -0.8114003), wk = 0.0030769 k( 111) = ( 0.6849206 -0.3668395 -0.7858625), wk = 0.0030769 k( 112) = ( 0.6793169 -0.3528093 -0.7603247), wk = 0.0030769 k( 113) = ( 0.6737133 -0.3387791 -0.7347869), wk = 0.0030769 k( 114) = ( 0.6681096 -0.3247489 -0.7092490), wk = 0.0030769 k( 115) = ( 0.6625060 -0.3107187 -0.6837112), wk = 0.0030769 k( 116) = ( 0.6569023 -0.2966885 -0.6581734), wk = 0.0030769 k( 117) = ( 0.6512987 -0.2826583 -0.6326356), wk = 0.0030769 k( 118) = ( 0.6456950 -0.2686281 -0.6070978), wk = 0.0030769 k( 119) = ( 0.6400913 -0.2545979 -0.5815600), wk = 0.0030769 k( 120) = ( 0.6344877 -0.2405678 -0.5560222), wk = 0.0030769 k( 121) = ( 0.6288840 -0.2265376 -0.5304844), wk = 0.0030769 k( 122) = ( 0.6232804 -0.2125074 -0.5049466), wk = 0.0030769 k( 123) = ( 0.6176767 -0.1984772 -0.4794087), wk = 0.0030769 k( 124) = ( 0.6120731 -0.1844470 -0.4538709), wk = 0.0030769 k( 125) = ( 0.6064694 -0.1704168 -0.4283331), wk = 0.0030769 k( 126) = ( 0.6008658 -0.1563866 -0.4027953), wk = 0.0030769 k( 127) = ( 0.5952621 -0.1423564 -0.3772575), wk = 0.0030769 k( 128) = ( 0.5896585 -0.1283262 -0.3517197), wk = 0.0030769 k( 129) = ( 0.5840548 -0.1142960 -0.3261819), wk = 0.0030769 k( 130) = ( 0.5784512 -0.1002658 -0.3006441), wk = 0.0030769 k( 131) = ( 0.5728475 -0.0862356 -0.2751062), wk = 0.0030769 k( 132) = ( 0.5672438 -0.0722054 -0.2495684), wk = 0.0030769 k( 133) = ( 0.5616402 -0.0581752 -0.2240306), wk = 0.0030769 k( 134) = ( 0.5560365 -0.0441450 -0.1984928), wk = 0.0030769 k( 135) = ( 0.5504329 -0.0301148 -0.1729550), wk = 0.0030769 k( 136) = ( 0.5448292 -0.0160846 -0.1474172), wk = 0.0030769 k( 137) = ( 0.5392256 -0.0020544 -0.1218794), wk = 0.0030769 k( 138) = ( 0.5336219 0.0119758 -0.0963416), wk = 0.0030769 k( 139) = ( 0.5280183 0.0260060 -0.0708038), wk = 0.0030769 k( 140) = ( 0.5224146 0.0400362 -0.0452660), wk = 0.0030769 k( 141) = ( 0.5168110 0.0540664 -0.0197281), wk = 0.0030769 k( 142) = ( 0.5112073 0.0680966 0.0058097), wk = 0.0030769 k( 143) = ( 0.5056036 0.0821268 0.0313475), wk = 0.0030769 k( 144) = ( 0.5000000 0.0961570 0.0568853), wk = 0.0030769 k( 145) = ( 0.5000000 0.0961570 0.0568853), wk = 0.0030769 k( 146) = ( 0.4722222 0.0908149 0.0537250), wk = 0.0030769 k( 147) = ( 0.4444444 0.0854729 0.0505647), wk = 0.0030769 k( 148) = ( 0.4166667 0.0801308 0.0474044), wk = 0.0030769 k( 149) = ( 0.3888889 0.0747888 0.0442441), wk = 0.0030769 k( 150) = ( 0.3611111 0.0694467 0.0410838), wk = 0.0030769 k( 151) = ( 0.3333333 0.0641046 0.0379235), wk = 0.0030769 k( 152) = ( 0.3055556 0.0587626 0.0347632), wk = 0.0030769 k( 153) = ( 0.2777778 0.0534205 0.0316029), wk = 0.0030769 k( 154) = ( 0.2500000 0.0480785 0.0284426), wk = 0.0030769 k( 155) = ( 0.2222222 0.0427364 0.0252824), wk = 0.0030769 k( 156) = ( 0.1944444 0.0373944 0.0221221), wk = 0.0030769 k( 157) = ( 0.1666667 0.0320523 0.0189618), wk = 0.0030769 k( 158) = ( 0.1388889 0.0267103 0.0158015), wk = 0.0030769 k( 159) = ( 0.1111111 0.0213682 0.0126412), wk = 0.0030769 k( 160) = ( 0.0833333 0.0160262 0.0094809), wk = 0.0030769 k( 161) = ( 0.0555556 0.0106841 0.0063206), wk = 0.0030769 k( 162) = ( 0.0277778 0.0053421 0.0031603), wk = 0.0030769 k( 163) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 164) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 165) = ( 0.0056249 -0.0140834 -0.0256346), wk = 0.0030769 k( 166) = ( 0.0112498 -0.0281668 -0.0512693), wk = 0.0030769 k( 167) = ( 0.0168747 -0.0422502 -0.0769039), wk = 0.0030769 k( 168) = ( 0.0224996 -0.0563336 -0.1025385), wk = 0.0030769 k( 169) = ( 0.0281245 -0.0704170 -0.1281732), wk = 0.0030769 k( 170) = ( 0.0337494 -0.0845003 -0.1538078), wk = 0.0030769 k( 171) = ( 0.0393743 -0.0985837 -0.1794425), wk = 0.0030769 k( 172) = ( 0.0449992 -0.1126671 -0.2050771), wk = 0.0030769 k( 173) = ( 0.0506241 -0.1267505 -0.2307117), wk = 0.0030769 k( 174) = ( 0.0562490 -0.1408339 -0.2563464), wk = 0.0030769 k( 175) = ( 0.0618739 -0.1549173 -0.2819810), wk = 0.0030769 k( 176) = ( 0.0674988 -0.1690007 -0.3076157), wk = 0.0030769 k( 177) = ( 0.0731237 -0.1830841 -0.3332503), wk = 0.0030769 k( 178) = ( 0.0787486 -0.1971675 -0.3588850), wk = 0.0030769 k( 179) = ( 0.0843735 -0.2112509 -0.3845196), wk = 0.0030769 k( 180) = ( 0.0899984 -0.2253343 -0.4101542), wk = 0.0030769 k( 181) = ( 0.0956233 -0.2394177 -0.4357889), wk = 0.0030769 k( 182) = ( 0.1012482 -0.2535011 -0.4614235), wk = 0.0030769 k( 183) = ( 0.1068731 -0.2675845 -0.4870581), wk = 0.0030769 k( 184) = ( 0.1124980 -0.2816679 -0.5126928), wk = 0.0030769 k( 185) = ( 0.1181229 -0.2957512 -0.5383274), wk = 0.0030769 k( 186) = ( 0.1237478 -0.3098346 -0.5639620), wk = 0.0030769 k( 187) = ( 0.1293727 -0.3239180 -0.5895967), wk = 0.0030769 k( 188) = ( 0.1349976 -0.3380014 -0.6152313), wk = 0.0030769 k( 189) = ( 0.1406225 -0.3520848 -0.6408660), wk = 0.0030769 k( 190) = ( 0.1462474 -0.3661682 -0.6665006), wk = 0.0030769 k( 191) = ( 0.1518723 -0.3802516 -0.6921352), wk = 0.0030769 k( 192) = ( 0.1574972 -0.3943350 -0.7177699), wk = 0.0030769 k( 193) = ( 0.1631221 -0.4084184 -0.7434045), wk = 0.0030769 k( 194) = ( 0.1687470 -0.4225018 -0.7690392), wk = 0.0030769 k( 195) = ( 0.1743719 -0.4365852 -0.7946738), wk = 0.0030769 k( 196) = ( 0.1799968 -0.4506686 -0.8203085), wk = 0.0030769 k( 197) = ( 0.1856217 -0.4647520 -0.8459431), wk = 0.0030769 k( 198) = ( 0.1912466 -0.4788354 -0.8715777), wk = 0.0030769 k( 199) = ( 0.1968715 -0.4929188 -0.8972124), wk = 0.0030769 k( 200) = ( 0.2024964 -0.5070021 -0.9228470), wk = 0.0030769 k( 201) = ( 0.2081213 -0.5210855 -0.9484816), wk = 0.0030769 k( 202) = ( 0.2137462 -0.5351689 -0.9741163), wk = 0.0030769 k( 203) = ( 0.2193711 -0.5492523 -0.9997509), wk = 0.0030769 k( 204) = ( 0.2249960 -0.5633357 -1.0253855), wk = 0.0030769 k( 205) = ( 0.2306209 -0.5774191 -1.0510202), wk = 0.0030769 k( 206) = ( 0.2362458 -0.5915025 -1.0766548), wk = 0.0030769 k( 207) = ( 0.2418707 -0.6055859 -1.1022895), wk = 0.0030769 k( 208) = ( 0.2474956 -0.6196693 -1.1279241), wk = 0.0030769 k( 209) = ( 0.2531205 -0.6337527 -1.1535587), wk = 0.0030769 k( 210) = ( 0.2587454 -0.6478361 -1.1791934), wk = 0.0030769 k( 211) = ( 0.2643703 -0.6619195 -1.2048280), wk = 0.0030769 k( 212) = ( 0.2699952 -0.6760029 -1.2304627), wk = 0.0030769 k( 213) = ( 0.2756201 -0.6900863 -1.2560973), wk = 0.0030769 k( 214) = ( 0.2812450 -0.7041697 -1.2817320), wk = 0.0030769 k( 215) = ( 0.2868699 -0.7182530 -1.3073666), wk = 0.0030769 k( 216) = ( 0.2924948 -0.7323364 -1.3330012), wk = 0.0030769 k( 217) = ( 0.2981197 -0.7464198 -1.3586359), wk = 0.0030769 k( 218) = ( 0.3037446 -0.7605032 -1.3842705), wk = 0.0030769 k( 219) = ( 0.3093695 -0.7745866 -1.4099051), wk = 0.0030769 k( 220) = ( 0.3149944 -0.7886700 -1.4355398), wk = 0.0030769 k( 221) = ( 0.3206193 -0.8027534 -1.4611744), wk = 0.0030769 k( 222) = ( 0.3262442 -0.8168368 -1.4868090), wk = 0.0030769 k( 223) = ( 0.3318691 -0.8309202 -1.5124437), wk = 0.0030769 k( 224) = ( 0.3374940 -0.8450036 -1.5380783), wk = 0.0030769 k( 225) = ( 0.6625060 -0.7488466 -1.4811930), wk = 0.0030769 k( 226) = ( 0.6569023 -0.7197085 -1.4811930), wk = 0.0030769 k( 227) = ( 0.6512987 -0.6905705 -1.4811930), wk = 0.0030769 k( 228) = ( 0.6456950 -0.6614324 -1.4811930), wk = 0.0030769 k( 229) = ( 0.6400913 -0.6322944 -1.4811930), wk = 0.0030769 k( 230) = ( 0.6344877 -0.6031564 -1.4811930), wk = 0.0030769 k( 231) = ( 0.6288840 -0.5740183 -1.4811930), wk = 0.0030769 k( 232) = ( 0.6232804 -0.5448802 -1.4811930), wk = 0.0030769 k( 233) = ( 0.6176767 -0.5157422 -1.4811930), wk = 0.0030769 k( 234) = ( 0.6120731 -0.4866041 -1.4811930), wk = 0.0030769 k( 235) = ( 0.6064694 -0.4574661 -1.4811930), wk = 0.0030769 k( 236) = ( 0.6008658 -0.4283280 -1.4811930), wk = 0.0030769 k( 237) = ( 0.5952621 -0.3991900 -1.4811930), wk = 0.0030769 k( 238) = ( 0.5896585 -0.3700519 -1.4811930), wk = 0.0030769 k( 239) = ( 0.5840548 -0.3409138 -1.4811930), wk = 0.0030769 k( 240) = ( 0.5784512 -0.3117758 -1.4811930), wk = 0.0030769 k( 241) = ( 0.5728475 -0.2826377 -1.4811930), wk = 0.0030769 k( 242) = ( 0.5672438 -0.2534997 -1.4811930), wk = 0.0030769 k( 243) = ( 0.5616402 -0.2243616 -1.4811930), wk = 0.0030769 k( 244) = ( 0.5560365 -0.1952236 -1.4811930), wk = 0.0030769 k( 245) = ( 0.5504329 -0.1660855 -1.4811930), wk = 0.0030769 k( 246) = ( 0.5448292 -0.1369475 -1.4811930), wk = 0.0030769 k( 247) = ( 0.5392256 -0.1078094 -1.4811930), wk = 0.0030769 k( 248) = ( 0.5336219 -0.0786713 -1.4811930), wk = 0.0030769 k( 249) = ( 0.5280183 -0.0495333 -1.4811930), wk = 0.0030769 k( 250) = ( 0.5224146 -0.0203953 -1.4811930), wk = 0.0030769 k( 251) = ( 0.5168110 0.0087428 -1.4811930), wk = 0.0030769 k( 252) = ( 0.5112073 0.0378809 -1.4811930), wk = 0.0030769 k( 253) = ( 0.5056036 0.0670189 -1.4811930), wk = 0.0030769 k( 254) = ( 0.5000000 0.0961570 -1.4811930), wk = 0.0030769 k( 255) = ( 0.5000000 0.0961570 -1.4811930), wk = 0.0030769 k( 256) = ( 0.5270843 0.1013657 -1.4717122), wk = 0.0030769 k( 257) = ( 0.5541687 0.1065744 -1.4622313), wk = 0.0030769 k( 258) = ( 0.5812530 0.1117831 -1.4527504), wk = 0.0030769 k( 259) = ( 0.6083373 0.1169917 -1.4432695), wk = 0.0030769 k( 260) = ( 0.6354216 0.1222004 -1.4337886), wk = 0.0030769 k( 261) = ( 0.6625060 0.1274091 -1.4243077), wk = 0.0030769 k( 262) = ( 0.6625060 0.1274091 -1.4243077), wk = 0.0030769 k( 263) = ( 0.6592558 0.1267841 -1.3946839), wk = 0.0030769 k( 264) = ( 0.6560057 0.1261590 -1.3650600), wk = 0.0030769 k( 265) = ( 0.6527556 0.1255340 -1.3354362), wk = 0.0030769 k( 266) = ( 0.6495055 0.1249090 -1.3058123), wk = 0.0030769 k( 267) = ( 0.6462554 0.1242839 -1.2761884), wk = 0.0030769 k( 268) = ( 0.6430052 0.1236589 -1.2465646), wk = 0.0030769 k( 269) = ( 0.6397551 0.1230338 -1.2169407), wk = 0.0030769 k( 270) = ( 0.6365050 0.1224088 -1.1873168), wk = 0.0030769 k( 271) = ( 0.6332549 0.1217837 -1.1576930), wk = 0.0030769 k( 272) = ( 0.6300048 0.1211587 -1.1280691), wk = 0.0030769 k( 273) = ( 0.6267546 0.1205337 -1.0984453), wk = 0.0030769 k( 274) = ( 0.6235045 0.1199086 -1.0688214), wk = 0.0030769 k( 275) = ( 0.6202544 0.1192836 -1.0391976), wk = 0.0030769 k( 276) = ( 0.6170043 0.1186585 -1.0095737), wk = 0.0030769 k( 277) = ( 0.6137542 0.1180335 -0.9799498), wk = 0.0030769 k( 278) = ( 0.6105041 0.1174084 -0.9503260), wk = 0.0030769 k( 279) = ( 0.6072539 0.1167834 -0.9207021), wk = 0.0030769 k( 280) = ( 0.6040038 0.1161584 -0.8910783), wk = 0.0030769 k( 281) = ( 0.6007537 0.1155333 -0.8614544), wk = 0.0030769 k( 282) = ( 0.5975036 0.1149083 -0.8318305), wk = 0.0030769 k( 283) = ( 0.5942535 0.1142832 -0.8022067), wk = 0.0030769 k( 284) = ( 0.5910033 0.1136582 -0.7725828), wk = 0.0030769 k( 285) = ( 0.5877532 0.1130331 -0.7429589), wk = 0.0030769 k( 286) = ( 0.5845031 0.1124081 -0.7133351), wk = 0.0030769 k( 287) = ( 0.5812530 0.1117831 -0.6837112), wk = 0.0030769 k( 288) = ( 0.5780029 0.1111580 -0.6540874), wk = 0.0030769 k( 289) = ( 0.5747527 0.1105330 -0.6244635), wk = 0.0030769 k( 290) = ( 0.5715026 0.1099079 -0.5948397), wk = 0.0030769 k( 291) = ( 0.5682525 0.1092829 -0.5652158), wk = 0.0030769 k( 292) = ( 0.5650024 0.1086578 -0.5355919), wk = 0.0030769 k( 293) = ( 0.5617523 0.1080328 -0.5059681), wk = 0.0030769 k( 294) = ( 0.5585022 0.1074077 -0.4763442), wk = 0.0030769 k( 295) = ( 0.5552520 0.1067827 -0.4467204), wk = 0.0030769 k( 296) = ( 0.5520019 0.1061577 -0.4170965), wk = 0.0030769 k( 297) = ( 0.5487518 0.1055326 -0.3874726), wk = 0.0030769 k( 298) = ( 0.5455017 0.1049076 -0.3578488), wk = 0.0030769 k( 299) = ( 0.5422516 0.1042825 -0.3282249), wk = 0.0030769 k( 300) = ( 0.5390014 0.1036575 -0.2986010), wk = 0.0030769 k( 301) = ( 0.5357513 0.1030324 -0.2689772), wk = 0.0030769 k( 302) = ( 0.5325012 0.1024074 -0.2393533), wk = 0.0030769 k( 303) = ( 0.5292511 0.1017824 -0.2097295), wk = 0.0030769 k( 304) = ( 0.5260010 0.1011573 -0.1801056), wk = 0.0030769 k( 305) = ( 0.5227508 0.1005323 -0.1504817), wk = 0.0030769 k( 306) = ( 0.5195007 0.0999072 -0.1208579), wk = 0.0030769 k( 307) = ( 0.5162506 0.0992822 -0.0912340), wk = 0.0030769 k( 308) = ( 0.5130005 0.0986571 -0.0616101), wk = 0.0030769 k( 309) = ( 0.5097504 0.0980321 -0.0319863), wk = 0.0030769 k( 310) = ( 0.5065002 0.0974071 -0.0023624), wk = 0.0030769 k( 311) = ( 0.5032501 0.0967820 0.0272614), wk = 0.0030769 k( 312) = ( 0.5000000 0.0961570 0.0568853), wk = 0.0030769 k( 313) = ( 0.5000000 -1.2518793 -0.7405965), wk = 0.0030769 k( 314) = ( 0.5270843 -1.2438662 -0.7358561), wk = 0.0030769 k( 315) = ( 0.5541687 -1.2358531 -0.7311156), wk = 0.0030769 k( 316) = ( 0.5812530 -1.2278400 -0.7263752), wk = 0.0030769 k( 317) = ( 0.6083373 -1.2198270 -0.7216348), wk = 0.0030769 k( 318) = ( 0.6354216 -1.2118139 -0.7168943), wk = 0.0030769 k( 319) = ( 0.6625060 -1.2038008 -0.7121539), wk = 0.0030769 k( 320) = ( 0.6895903 -1.1957877 -0.7074134), wk = 0.0030769 k( 321) = ( 0.7166746 -1.1877746 -0.7026730), wk = 0.0030769 k( 322) = ( 0.7437590 -1.1797616 -0.6979326), wk = 0.0030769 k( 323) = ( 0.7708433 -1.1717485 -0.6931921), wk = 0.0030769 k( 324) = ( 0.7979276 -1.1637354 -0.6884517), wk = 0.0030769 k( 325) = ( 0.8250119 -1.1557223 -0.6837112), wk = 0.0030769 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 2) = ( 0.0096154 -0.0000000 0.0000000), wk = 0.0030769 k( 3) = ( 0.0192308 -0.0000000 0.0000000), wk = 0.0030769 k( 4) = ( 0.0288462 0.0000000 0.0000000), wk = 0.0030769 k( 5) = ( 0.0384615 -0.0000000 0.0000000), wk = 0.0030769 k( 6) = ( 0.0480769 -0.0000000 0.0000000), wk = 0.0030769 k( 7) = ( 0.0576923 0.0000000 0.0000000), wk = 0.0030769 k( 8) = ( 0.0673077 -0.0000000 -0.0000000), wk = 0.0030769 k( 9) = ( 0.0769231 -0.0000000 0.0000000), wk = 0.0030769 k( 10) = ( 0.0865385 -0.0000000 0.0000000), wk = 0.0030769 k( 11) = ( 0.0961538 -0.0000000 0.0000000), wk = 0.0030769 k( 12) = ( 0.1057692 -0.0000000 0.0000000), wk = 0.0030769 k( 13) = ( 0.1153846 0.0000000 0.0000000), wk = 0.0030769 k( 14) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0030769 k( 15) = ( 0.1346154 -0.0000000 -0.0000000), wk = 0.0030769 k( 16) = ( 0.1442308 0.0000000 -0.0000000), wk = 0.0030769 k( 17) = ( 0.1538461 -0.0000000 0.0000000), wk = 0.0030769 k( 18) = ( 0.1634615 0.0000000 -0.0000000), wk = 0.0030769 k( 19) = ( 0.1730769 -0.0000000 0.0000000), wk = 0.0030769 k( 20) = ( 0.1826923 -0.0000000 -0.0000000), wk = 0.0030769 k( 21) = ( 0.1923077 -0.0000000 0.0000000), wk = 0.0030769 k( 22) = ( 0.2019231 0.0000000 0.0000000), wk = 0.0030769 k( 23) = ( 0.2115385 -0.0000000 0.0000000), wk = 0.0030769 k( 24) = ( 0.2211539 -0.0000000 -0.0000000), wk = 0.0030769 k( 25) = ( 0.2307692 -0.0000000 0.0000000), wk = 0.0030769 k( 26) = ( 0.2403846 0.0000000 0.0000000), wk = 0.0030769 k( 27) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0030769 k( 28) = ( 0.2596154 -0.0000000 0.0000000), wk = 0.0030769 k( 29) = ( 0.2692308 0.0000000 0.0000000), wk = 0.0030769 k( 30) = ( 0.2788462 0.0000000 0.0000000), wk = 0.0030769 k( 31) = ( 0.2884615 0.0000000 -0.0000000), wk = 0.0030769 k( 32) = ( 0.2980769 0.0000000 0.0000000), wk = 0.0030769 k( 33) = ( 0.3076923 0.0000000 0.0000000), wk = 0.0030769 k( 34) = ( 0.3173077 -0.0000000 -0.0000000), wk = 0.0030769 k( 35) = ( 0.3269231 0.0000000 -0.0000000), wk = 0.0030769 k( 36) = ( 0.3365385 -0.0000000 0.0000000), wk = 0.0030769 k( 37) = ( 0.3461538 0.0000000 0.0000000), wk = 0.0030769 k( 38) = ( 0.3557692 -0.0000000 0.0000000), wk = 0.0030769 k( 39) = ( 0.3653846 -0.0000000 -0.0000000), wk = 0.0030769 k( 40) = ( 0.3750000 -0.0000000 0.0000000), wk = 0.0030769 k( 41) = ( 0.3846154 -0.0000000 0.0000000), wk = 0.0030769 k( 42) = ( 0.3942308 -0.0000000 -0.0000000), wk = 0.0030769 k( 43) = ( 0.4038462 -0.0000000 0.0000000), wk = 0.0030769 k( 44) = ( 0.4134615 -0.0000000 0.0000000), wk = 0.0030769 k( 45) = ( 0.4230769 -0.0000000 0.0000000), wk = 0.0030769 k( 46) = ( 0.4326923 -0.0000000 0.0000000), wk = 0.0030769 k( 47) = ( 0.4423077 -0.0000000 0.0000000), wk = 0.0030769 k( 48) = ( 0.4519231 -0.0000000 0.0000000), wk = 0.0030769 k( 49) = ( 0.4615385 -0.0000000 0.0000000), wk = 0.0030769 k( 50) = ( 0.4711538 0.0000000 0.0000000), wk = 0.0030769 k( 51) = ( 0.4807692 -0.0000000 0.0000000), wk = 0.0030769 k( 52) = ( 0.4903846 -0.0000000 0.0000000), wk = 0.0030769 k( 53) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0030769 k( 54) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0030769 k( 55) = ( 0.5000000 0.0056448 -0.0056448), wk = 0.0030769 k( 56) = ( 0.5000000 0.0112896 -0.0112895), wk = 0.0030769 k( 57) = ( 0.5000000 0.0169343 -0.0169343), wk = 0.0030769 k( 58) = ( 0.5000000 0.0225791 -0.0225791), wk = 0.0030769 k( 59) = ( 0.5000000 0.0282239 -0.0282239), wk = 0.0030769 k( 60) = ( 0.5000000 0.0338687 -0.0338687), wk = 0.0030769 k( 61) = ( 0.5000000 0.0395134 -0.0395134), wk = 0.0030769 k( 62) = ( 0.5000000 0.0451582 -0.0451582), wk = 0.0030769 k( 63) = ( 0.5000000 0.0508030 -0.0508030), wk = 0.0030769 k( 64) = ( 0.5000000 0.0564478 -0.0564478), wk = 0.0030769 k( 65) = ( 0.5000000 0.0620925 -0.0620925), wk = 0.0030769 k( 66) = ( 0.5000000 0.0677373 -0.0677373), wk = 0.0030769 k( 67) = ( 0.5000000 0.0733821 -0.0733821), wk = 0.0030769 k( 68) = ( 0.5000000 0.0790269 -0.0790269), wk = 0.0030769 k( 69) = ( 0.5000000 0.0846716 -0.0846716), wk = 0.0030769 k( 70) = ( 0.5000000 0.0903164 -0.0903164), wk = 0.0030769 k( 71) = ( 0.5000000 0.0959612 -0.0959612), wk = 0.0030769 k( 72) = ( 0.5000000 0.1016060 -0.1016060), wk = 0.0030769 k( 73) = ( 0.5000000 0.1072508 -0.1072507), wk = 0.0030769 k( 74) = ( 0.5000000 0.1128955 -0.1128955), wk = 0.0030769 k( 75) = ( 0.5000000 0.1185403 -0.1185403), wk = 0.0030769 k( 76) = ( 0.5000000 0.1241851 -0.1241851), wk = 0.0030769 k( 77) = ( 0.5000000 0.1298299 -0.1298299), wk = 0.0030769 k( 78) = ( 0.5000000 0.1354746 -0.1354746), wk = 0.0030769 k( 79) = ( 0.5000000 0.1411194 -0.1411194), wk = 0.0030769 k( 80) = ( 0.5000000 0.1467642 -0.1467642), wk = 0.0030769 k( 81) = ( 0.5000000 0.1524090 -0.1524090), wk = 0.0030769 k( 82) = ( 0.5000000 0.1580537 -0.1580537), wk = 0.0030769 k( 83) = ( 0.5000000 0.1636985 -0.1636985), wk = 0.0030769 k( 84) = ( 0.5000000 0.1693433 -0.1693433), wk = 0.0030769 k( 85) = ( 0.5000000 0.1749881 -0.1749881), wk = 0.0030769 k( 86) = ( 0.8250119 0.5000000 0.1749881), wk = 0.0030769 k( 87) = ( 0.8194083 0.5000000 0.1805917), wk = 0.0030769 k( 88) = ( 0.8138046 0.5000000 0.1861954), wk = 0.0030769 k( 89) = ( 0.8082010 0.5000000 0.1917990), wk = 0.0030769 k( 90) = ( 0.8025973 0.5000000 0.1974027), wk = 0.0030769 k( 91) = ( 0.7969937 0.5000000 0.2030063), wk = 0.0030769 k( 92) = ( 0.7913900 0.5000000 0.2086100), wk = 0.0030769 k( 93) = ( 0.7857864 0.5000000 0.2142136), wk = 0.0030769 k( 94) = ( 0.7801827 0.5000000 0.2198173), wk = 0.0030769 k( 95) = ( 0.7745791 0.5000000 0.2254210), wk = 0.0030769 k( 96) = ( 0.7689754 0.5000000 0.2310246), wk = 0.0030769 k( 97) = ( 0.7633717 0.5000000 0.2366283), wk = 0.0030769 k( 98) = ( 0.7577681 0.5000000 0.2422319), wk = 0.0030769 k( 99) = ( 0.7521644 0.5000000 0.2478356), wk = 0.0030769 k( 100) = ( 0.7465608 0.5000000 0.2534392), wk = 0.0030769 k( 101) = ( 0.7409571 0.5000000 0.2590429), wk = 0.0030769 k( 102) = ( 0.7353535 0.5000000 0.2646465), wk = 0.0030769 k( 103) = ( 0.7297498 0.5000000 0.2702502), wk = 0.0030769 k( 104) = ( 0.7241462 0.5000000 0.2758538), wk = 0.0030769 k( 105) = ( 0.7185425 0.5000000 0.2814575), wk = 0.0030769 k( 106) = ( 0.7129389 0.5000000 0.2870611), wk = 0.0030769 k( 107) = ( 0.7073352 0.5000000 0.2926648), wk = 0.0030769 k( 108) = ( 0.7017315 0.5000000 0.2982685), wk = 0.0030769 k( 109) = ( 0.6961279 0.5000000 0.3038721), wk = 0.0030769 k( 110) = ( 0.6905242 0.5000000 0.3094758), wk = 0.0030769 k( 111) = ( 0.6849206 0.5000000 0.3150794), wk = 0.0030769 k( 112) = ( 0.6793169 0.5000000 0.3206831), wk = 0.0030769 k( 113) = ( 0.6737133 0.5000000 0.3262867), wk = 0.0030769 k( 114) = ( 0.6681096 0.5000000 0.3318904), wk = 0.0030769 k( 115) = ( 0.6625060 0.5000000 0.3374940), wk = 0.0030769 k( 116) = ( 0.6569023 0.5000000 0.3430977), wk = 0.0030769 k( 117) = ( 0.6512987 0.5000000 0.3487013), wk = 0.0030769 k( 118) = ( 0.6456950 0.5000000 0.3543050), wk = 0.0030769 k( 119) = ( 0.6400913 0.5000000 0.3599087), wk = 0.0030769 k( 120) = ( 0.6344877 0.5000000 0.3655123), wk = 0.0030769 k( 121) = ( 0.6288840 0.5000000 0.3711160), wk = 0.0030769 k( 122) = ( 0.6232804 0.5000000 0.3767196), wk = 0.0030769 k( 123) = ( 0.6176767 0.5000000 0.3823233), wk = 0.0030769 k( 124) = ( 0.6120731 0.5000000 0.3879269), wk = 0.0030769 k( 125) = ( 0.6064694 0.5000000 0.3935306), wk = 0.0030769 k( 126) = ( 0.6008658 0.5000000 0.3991342), wk = 0.0030769 k( 127) = ( 0.5952621 0.5000000 0.4047379), wk = 0.0030769 k( 128) = ( 0.5896585 0.5000000 0.4103415), wk = 0.0030769 k( 129) = ( 0.5840548 0.5000000 0.4159452), wk = 0.0030769 k( 130) = ( 0.5784512 0.5000000 0.4215488), wk = 0.0030769 k( 131) = ( 0.5728475 0.5000000 0.4271525), wk = 0.0030769 k( 132) = ( 0.5672438 0.5000000 0.4327562), wk = 0.0030769 k( 133) = ( 0.5616402 0.5000000 0.4383598), wk = 0.0030769 k( 134) = ( 0.5560365 0.5000000 0.4439635), wk = 0.0030769 k( 135) = ( 0.5504329 0.5000000 0.4495671), wk = 0.0030769 k( 136) = ( 0.5448292 0.5000000 0.4551708), wk = 0.0030769 k( 137) = ( 0.5392256 0.5000000 0.4607744), wk = 0.0030769 k( 138) = ( 0.5336219 0.5000000 0.4663781), wk = 0.0030769 k( 139) = ( 0.5280183 0.5000000 0.4719817), wk = 0.0030769 k( 140) = ( 0.5224146 0.5000000 0.4775854), wk = 0.0030769 k( 141) = ( 0.5168110 0.5000000 0.4831890), wk = 0.0030769 k( 142) = ( 0.5112073 0.5000000 0.4887927), wk = 0.0030769 k( 143) = ( 0.5056036 0.5000000 0.4943964), wk = 0.0030769 k( 144) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 145) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 146) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0030769 k( 147) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0030769 k( 148) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0030769 k( 149) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0030769 k( 150) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0030769 k( 151) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0030769 k( 152) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0030769 k( 153) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0030769 k( 154) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0030769 k( 155) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0030769 k( 156) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0030769 k( 157) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0030769 k( 158) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0030769 k( 159) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0030769 k( 160) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0030769 k( 161) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0030769 k( 162) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0030769 k( 163) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 164) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030769 k( 165) = ( 0.0056249 0.0000000 -0.0056249), wk = 0.0030769 k( 166) = ( 0.0112498 0.0000000 -0.0112498), wk = 0.0030769 k( 167) = ( 0.0168747 -0.0000000 -0.0168747), wk = 0.0030769 k( 168) = ( 0.0224996 0.0000000 -0.0224996), wk = 0.0030769 k( 169) = ( 0.0281245 -0.0000000 -0.0281245), wk = 0.0030769 k( 170) = ( 0.0337494 -0.0000000 -0.0337494), wk = 0.0030769 k( 171) = ( 0.0393743 0.0000000 -0.0393743), wk = 0.0030769 k( 172) = ( 0.0449992 0.0000000 -0.0449992), wk = 0.0030769 k( 173) = ( 0.0506241 0.0000000 -0.0506241), wk = 0.0030769 k( 174) = ( 0.0562490 0.0000000 -0.0562490), wk = 0.0030769 k( 175) = ( 0.0618739 -0.0000000 -0.0618739), wk = 0.0030769 k( 176) = ( 0.0674988 0.0000000 -0.0674988), wk = 0.0030769 k( 177) = ( 0.0731237 0.0000000 -0.0731237), wk = 0.0030769 k( 178) = ( 0.0787486 -0.0000000 -0.0787486), wk = 0.0030769 k( 179) = ( 0.0843735 0.0000000 -0.0843735), wk = 0.0030769 k( 180) = ( 0.0899984 -0.0000000 -0.0899984), wk = 0.0030769 k( 181) = ( 0.0956233 0.0000000 -0.0956233), wk = 0.0030769 k( 182) = ( 0.1012482 0.0000000 -0.1012482), wk = 0.0030769 k( 183) = ( 0.1068731 -0.0000000 -0.1068731), wk = 0.0030769 k( 184) = ( 0.1124980 -0.0000000 -0.1124980), wk = 0.0030769 k( 185) = ( 0.1181229 -0.0000000 -0.1181229), wk = 0.0030769 k( 186) = ( 0.1237478 0.0000000 -0.1237478), wk = 0.0030769 k( 187) = ( 0.1293727 -0.0000000 -0.1293727), wk = 0.0030769 k( 188) = ( 0.1349976 0.0000000 -0.1349976), wk = 0.0030769 k( 189) = ( 0.1406225 -0.0000000 -0.1406225), wk = 0.0030769 k( 190) = ( 0.1462474 -0.0000000 -0.1462474), wk = 0.0030769 k( 191) = ( 0.1518723 -0.0000000 -0.1518723), wk = 0.0030769 k( 192) = ( 0.1574972 -0.0000000 -0.1574972), wk = 0.0030769 k( 193) = ( 0.1631221 -0.0000000 -0.1631221), wk = 0.0030769 k( 194) = ( 0.1687470 0.0000000 -0.1687470), wk = 0.0030769 k( 195) = ( 0.1743719 -0.0000000 -0.1743719), wk = 0.0030769 k( 196) = ( 0.1799968 -0.0000000 -0.1799968), wk = 0.0030769 k( 197) = ( 0.1856217 -0.0000000 -0.1856217), wk = 0.0030769 k( 198) = ( 0.1912466 0.0000000 -0.1912466), wk = 0.0030769 k( 199) = ( 0.1968715 -0.0000000 -0.1968715), wk = 0.0030769 k( 200) = ( 0.2024964 0.0000000 -0.2024964), wk = 0.0030769 k( 201) = ( 0.2081213 0.0000000 -0.2081213), wk = 0.0030769 k( 202) = ( 0.2137462 -0.0000000 -0.2137462), wk = 0.0030769 k( 203) = ( 0.2193711 -0.0000000 -0.2193711), wk = 0.0030769 k( 204) = ( 0.2249960 -0.0000000 -0.2249960), wk = 0.0030769 k( 205) = ( 0.2306209 -0.0000000 -0.2306209), wk = 0.0030769 k( 206) = ( 0.2362458 -0.0000000 -0.2362458), wk = 0.0030769 k( 207) = ( 0.2418707 0.0000000 -0.2418707), wk = 0.0030769 k( 208) = ( 0.2474956 0.0000000 -0.2474956), wk = 0.0030769 k( 209) = ( 0.2531205 -0.0000000 -0.2531205), wk = 0.0030769 k( 210) = ( 0.2587454 0.0000000 -0.2587454), wk = 0.0030769 k( 211) = ( 0.2643703 -0.0000000 -0.2643703), wk = 0.0030769 k( 212) = ( 0.2699952 -0.0000000 -0.2699952), wk = 0.0030769 k( 213) = ( 0.2756201 0.0000000 -0.2756201), wk = 0.0030769 k( 214) = ( 0.2812450 0.0000000 -0.2812450), wk = 0.0030769 k( 215) = ( 0.2868699 0.0000000 -0.2868699), wk = 0.0030769 k( 216) = ( 0.2924948 0.0000000 -0.2924948), wk = 0.0030769 k( 217) = ( 0.2981197 -0.0000000 -0.2981197), wk = 0.0030769 k( 218) = ( 0.3037446 -0.0000000 -0.3037446), wk = 0.0030769 k( 219) = ( 0.3093695 -0.0000000 -0.3093695), wk = 0.0030769 k( 220) = ( 0.3149944 -0.0000000 -0.3149944), wk = 0.0030769 k( 221) = ( 0.3206193 -0.0000000 -0.3206193), wk = 0.0030769 k( 222) = ( 0.3262442 0.0000000 -0.3262442), wk = 0.0030769 k( 223) = ( 0.3318691 0.0000000 -0.3318691), wk = 0.0030769 k( 224) = ( 0.3374940 -0.0000000 -0.3374940), wk = 0.0030769 k( 225) = ( 0.6625060 0.3374940 0.0000000), wk = 0.0030769 k( 226) = ( 0.6569023 0.3430977 0.0000000), wk = 0.0030769 k( 227) = ( 0.6512987 0.3487013 0.0000000), wk = 0.0030769 k( 228) = ( 0.6456950 0.3543050 0.0000000), wk = 0.0030769 k( 229) = ( 0.6400913 0.3599086 -0.0000000), wk = 0.0030769 k( 230) = ( 0.6344877 0.3655123 0.0000000), wk = 0.0030769 k( 231) = ( 0.6288840 0.3711160 0.0000000), wk = 0.0030769 k( 232) = ( 0.6232804 0.3767196 0.0000000), wk = 0.0030769 k( 233) = ( 0.6176767 0.3823233 0.0000000), wk = 0.0030769 k( 234) = ( 0.6120731 0.3879269 0.0000000), wk = 0.0030769 k( 235) = ( 0.6064694 0.3935306 0.0000000), wk = 0.0030769 k( 236) = ( 0.6008658 0.3991342 -0.0000000), wk = 0.0030769 k( 237) = ( 0.5952621 0.4047379 -0.0000000), wk = 0.0030769 k( 238) = ( 0.5896585 0.4103415 0.0000000), wk = 0.0030769 k( 239) = ( 0.5840548 0.4159452 0.0000000), wk = 0.0030769 k( 240) = ( 0.5784512 0.4215488 0.0000000), wk = 0.0030769 k( 241) = ( 0.5728475 0.4271525 0.0000000), wk = 0.0030769 k( 242) = ( 0.5672438 0.4327562 0.0000000), wk = 0.0030769 k( 243) = ( 0.5616402 0.4383598 -0.0000000), wk = 0.0030769 k( 244) = ( 0.5560365 0.4439635 0.0000000), wk = 0.0030769 k( 245) = ( 0.5504329 0.4495671 0.0000000), wk = 0.0030769 k( 246) = ( 0.5448292 0.4551708 0.0000000), wk = 0.0030769 k( 247) = ( 0.5392256 0.4607744 -0.0000000), wk = 0.0030769 k( 248) = ( 0.5336219 0.4663781 0.0000000), wk = 0.0030769 k( 249) = ( 0.5280183 0.4719817 -0.0000000), wk = 0.0030769 k( 250) = ( 0.5224146 0.4775854 0.0000000), wk = 0.0030769 k( 251) = ( 0.5168110 0.4831890 0.0000000), wk = 0.0030769 k( 252) = ( 0.5112073 0.4887927 -0.0000000), wk = 0.0030769 k( 253) = ( 0.5056036 0.4943963 -0.0000000), wk = 0.0030769 k( 254) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030769 k( 255) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0030769 k( 256) = ( 0.5270843 0.5270843 0.0291647), wk = 0.0030769 k( 257) = ( 0.5541687 0.5541687 0.0583294), wk = 0.0030769 k( 258) = ( 0.5812530 0.5812530 0.0874940), wk = 0.0030769 k( 259) = ( 0.6083373 0.6083373 0.1166587), wk = 0.0030769 k( 260) = ( 0.6354216 0.6354216 0.1458234), wk = 0.0030769 k( 261) = ( 0.6625060 0.6625060 0.1749881), wk = 0.0030769 k( 262) = ( 0.6625060 0.6625060 0.1749881), wk = 0.0030769 k( 263) = ( 0.6592558 0.6592558 0.1814883), wk = 0.0030769 k( 264) = ( 0.6560057 0.6560057 0.1879885), wk = 0.0030769 k( 265) = ( 0.6527556 0.6527556 0.1944888), wk = 0.0030769 k( 266) = ( 0.6495055 0.6495055 0.2009890), wk = 0.0030769 k( 267) = ( 0.6462554 0.6462554 0.2074893), wk = 0.0030769 k( 268) = ( 0.6430052 0.6430052 0.2139895), wk = 0.0030769 k( 269) = ( 0.6397551 0.6397551 0.2204897), wk = 0.0030769 k( 270) = ( 0.6365050 0.6365050 0.2269900), wk = 0.0030769 k( 271) = ( 0.6332549 0.6332549 0.2334902), wk = 0.0030769 k( 272) = ( 0.6300048 0.6300048 0.2399905), wk = 0.0030769 k( 273) = ( 0.6267546 0.6267546 0.2464907), wk = 0.0030769 k( 274) = ( 0.6235045 0.6235045 0.2529909), wk = 0.0030769 k( 275) = ( 0.6202544 0.6202544 0.2594912), wk = 0.0030769 k( 276) = ( 0.6170043 0.6170043 0.2659914), wk = 0.0030769 k( 277) = ( 0.6137542 0.6137542 0.2724916), wk = 0.0030769 k( 278) = ( 0.6105041 0.6105041 0.2789919), wk = 0.0030769 k( 279) = ( 0.6072539 0.6072539 0.2854921), wk = 0.0030769 k( 280) = ( 0.6040038 0.6040038 0.2919924), wk = 0.0030769 k( 281) = ( 0.6007537 0.6007537 0.2984926), wk = 0.0030769 k( 282) = ( 0.5975036 0.5975036 0.3049928), wk = 0.0030769 k( 283) = ( 0.5942535 0.5942535 0.3114931), wk = 0.0030769 k( 284) = ( 0.5910033 0.5910033 0.3179933), wk = 0.0030769 k( 285) = ( 0.5877532 0.5877532 0.3244936), wk = 0.0030769 k( 286) = ( 0.5845031 0.5845031 0.3309938), wk = 0.0030769 k( 287) = ( 0.5812530 0.5812530 0.3374940), wk = 0.0030769 k( 288) = ( 0.5780029 0.5780029 0.3439943), wk = 0.0030769 k( 289) = ( 0.5747527 0.5747527 0.3504945), wk = 0.0030769 k( 290) = ( 0.5715026 0.5715026 0.3569947), wk = 0.0030769 k( 291) = ( 0.5682525 0.5682525 0.3634950), wk = 0.0030769 k( 292) = ( 0.5650024 0.5650024 0.3699952), wk = 0.0030769 k( 293) = ( 0.5617523 0.5617523 0.3764955), wk = 0.0030769 k( 294) = ( 0.5585022 0.5585021 0.3829957), wk = 0.0030769 k( 295) = ( 0.5552520 0.5552520 0.3894959), wk = 0.0030769 k( 296) = ( 0.5520019 0.5520019 0.3959962), wk = 0.0030769 k( 297) = ( 0.5487518 0.5487518 0.4024964), wk = 0.0030769 k( 298) = ( 0.5455017 0.5455017 0.4089967), wk = 0.0030769 k( 299) = ( 0.5422516 0.5422515 0.4154969), wk = 0.0030769 k( 300) = ( 0.5390014 0.5390014 0.4219971), wk = 0.0030769 k( 301) = ( 0.5357513 0.5357513 0.4284974), wk = 0.0030769 k( 302) = ( 0.5325012 0.5325012 0.4349976), wk = 0.0030769 k( 303) = ( 0.5292511 0.5292511 0.4414978), wk = 0.0030769 k( 304) = ( 0.5260010 0.5260010 0.4479981), wk = 0.0030769 k( 305) = ( 0.5227508 0.5227508 0.4544983), wk = 0.0030769 k( 306) = ( 0.5195007 0.5195007 0.4609986), wk = 0.0030769 k( 307) = ( 0.5162506 0.5162506 0.4674988), wk = 0.0030769 k( 308) = ( 0.5130005 0.5130005 0.4739991), wk = 0.0030769 k( 309) = ( 0.5097504 0.5097504 0.4804993), wk = 0.0030769 k( 310) = ( 0.5065002 0.5065002 0.4869995), wk = 0.0030769 k( 311) = ( 0.5032501 0.5032501 0.4934998), wk = 0.0030769 k( 312) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0030769 k( 313) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0030769 k( 314) = ( 0.5270843 0.0281245 0.0281245), wk = 0.0030769 k( 315) = ( 0.5541687 0.0562490 0.0562490), wk = 0.0030769 k( 316) = ( 0.5812530 0.0843735 0.0843735), wk = 0.0030769 k( 317) = ( 0.6083373 0.1124980 0.1124980), wk = 0.0030769 k( 318) = ( 0.6354216 0.1406225 0.1406225), wk = 0.0030769 k( 319) = ( 0.6625060 0.1687470 0.1687470), wk = 0.0030769 k( 320) = ( 0.6895903 0.1968715 0.1968715), wk = 0.0030769 k( 321) = ( 0.7166746 0.2249960 0.2249960), wk = 0.0030769 k( 322) = ( 0.7437590 0.2531205 0.2531205), wk = 0.0030769 k( 323) = ( 0.7708433 0.2812450 0.2812450), wk = 0.0030769 k( 324) = ( 0.7979276 0.3093695 0.3093695), wk = 0.0030769 k( 325) = ( 0.8250119 0.3374940 0.3374940), wk = 0.0030769 Dense grid: 66861 G-vectors FFT dimensions: ( 108, 108, 108) Smooth grid: 30929 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 218, 58) NL pseudopotentials 0.27 Mb ( 109, 164) Each V/rho on FFT grid 0.53 Mb ( 34992) Each G-vector array 0.01 Mb ( 1858) G-vector shells 0.01 Mb ( 1527) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.77 Mb ( 218, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.29 Mb ( 164, 2, 58) The potential is recalculated from file : ./HfNCl.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.0 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 7.6 secs Computing kpt #: 4 total cpu time spent up to now is 8.9 secs Computing kpt #: 5 total cpu time spent up to now is 10.2 secs Computing kpt #: 6 total cpu time spent up to now is 11.6 secs Computing kpt #: 7 total cpu time spent up to now is 12.9 secs Computing kpt #: 8 total cpu time spent up to now is 14.2 secs Computing kpt #: 9 total cpu time spent up to now is 15.6 secs Computing kpt #: 10 total cpu time spent up to now is 16.9 secs Computing kpt #: 11 total cpu time spent up to now is 18.3 secs Computing kpt #: 12 total cpu time spent up to now is 19.7 secs Computing kpt #: 13 total cpu time spent up to now is 21.0 secs Computing kpt #: 14 total cpu time spent up to now is 22.6 secs Computing kpt #: 15 total cpu time spent up to now is 24.2 secs Computing kpt #: 16 total cpu time spent up to now is 25.8 secs Computing kpt #: 17 total cpu time spent up to now is 27.4 secs Computing kpt #: 18 total cpu time spent up to now is 28.9 secs Computing kpt #: 19 total cpu time spent up to now is 30.5 secs Computing kpt #: 20 total cpu time spent up to now is 32.1 secs Computing kpt #: 21 total cpu time spent up to now is 33.6 secs Computing kpt #: 22 total cpu time spent up to now is 35.2 secs Computing kpt #: 23 total cpu time spent up to now is 36.7 secs Computing kpt #: 24 total cpu time spent up to now is 38.3 secs Computing kpt #: 25 total cpu time spent up to now is 39.6 secs Computing kpt #: 26 total cpu time spent up to now is 41.0 secs Computing kpt #: 27 total cpu time spent up to now is 42.3 secs Computing kpt #: 28 total cpu time spent up to now is 43.7 secs Computing kpt #: 29 total cpu time spent up to now is 45.0 secs Computing kpt #: 30 total cpu time spent up to now is 46.3 secs Computing kpt #: 31 total cpu time spent up to now is 47.7 secs Computing kpt #: 32 total cpu time spent up to now is 49.2 secs Computing kpt #: 33 total cpu time spent up to now is 50.5 secs Computing kpt #: 34 total cpu time spent up to now is 51.9 secs Computing kpt #: 35 total cpu time spent up to now is 53.2 secs Computing kpt #: 36 total cpu time spent up to now is 54.6 secs Computing kpt #: 37 total cpu time spent up to now is 56.0 secs Computing kpt #: 38 total cpu time spent up to now is 57.4 secs Computing kpt #: 39 total cpu time spent up to now is 58.8 secs Computing kpt #: 40 total cpu time spent up to now is 60.2 secs Computing kpt #: 41 total cpu time spent up to now is 61.5 secs Computing kpt #: 42 total cpu time spent up to now is 62.9 secs Computing kpt #: 43 total cpu time spent up to now is 64.3 secs Computing kpt #: 44 total cpu time spent up to now is 65.7 secs Computing kpt #: 45 total cpu time spent up to now is 67.1 secs Computing kpt #: 46 total cpu time spent up to now is 68.5 secs Computing kpt #: 47 total cpu time spent up to now is 69.9 secs Computing kpt #: 48 total cpu time spent up to now is 71.3 secs Computing kpt #: 49 total cpu time spent up to now is 72.7 secs Computing kpt #: 50 total cpu time spent up to now is 74.1 secs Computing kpt #: 51 total cpu time spent up to now is 75.5 secs Computing kpt #: 52 total cpu time spent up to now is 76.9 secs Computing kpt #: 53 total cpu time spent up to now is 78.2 secs Computing kpt #: 54 total cpu time spent up to now is 79.6 secs Computing kpt #: 55 total cpu time spent up to now is 81.0 secs Computing kpt #: 56 total cpu time spent up to now is 82.4 secs Computing kpt #: 57 total cpu time spent up to now is 83.8 secs Computing kpt #: 58 total cpu time spent up to now is 85.2 secs Computing kpt #: 59 total cpu time spent up to now is 86.6 secs Computing kpt #: 60 total cpu time spent up to now is 87.9 secs Computing kpt #: 61 total cpu time spent up to now is 89.3 secs Computing kpt #: 62 total cpu time spent up to now is 90.7 secs Computing kpt #: 63 total cpu time spent up to now is 92.1 secs Computing kpt #: 64 total cpu time spent up to now is 93.5 secs Computing kpt #: 65 total cpu time spent up to now is 94.9 secs Computing kpt #: 66 total cpu time spent up to now is 96.3 secs Computing kpt #: 67 total cpu time spent up to now is 97.7 secs Computing kpt #: 68 total cpu time spent up to now is 99.1 secs Computing kpt #: 69 total cpu time spent up to now is 100.5 secs Computing kpt #: 70 total cpu time spent up to now is 101.9 secs Computing kpt #: 71 total cpu time spent up to now is 103.3 secs Computing kpt #: 72 total cpu time spent up to now is 104.7 secs Computing kpt #: 73 total cpu time spent up to now is 106.1 secs Computing kpt #: 74 total cpu time spent up to now is 107.5 secs Computing kpt #: 75 total cpu time spent up to now is 108.9 secs Computing kpt #: 76 total cpu time spent up to now is 110.3 secs Computing kpt #: 77 total cpu time spent up to now is 111.9 secs Computing kpt #: 78 total cpu time spent up to now is 113.5 secs Computing kpt #: 79 total cpu time spent up to now is 114.9 secs Computing kpt #: 80 total cpu time spent up to now is 116.3 secs Computing kpt #: 81 total cpu time spent up to now is 117.8 secs Computing kpt #: 82 total cpu time spent up to now is 119.2 secs Computing kpt #: 83 total cpu time spent up to now is 120.6 secs Computing kpt #: 84 total cpu time spent up to now is 122.0 secs Computing kpt #: 85 total cpu time spent up to now is 123.4 secs Computing kpt #: 86 total cpu time spent up to now is 124.8 secs Computing kpt #: 87 total cpu time spent up to now is 126.3 secs Computing kpt #: 88 total cpu time spent up to now is 127.7 secs Computing kpt #: 89 total cpu time spent up to now is 129.1 secs Computing kpt #: 90 total cpu time spent up to now is 130.5 secs Computing kpt #: 91 total cpu time spent up to now is 131.9 secs Computing kpt #: 92 total cpu time spent up to now is 133.3 secs Computing kpt #: 93 total cpu time spent up to now is 134.7 secs Computing kpt #: 94 total cpu time spent up to now is 136.1 secs Computing kpt #: 95 total cpu time spent up to now is 137.5 secs Computing kpt #: 96 total cpu time spent up to now is 138.9 secs Computing kpt #: 97 total cpu time spent up to now is 140.3 secs Computing kpt #: 98 total cpu time spent up to now is 141.8 secs Computing kpt #: 99 total cpu time spent up to now is 143.2 secs Computing kpt #: 100 total cpu time spent up to now is 144.6 secs Computing kpt #: 101 total cpu time spent up to now is 145.9 secs Computing kpt #: 102 total cpu time spent up to now is 147.2 secs Computing kpt #: 103 total cpu time spent up to now is 148.6 secs Computing kpt #: 104 total cpu time spent up to now is 150.0 secs Computing kpt #: 105 total cpu time spent up to now is 151.3 secs Computing kpt #: 106 total cpu time spent up to now is 152.7 secs Computing kpt #: 107 total cpu time spent up to now is 154.1 secs Computing kpt #: 108 total cpu time spent up to now is 155.5 secs Computing kpt #: 109 total cpu time spent up to now is 156.9 secs Computing kpt #: 110 total cpu time spent up to now is 158.3 secs Computing kpt #: 111 total cpu time spent up to now is 159.7 secs Computing kpt #: 112 total cpu time spent up to now is 161.3 secs Computing kpt #: 113 total cpu time spent up to now is 162.9 secs Computing kpt #: 114 total cpu time spent up to now is 164.5 secs Computing kpt #: 115 total cpu time spent up to now is 166.0 secs Computing kpt #: 116 total cpu time spent up to now is 167.6 secs Computing kpt #: 117 total cpu time spent up to now is 169.2 secs Computing kpt #: 118 total cpu time spent up to now is 170.6 secs Computing kpt #: 119 total cpu time spent up to now is 171.9 secs Computing kpt #: 120 total cpu time spent up to now is 173.3 secs Computing kpt #: 121 total cpu time spent up to now is 174.8 secs Computing kpt #: 122 total cpu time spent up to now is 176.3 secs Computing kpt #: 123 total cpu time spent up to now is 177.9 secs Computing kpt #: 124 total cpu time spent up to now is 179.4 secs Computing kpt #: 125 total cpu time spent up to now is 181.0 secs Computing kpt #: 126 total cpu time spent up to now is 182.6 secs Computing kpt #: 127 total cpu time spent up to now is 184.1 secs Computing kpt #: 128 total cpu time spent up to now is 185.7 secs Computing kpt #: 129 total cpu time spent up to now is 187.3 secs Computing kpt #: 130 total cpu time spent up to now is 188.9 secs Computing kpt #: 131 total cpu time spent up to now is 190.5 secs Computing kpt #: 132 total cpu time spent up to now is 192.0 secs Computing kpt #: 133 total cpu time spent up to now is 193.4 secs Computing kpt #: 134 total cpu time spent up to now is 194.8 secs Computing kpt #: 135 total cpu time spent up to now is 196.1 secs Computing kpt #: 136 total cpu time spent up to now is 197.5 secs Computing kpt #: 137 total cpu time spent up to now is 198.8 secs Computing kpt #: 138 total cpu time spent up to now is 200.1 secs Computing kpt #: 139 total cpu time spent up to now is 201.4 secs Computing kpt #: 140 total cpu time spent up to now is 202.8 secs Computing kpt #: 141 total cpu time spent up to now is 204.1 secs Computing kpt #: 142 total cpu time spent up to now is 205.4 secs Computing kpt #: 143 total cpu time spent up to now is 206.6 secs Computing kpt #: 144 total cpu time spent up to now is 207.9 secs Computing kpt #: 145 total cpu time spent up to now is 209.2 secs Computing kpt #: 146 total cpu time spent up to now is 210.4 secs Computing kpt #: 147 total cpu time spent up to now is 211.7 secs Computing kpt #: 148 total cpu time spent up to now is 213.0 secs Computing kpt #: 149 total cpu time spent up to now is 214.3 secs Computing kpt #: 150 total cpu time spent up to now is 215.6 secs Computing kpt #: 151 total cpu time spent up to now is 216.9 secs Computing kpt #: 152 total cpu time spent up to now is 218.2 secs Computing kpt #: 153 total cpu time spent up to now is 219.5 secs Computing kpt #: 154 total cpu time spent up to now is 220.8 secs Computing kpt #: 155 total cpu time spent up to now is 222.1 secs Computing kpt #: 156 total cpu time spent up to now is 223.3 secs Computing kpt #: 157 total cpu time spent up to now is 224.6 secs Computing kpt #: 158 total cpu time spent up to now is 225.9 secs Computing kpt #: 159 total cpu time spent up to now is 227.2 secs Computing kpt #: 160 total cpu time spent up to now is 228.5 secs Computing kpt #: 161 total cpu time spent up to now is 229.8 secs Computing kpt #: 162 total cpu time spent up to now is 231.1 secs Computing kpt #: 163 total cpu time spent up to now is 232.3 secs Computing kpt #: 164 total cpu time spent up to now is 233.6 secs Computing kpt #: 165 total cpu time spent up to now is 235.0 secs Computing kpt #: 166 total cpu time spent up to now is 236.3 secs Computing kpt #: 167 total cpu time spent up to now is 237.6 secs Computing kpt #: 168 total cpu time spent up to now is 238.9 secs Computing kpt #: 169 total cpu time spent up to now is 240.2 secs Computing kpt #: 170 total cpu time spent up to now is 241.6 secs Computing kpt #: 171 total cpu time spent up to now is 242.9 secs Computing kpt #: 172 total cpu time spent up to now is 244.2 secs Computing kpt #: 173 total cpu time spent up to now is 245.6 secs Computing kpt #: 174 total cpu time spent up to now is 247.0 secs Computing kpt #: 175 total cpu time spent up to now is 248.3 secs Computing kpt #: 176 total cpu time spent up to now is 249.7 secs Computing kpt #: 177 total cpu time spent up to now is 251.0 secs Computing kpt #: 178 total cpu time spent up to now is 252.4 secs Computing kpt #: 179 total cpu time spent up to now is 253.8 secs Computing kpt #: 180 total cpu time spent up to now is 255.4 secs Computing kpt #: 181 total cpu time spent up to now is 256.9 secs Computing kpt #: 182 total cpu time spent up to now is 258.5 secs Computing kpt #: 183 total cpu time spent up to now is 260.1 secs Computing kpt #: 184 total cpu time spent up to now is 261.7 secs Computing kpt #: 185 total cpu time spent up to now is 263.2 secs Computing kpt #: 186 total cpu time spent up to now is 264.8 secs Computing kpt #: 187 total cpu time spent up to now is 266.3 secs Computing kpt #: 188 total cpu time spent up to now is 267.9 secs Computing kpt #: 189 total cpu time spent up to now is 269.4 secs Computing kpt #: 190 total cpu time spent up to now is 271.0 secs Computing kpt #: 191 total cpu time spent up to now is 272.6 secs Computing kpt #: 192 total cpu time spent up to now is 274.1 secs Computing kpt #: 193 total cpu time spent up to now is 275.5 secs Computing kpt #: 194 total cpu time spent up to now is 276.7 secs Computing kpt #: 195 total cpu time spent up to now is 278.1 secs Computing kpt #: 196 total cpu time spent up to now is 279.4 secs Computing kpt #: 197 total cpu time spent up to now is 280.7 secs Computing kpt #: 198 total cpu time spent up to now is 282.0 secs Computing kpt #: 199 total cpu time spent up to now is 283.3 secs Computing kpt #: 200 total cpu time spent up to now is 284.6 secs Computing kpt #: 201 total cpu time spent up to now is 285.9 secs Computing kpt #: 202 total cpu time spent up to now is 287.2 secs Computing kpt #: 203 total cpu time spent up to now is 288.5 secs Computing kpt #: 204 total cpu time spent up to now is 289.9 secs Computing kpt #: 205 total cpu time spent up to now is 291.2 secs Computing kpt #: 206 total cpu time spent up to now is 292.5 secs Computing kpt #: 207 total cpu time spent up to now is 293.8 secs Computing kpt #: 208 total cpu time spent up to now is 295.2 secs Computing kpt #: 209 total cpu time spent up to now is 296.5 secs Computing kpt #: 210 total cpu time spent up to now is 297.9 secs Computing kpt #: 211 total cpu time spent up to now is 299.2 secs Computing kpt #: 212 total cpu time spent up to now is 300.6 secs Computing kpt #: 213 total cpu time spent up to now is 301.9 secs Computing kpt #: 214 total cpu time spent up to now is 303.3 secs Computing kpt #: 215 total cpu time spent up to now is 304.7 secs Computing kpt #: 216 total cpu time spent up to now is 306.1 secs Computing kpt #: 217 total cpu time spent up to now is 307.5 secs Computing kpt #: 218 total cpu time spent up to now is 308.9 secs Computing kpt #: 219 total cpu time spent up to now is 310.3 secs Computing kpt #: 220 total cpu time spent up to now is 311.7 secs Computing kpt #: 221 total cpu time spent up to now is 313.1 secs Computing kpt #: 222 total cpu time spent up to now is 314.5 secs Computing kpt #: 223 total cpu time spent up to now is 315.9 secs Computing kpt #: 224 total cpu time spent up to now is 317.3 secs Computing kpt #: 225 total cpu time spent up to now is 318.8 secs Computing kpt #: 226 total cpu time spent up to now is 320.4 secs Computing kpt #: 227 total cpu time spent up to now is 321.8 secs Computing kpt #: 228 total cpu time spent up to now is 323.2 secs Computing kpt #: 229 total cpu time spent up to now is 324.6 secs Computing kpt #: 230 total cpu time spent up to now is 326.0 secs Computing kpt #: 231 total cpu time spent up to now is 327.4 secs Computing kpt #: 232 total cpu time spent up to now is 328.8 secs Computing kpt #: 233 total cpu time spent up to now is 330.2 secs Computing kpt #: 234 total cpu time spent up to now is 331.6 secs Computing kpt #: 235 total cpu time spent up to now is 333.1 secs Computing kpt #: 236 total cpu time spent up to now is 334.5 secs Computing kpt #: 237 total cpu time spent up to now is 335.9 secs Computing kpt #: 238 total cpu time spent up to now is 337.3 secs Computing kpt #: 239 total cpu time spent up to now is 338.7 secs Computing kpt #: 240 total cpu time spent up to now is 340.0 secs Computing kpt #: 241 total cpu time spent up to now is 341.4 secs Computing kpt #: 242 total cpu time spent up to now is 342.8 secs Computing kpt #: 243 total cpu time spent up to now is 344.2 secs Computing kpt #: 244 total cpu time spent up to now is 345.5 secs Computing kpt #: 245 total cpu time spent up to now is 346.9 secs Computing kpt #: 246 total cpu time spent up to now is 348.2 secs Computing kpt #: 247 total cpu time spent up to now is 349.6 secs Computing kpt #: 248 total cpu time spent up to now is 350.9 secs Computing kpt #: 249 total cpu time spent up to now is 352.3 secs Computing kpt #: 250 total cpu time spent up to now is 353.6 secs Computing kpt #: 251 total cpu time spent up to now is 355.0 secs Computing kpt #: 252 total cpu time spent up to now is 356.4 secs Computing kpt #: 253 total cpu time spent up to now is 357.7 secs Computing kpt #: 254 total cpu time spent up to now is 359.1 secs Computing kpt #: 255 total cpu time spent up to now is 360.4 secs Computing kpt #: 256 total cpu time spent up to now is 361.8 secs Computing kpt #: 257 total cpu time spent up to now is 363.1 secs Computing kpt #: 258 total cpu time spent up to now is 364.5 secs Computing kpt #: 259 total cpu time spent up to now is 365.9 secs Computing kpt #: 260 total cpu time spent up to now is 367.2 secs Computing kpt #: 261 total cpu time spent up to now is 368.6 secs Computing kpt #: 262 total cpu time spent up to now is 370.0 secs Computing kpt #: 263 total cpu time spent up to now is 371.3 secs Computing kpt #: 264 total cpu time spent up to now is 372.7 secs Computing kpt #: 265 total cpu time spent up to now is 374.1 secs Computing kpt #: 266 total cpu time spent up to now is 375.6 secs Computing kpt #: 267 total cpu time spent up to now is 377.0 secs Computing kpt #: 268 total cpu time spent up to now is 378.4 secs Computing kpt #: 269 total cpu time spent up to now is 379.8 secs Computing kpt #: 270 total cpu time spent up to now is 381.2 secs Computing kpt #: 271 total cpu time spent up to now is 382.6 secs Computing kpt #: 272 total cpu time spent up to now is 384.0 secs Computing kpt #: 273 total cpu time spent up to now is 385.4 secs Computing kpt #: 274 total cpu time spent up to now is 386.8 secs Computing kpt #: 275 total cpu time spent up to now is 388.2 secs Computing kpt #: 276 total cpu time spent up to now is 389.6 secs Computing kpt #: 277 total cpu time spent up to now is 391.0 secs Computing kpt #: 278 total cpu time spent up to now is 392.6 secs Computing kpt #: 279 total cpu time spent up to now is 394.2 secs Computing kpt #: 280 total cpu time spent up to now is 395.8 secs Computing kpt #: 281 total cpu time spent up to now is 397.4 secs Computing kpt #: 282 total cpu time spent up to now is 399.0 secs Computing kpt #: 283 total cpu time spent up to now is 400.6 secs Computing kpt #: 284 total cpu time spent up to now is 402.2 secs Computing kpt #: 285 total cpu time spent up to now is 403.6 secs Computing kpt #: 286 total cpu time spent up to now is 404.9 secs Computing kpt #: 287 total cpu time spent up to now is 406.3 secs Computing kpt #: 288 total cpu time spent up to now is 407.6 secs Computing kpt #: 289 total cpu time spent up to now is 409.1 secs Computing kpt #: 290 total cpu time spent up to now is 410.7 secs Computing kpt #: 291 total cpu time spent up to now is 412.8 secs Computing kpt #: 292 total cpu time spent up to now is 414.4 secs Computing kpt #: 293 total cpu time spent up to now is 416.0 secs Computing kpt #: 294 total cpu time spent up to now is 417.6 secs Computing kpt #: 295 total cpu time spent up to now is 419.2 secs Computing kpt #: 296 total cpu time spent up to now is 420.8 secs Computing kpt #: 297 total cpu time spent up to now is 422.3 secs Computing kpt #: 298 total cpu time spent up to now is 423.9 secs Computing kpt #: 299 total cpu time spent up to now is 425.3 secs Computing kpt #: 300 total cpu time spent up to now is 426.7 secs Computing kpt #: 301 total cpu time spent up to now is 428.0 secs Computing kpt #: 302 total cpu time spent up to now is 429.4 secs Computing kpt #: 303 total cpu time spent up to now is 430.8 secs Computing kpt #: 304 total cpu time spent up to now is 432.1 secs Computing kpt #: 305 total cpu time spent up to now is 433.4 secs Computing kpt #: 306 total cpu time spent up to now is 434.7 secs Computing kpt #: 307 total cpu time spent up to now is 436.0 secs Computing kpt #: 308 total cpu time spent up to now is 437.3 secs Computing kpt #: 309 total cpu time spent up to now is 438.6 secs Computing kpt #: 310 total cpu time spent up to now is 439.9 secs Computing kpt #: 311 total cpu time spent up to now is 441.2 secs Computing kpt #: 312 total cpu time spent up to now is 442.5 secs Computing kpt #: 313 total cpu time spent up to now is 443.8 secs Computing kpt #: 314 total cpu time spent up to now is 445.2 secs Computing kpt #: 315 total cpu time spent up to now is 446.6 secs Computing kpt #: 316 total cpu time spent up to now is 447.9 secs Computing kpt #: 317 total cpu time spent up to now is 449.3 secs Computing kpt #: 318 total cpu time spent up to now is 450.7 secs Computing kpt #: 319 total cpu time spent up to now is 452.1 secs Computing kpt #: 320 total cpu time spent up to now is 453.4 secs Computing kpt #: 321 total cpu time spent up to now is 454.8 secs Computing kpt #: 322 total cpu time spent up to now is 456.2 secs Computing kpt #: 323 total cpu time spent up to now is 457.6 secs Computing kpt #: 324 total cpu time spent up to now is 459.0 secs Computing kpt #: 325 total cpu time spent up to now is 460.3 secs ethr = 2.08E-08, avg # of iterations = 19.4 total cpu time spent up to now is 460.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3897 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8988 -26.8988 -26.7967 -26.7967 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0305 -19.0305 -6.7648 -6.7648 -6.3111 -6.3111 -5.1611 -5.1611 -4.5207 -4.5207 4.1050 4.1050 4.3120 4.3120 4.3502 4.3502 4.8322 4.8322 4.9141 4.9141 5.2197 5.2197 5.7305 5.7305 7.0197 7.0197 7.0332 7.0332 7.1406 7.1406 7.1539 7.1539 8.3649 8.3649 11.7397 11.7397 11.8773 11.8773 12.0835 12.0835 12.9020 12.9020 13.2168 13.2168 k = 0.0096-0.0241-0.0142 ( 3880 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8988 -26.8988 -26.7966 -26.7966 -19.4049 -19.4049 -19.1289 -19.1289 -19.0386 -19.0386 -19.0306 -19.0306 -6.7639 -6.7639 -6.3106 -6.3106 -5.1608 -5.1608 -4.5203 -4.5203 4.1047 4.1047 4.3110 4.3110 4.3492 4.3492 4.8320 4.8320 4.9137 4.9137 5.2220 5.2220 5.7336 5.7336 7.0169 7.0169 7.0302 7.0302 7.1395 7.1395 7.1532 7.1532 8.3640 8.3640 11.7409 11.7409 11.8781 11.8781 12.0852 12.0852 12.9035 12.9035 13.2175 13.2175 k = 0.0192-0.0481-0.0285 ( 3877 PWs) bands (ev): -52.5388 -52.5388 -52.5137 -52.5137 -26.8988 -26.8988 -26.7968 -26.7968 -19.4049 -19.4049 -19.1299 -19.1299 -19.0386 -19.0386 -19.0312 -19.0312 -6.7611 -6.7611 -6.3089 -6.3089 -5.1597 -5.1597 -4.5192 -4.5192 4.1039 4.1039 4.3075 4.3075 4.3469 4.3469 4.8307 4.8307 4.9131 4.9131 5.2286 5.2286 5.7425 5.7425 7.0082 7.0082 7.0216 7.0216 7.1362 7.1362 7.1508 7.1508 8.3614 8.3614 11.7445 11.7445 11.8807 11.8807 12.0902 12.0902 12.9081 12.9081 13.2195 13.2195 k = 0.0288-0.0722-0.0427 ( 3881 PWs) bands (ev): -52.5387 -52.5387 -52.5137 -52.5137 -26.8990 -26.8990 -26.7972 -26.7972 -19.4050 -19.4050 -19.1315 -19.1315 -19.0388 -19.0388 -19.0322 -19.0322 -6.7566 -6.7566 -6.3062 -6.3062 -5.1580 -5.1580 -4.5172 -4.5172 4.1024 4.1024 4.3000 4.3000 4.3451 4.3451 4.8274 4.8274 4.9138 4.9138 5.2393 5.2393 5.7570 5.7570 6.9920 6.9920 7.0091 7.0091 7.1306 7.1306 7.1470 7.1470 8.3569 8.3569 11.7503 11.7503 11.8848 11.8848 12.0986 12.0986 12.9158 12.9158 13.2233 13.2233 k = 0.0385-0.0963-0.0570 ( 3883 PWs) bands (ev): -52.5386 -52.5386 -52.5137 -52.5137 -26.8992 -26.8992 -26.7977 -26.7977 -19.4051 -19.4051 -19.1338 -19.1338 -19.0392 -19.0392 -19.0334 -19.0334 -6.7503 -6.7503 -6.3024 -6.3024 -5.1555 -5.1555 -4.5145 -4.5145 4.1002 4.1002 4.2877 4.2877 4.3453 4.3453 4.8206 4.8206 4.9176 4.9176 5.2535 5.2535 5.7763 5.7763 6.9676 6.9676 6.9945 6.9945 7.1210 7.1210 7.1434 7.1434 8.3506 8.3506 11.7581 11.7581 11.8905 11.8905 12.1104 12.1104 12.9267 12.9267 13.2293 13.2293 k = 0.0481-0.1204-0.0712 ( 3885 PWs) bands (ev): -52.5385 -52.5385 -52.5137 -52.5137 -26.8995 -26.8995 -26.7984 -26.7984 -19.4052 -19.4052 -19.1366 -19.1366 -19.0403 -19.0403 -19.0345 -19.0345 -6.7422 -6.7422 -6.2976 -6.2976 -5.1523 -5.1523 -4.5110 -4.5110 4.0969 4.0969 4.2712 4.2712 4.3476 4.3476 4.8099 4.8099 4.9256 4.9256 5.2706 5.2706 5.7998 5.7998 6.9358 6.9358 6.9778 6.9778 7.1063 7.1063 7.1406 7.1406 8.3424 8.3424 11.7676 11.7676 11.8974 11.8974 12.1256 12.1256 12.9410 12.9410 13.2379 13.2379 k = 0.0577-0.1444-0.0855 ( 3885 PWs) bands (ev): -52.5384 -52.5384 -52.5136 -52.5136 -26.8998 -26.8998 -26.7992 -26.7992 -19.4054 -19.4054 -19.1400 -19.1400 -19.0422 -19.0422 -19.0351 -19.0351 -6.7323 -6.7323 -6.2918 -6.2918 -5.1484 -5.1484 -4.5068 -4.5068 4.0923 4.0923 4.2517 4.2517 4.3519 4.3519 4.7959 4.7959 4.9380 4.9380 5.2896 5.2896 5.8268 5.8268 6.8980 6.8980 6.9591 6.9591 7.0871 7.0871 7.1381 7.1381 8.3321 8.3321 11.7787 11.7787 11.9054 11.9054 12.1441 12.1441 12.9586 12.9586 13.2497 13.2497 k = 0.0673-0.1685-0.0997 ( 3882 PWs) bands (ev): -52.5382 -52.5382 -52.5136 -52.5136 -26.9002 -26.9002 -26.8001 -26.8001 -19.4056 -19.4056 -19.1438 -19.1438 -19.0449 -19.0449 -19.0354 -19.0354 -6.7208 -6.7208 -6.2849 -6.2849 -5.1439 -5.1439 -4.5018 -4.5018 4.0860 4.0860 4.2303 4.2303 4.3577 4.3577 4.7796 4.7796 4.9544 4.9544 5.3097 5.3097 5.8564 5.8564 6.8551 6.8551 6.9381 6.9381 7.0638 7.0638 7.1353 7.1353 8.3197 8.3197 11.7910 11.7910 11.9143 11.9143 12.1661 12.1661 12.9794 12.9794 13.2652 13.2652 k = 0.0769-0.1926-0.1139 ( 3882 PWs) bands (ev): -52.5380 -52.5380 -52.5135 -52.5135 -26.9006 -26.9006 -26.8011 -26.8011 -19.4059 -19.4059 -19.1482 -19.1482 -19.0484 -19.0484 -19.0355 -19.0355 -6.7077 -6.7077 -6.2771 -6.2771 -5.1386 -5.1386 -4.4961 -4.4961 4.0776 4.0776 4.2081 4.2081 4.3649 4.3649 4.7622 4.7622 4.9745 4.9745 5.3301 5.3301 5.8879 5.8879 6.8080 6.8080 6.9151 6.9151 7.0373 7.0373 7.1320 7.1320 8.3052 8.3052 11.8044 11.8044 11.9238 11.9238 12.1915 12.1915 13.0031 13.0031 13.2850 13.2850 k = 0.0865-0.2167-0.1282 ( 3880 PWs) bands (ev): -52.5377 -52.5377 -52.5135 -52.5135 -26.9011 -26.9011 -26.8023 -26.8023 -19.4062 -19.4062 -19.1530 -19.1530 -19.0523 -19.0523 -19.0356 -19.0356 -6.6930 -6.6930 -6.2684 -6.2684 -5.1326 -5.1326 -4.4897 -4.4897 4.0666 4.0666 4.1862 4.1862 4.3735 4.3735 4.7447 4.7447 4.9978 4.9978 5.3497 5.3497 5.9209 5.9209 6.7575 6.7575 6.8900 6.8900 7.0084 7.0084 7.1280 7.1280 8.2885 8.2885 11.8185 11.8185 11.9338 11.9338 12.2202 12.2202 13.0291 13.0291 13.3097 13.3097 k = 0.0962-0.2407-0.1424 ( 3879 PWs) bands (ev): -52.5375 -52.5375 -52.5134 -52.5134 -26.9017 -26.9017 -26.8036 -26.8036 -19.4066 -19.4066 -19.1583 -19.1583 -19.0566 -19.0566 -19.0357 -19.0357 -6.6768 -6.6768 -6.2588 -6.2588 -5.1259 -5.1259 -4.4827 -4.4827 4.0526 4.0526 4.1654 4.1654 4.3832 4.3832 4.7278 4.7278 5.0241 5.0241 5.3677 5.3677 5.9547 5.9547 6.7043 6.7043 6.8630 6.8630 6.9779 6.9779 7.1232 7.1232 8.2696 8.2696 11.8334 11.8334 11.9440 11.9440 12.2522 12.2522 13.0567 13.0567 13.3400 13.3400 k = 0.1058-0.2648-0.1567 ( 3884 PWs) bands (ev): -52.5372 -52.5372 -52.5133 -52.5133 -26.9023 -26.9023 -26.8051 -26.8051 -19.4070 -19.4070 -19.1639 -19.1639 -19.0614 -19.0614 -19.0359 -19.0359 -6.6591 -6.6591 -6.2484 -6.2484 -5.1186 -5.1186 -4.4749 -4.4749 4.0353 4.0353 4.1462 4.1462 4.3940 4.3940 4.7123 4.7123 5.0533 5.0533 5.3831 5.3831 5.9888 5.9888 6.6488 6.6488 6.8345 6.8345 6.9465 6.9465 7.1175 7.1175 8.2486 8.2486 11.8488 11.8488 11.9545 11.9545 12.2872 12.2872 13.0851 13.0851 13.3763 13.3763 k = 0.1154-0.2889-0.1709 ( 3883 PWs) bands (ev): -52.5369 -52.5369 -52.5133 -52.5133 -26.9029 -26.9029 -26.8067 -26.8067 -19.4074 -19.4074 -19.1699 -19.1699 -19.0666 -19.0666 -19.0362 -19.0362 -6.6401 -6.6401 -6.2372 -6.2372 -5.1105 -5.1105 -4.4665 -4.4665 4.0151 4.0151 4.1287 4.1287 4.4058 4.4058 4.6987 4.6987 5.0850 5.0850 5.3952 5.3952 6.0228 6.0228 6.5914 6.5914 6.8050 6.8050 6.9150 6.9150 7.1111 7.1111 8.2255 8.2255 11.8647 11.8647 11.9651 11.9651 12.3251 12.3251 13.1135 13.1135 13.4192 13.4192 k = 0.1250-0.3130-0.1851 ( 3876 PWs) bands (ev): -52.5366 -52.5366 -52.5132 -52.5132 -26.9035 -26.9035 -26.8083 -26.8083 -19.4079 -19.4079 -19.1763 -19.1763 -19.0720 -19.0720 -19.0365 -19.0365 -6.6199 -6.6199 -6.2253 -6.2253 -5.1017 -5.1017 -4.4575 -4.4575 3.9923 3.9923 4.1126 4.1126 4.4184 4.4184 4.6875 4.6875 5.1193 5.1193 5.4030 5.4030 6.0564 6.0564 6.5326 6.5326 6.7753 6.7753 6.8838 6.8838 7.1039 7.1039 8.2004 8.2004 11.8811 11.8811 11.9761 11.9761 12.3655 12.3655 13.1414 13.1414 13.4686 13.4686 k = 0.1346-0.3370-0.1994 ( 3882 PWs) bands (ev): -52.5362 -52.5362 -52.5131 -52.5131 -26.9042 -26.9042 -26.8102 -26.8102 -19.4085 -19.4085 -19.1830 -19.1830 -19.0778 -19.0778 -19.0370 -19.0370 -6.5984 -6.5984 -6.2127 -6.2127 -5.0923 -5.0923 -4.4479 -4.4479 3.9677 3.9677 4.0976 4.0976 4.4316 4.4316 4.6791 4.6791 5.1558 5.1558 5.4058 5.4058 6.0892 6.0892 6.4724 6.4724 6.7464 6.7464 6.8533 6.8533 7.0960 7.0960 8.1734 8.1734 11.8980 11.8980 11.9874 11.9874 12.4080 12.4080 13.1684 13.1684 13.5244 13.5244 k = 0.1442-0.3611-0.2136 ( 3883 PWs) bands (ev): -52.5359 -52.5359 -52.5130 -52.5130 -26.9049 -26.9049 -26.8121 -26.8121 -19.4092 -19.4092 -19.1899 -19.1899 -19.0838 -19.0838 -19.0375 -19.0375 -6.5759 -6.5759 -6.1995 -6.1995 -5.0821 -5.0821 -4.4378 -4.4378 3.9418 3.9418 4.0834 4.0834 4.4453 4.4453 4.6737 4.6737 5.1945 5.1945 5.4032 5.4032 6.1207 6.1207 6.4111 6.4111 6.7193 6.7193 6.8238 6.8238 7.0876 7.0876 8.1447 8.1447 11.9153 11.9153 11.9993 11.9993 12.4525 12.4525 13.1944 13.1944 13.5859 13.5859 k = 0.1538-0.3852-0.2279 ( 3886 PWs) bands (ev): -52.5355 -52.5355 -52.5130 -52.5130 -26.9057 -26.9057 -26.8141 -26.8141 -19.4100 -19.4100 -19.1971 -19.1971 -19.0900 -19.0900 -19.0382 -19.0382 -6.5524 -6.5524 -6.1857 -6.1857 -5.0713 -5.0713 -4.4272 -4.4272 3.9150 3.9150 4.0700 4.0700 4.4591 4.4591 4.6715 4.6715 5.2351 5.2351 5.3949 5.3949 6.1504 6.1504 6.3491 6.3491 6.6949 6.6949 6.7954 6.7954 7.0788 7.0788 8.1145 8.1145 11.9330 11.9330 12.0118 12.0118 12.4984 12.4984 13.2195 13.2195 13.6521 13.6521 k = 0.1635-0.4093-0.2421 ( 3886 PWs) bands (ev): -52.5351 -52.5351 -52.5129 -52.5129 -26.9065 -26.9065 -26.8162 -26.8162 -19.4108 -19.4108 -19.2045 -19.2045 -19.0963 -19.0963 -19.0390 -19.0390 -6.5281 -6.5281 -6.1714 -6.1714 -5.0597 -5.0597 -4.4161 -4.4161 3.8875 3.8875 4.0574 4.0574 4.4729 4.4729 4.6728 4.6728 5.2771 5.2771 5.3811 5.3811 6.1760 6.1760 6.2885 6.2885 6.6733 6.6733 6.7688 6.7688 7.0696 7.0696 8.0830 8.0830 11.9511 11.9511 12.0252 12.0252 12.5455 12.5455 13.2438 13.2438 13.7219 13.7219 k = 0.1731-0.4333-0.2564 ( 3884 PWs) bands (ev): -52.5347 -52.5347 -52.5128 -52.5128 -26.9072 -26.9072 -26.8185 -26.8185 -19.4118 -19.4118 -19.2121 -19.2121 -19.1027 -19.1027 -19.0400 -19.0400 -6.5030 -6.5030 -6.1568 -6.1568 -5.0475 -5.0475 -4.4046 -4.4046 3.8594 3.8594 4.0459 4.0459 4.4864 4.4864 4.6775 4.6775 5.3176 5.3176 5.3648 5.3648 6.1820 6.1820 6.2448 6.2448 6.6542 6.6542 6.7447 6.7447 7.0602 7.0602 8.0505 8.0505 11.9694 11.9694 12.0395 12.0395 12.5934 12.5934 13.2674 13.2674 13.7940 13.7940 k = 0.1827-0.4574-0.2706 ( 3886 PWs) bands (ev): -52.5342 -52.5342 -52.5127 -52.5127 -26.9080 -26.9080 -26.8208 -26.8208 -19.4128 -19.4128 -19.2198 -19.2198 -19.1092 -19.1092 -19.0410 -19.0410 -6.4772 -6.4772 -6.1417 -6.1417 -5.0346 -5.0346 -4.3926 -4.3926 3.8307 3.8307 4.0357 4.0357 4.4993 4.4993 4.6857 4.6857 5.3258 5.3258 5.3771 5.3771 6.1357 6.1357 6.2508 6.2508 6.6361 6.6361 6.7244 6.7244 7.0509 7.0509 8.0172 8.0172 11.9878 11.9878 12.0549 12.0549 12.6417 12.6417 13.2904 13.2904 13.8668 13.8668 k = 0.1923-0.4815-0.2848 ( 3886 PWs) bands (ev): -52.5338 -52.5338 -52.5126 -52.5126 -26.9088 -26.9088 -26.8231 -26.8231 -19.4140 -19.4140 -19.2278 -19.2278 -19.1157 -19.1157 -19.0421 -19.0421 -6.4510 -6.4510 -6.1264 -6.1264 -5.0210 -5.0210 -4.3804 -4.3804 3.8013 3.8013 4.0271 4.0271 4.5116 4.5116 4.6971 4.6971 5.2992 5.2992 5.4209 5.4209 6.0715 6.0715 6.2723 6.2723 6.6173 6.6173 6.7096 6.7096 7.0417 7.0417 7.9834 7.9834 12.0062 12.0062 12.0717 12.0717 12.6900 12.6900 13.3129 13.3129 13.9385 13.9385 k = 0.2019-0.5056-0.2991 ( 3879 PWs) bands (ev): -52.5333 -52.5333 -52.5125 -52.5125 -26.9096 -26.9096 -26.8255 -26.8255 -19.4152 -19.4152 -19.2359 -19.2359 -19.1222 -19.1222 -19.0434 -19.0434 -6.4244 -6.4244 -6.1109 -6.1109 -5.0066 -5.0066 -4.3679 -4.3679 3.7712 3.7712 4.0205 4.0205 4.5232 4.5232 4.7115 4.7115 5.2660 5.2660 5.4687 5.4687 6.0041 6.0041 6.2946 6.2946 6.5963 6.5963 6.7010 6.7010 7.0328 7.0328 7.9496 7.9496 12.0244 12.0244 12.0898 12.0898 12.7379 12.7379 13.3348 13.3348 14.0070 14.0070 k = 0.2115-0.5296-0.3133 ( 3881 PWs) bands (ev): -52.5328 -52.5328 -52.5124 -52.5124 -26.9105 -26.9105 -26.8280 -26.8280 -19.4167 -19.4167 -19.2441 -19.2441 -19.1285 -19.1285 -19.0447 -19.0447 -6.3974 -6.3974 -6.0952 -6.0952 -4.9916 -4.9916 -4.3552 -4.3552 3.7403 3.7403 4.0160 4.0160 4.5343 4.5343 4.7284 4.7284 5.2295 5.2295 5.5181 5.5181 5.9358 5.9358 6.3157 6.3157 6.5731 6.5731 6.6982 6.6982 7.0244 7.0244 7.9160 7.9160 12.0424 12.0424 12.1094 12.1094 12.7849 12.7849 13.3563 13.3563 14.0699 14.0699 k = 0.2212-0.5537-0.3276 ( 3878 PWs) bands (ev): -52.5323 -52.5323 -52.5123 -52.5123 -26.9113 -26.9113 -26.8305 -26.8305 -19.4182 -19.4182 -19.2524 -19.2524 -19.1348 -19.1348 -19.0462 -19.0462 -6.3704 -6.3704 -6.0794 -6.0794 -4.9759 -4.9759 -4.3423 -4.3423 3.7085 3.7085 4.0139 4.0139 4.5448 4.5448 4.7474 4.7474 5.1909 5.1909 5.5682 5.5682 5.8677 5.8677 6.3348 6.3348 6.5483 6.5483 6.6999 6.6999 7.0167 7.0167 7.8830 7.8830 12.0602 12.0602 12.1303 12.1303 12.8303 12.8303 13.3773 13.3773 14.1245 14.1245 k = 0.2308-0.5778-0.3418 ( 3872 PWs) bands (ev): -52.5318 -52.5318 -52.5123 -52.5123 -26.9121 -26.9121 -26.8331 -26.8331 -19.4199 -19.4199 -19.2607 -19.2607 -19.1409 -19.1409 -19.0477 -19.0477 -6.3433 -6.3433 -6.0636 -6.0636 -4.9595 -4.9595 -4.3293 -4.3293 3.6758 3.6758 4.0143 4.0143 4.5549 4.5549 4.7680 4.7680 5.1512 5.1512 5.6183 5.6183 5.8008 5.8008 6.3514 6.3514 6.5227 6.5227 6.7050 6.7050 7.0100 7.0100 7.8511 7.8511 12.0777 12.0777 12.1525 12.1525 12.8737 12.8737 13.3977 13.3977 14.1677 14.1677 k = 0.2404-0.6019-0.3561 ( 3874 PWs) bands (ev): -52.5313 -52.5313 -52.5122 -52.5122 -26.9129 -26.9129 -26.8358 -26.8358 -19.4217 -19.4217 -19.2692 -19.2692 -19.1468 -19.1468 -19.0494 -19.0494 -6.3163 -6.3163 -6.0479 -6.0479 -4.9424 -4.9424 -4.3162 -4.3162 3.6422 3.6422 4.0174 4.0174 4.5645 4.5645 4.7897 4.7897 5.1113 5.1113 5.6654 5.6654 5.7383 5.7383 6.3646 6.3646 6.4970 6.4970 6.7125 6.7125 7.0044 7.0044 7.8207 7.8207 12.0950 12.0950 12.1756 12.1756 12.9141 12.9141 13.4176 13.4176 14.1967 14.1967 k = 0.2500-0.6259-0.3703 ( 3876 PWs) bands (ev): -52.5308 -52.5308 -52.5121 -52.5121 -26.9137 -26.9137 -26.8384 -26.8384 -19.4236 -19.4236 -19.2777 -19.2777 -19.1525 -19.1525 -19.0511 -19.0511 -6.2895 -6.2895 -6.0323 -6.0323 -4.9247 -4.9247 -4.3032 -4.3032 3.6076 3.6076 4.0233 4.0233 4.5737 4.5737 4.8117 4.8117 5.0723 5.0723 5.6603 5.6603 5.7300 5.7300 6.3738 6.3738 6.4717 6.4717 6.7218 6.7218 7.0003 7.0003 7.7922 7.7922 12.1122 12.1122 12.1993 12.1993 12.9507 12.9507 13.4368 13.4368 14.2088 14.2088 k = 0.2596-0.6500-0.3845 ( 3874 PWs) bands (ev): -52.5303 -52.5303 -52.5121 -52.5121 -26.9144 -26.9144 -26.8411 -26.8411 -19.4257 -19.4257 -19.2862 -19.2862 -19.1579 -19.1579 -19.0528 -19.0528 -6.2630 -6.2630 -6.0169 -6.0169 -4.9063 -4.9063 -4.2902 -4.2902 3.5721 3.5721 4.0318 4.0318 4.5824 4.5824 4.8331 4.8331 5.0351 5.0351 5.6025 5.6025 5.7763 5.7763 6.3777 6.3777 6.4478 6.4478 6.7325 6.7325 6.9978 6.9978 7.7658 7.7658 12.1292 12.1292 12.2234 12.2234 12.9826 12.9826 13.4553 13.4553 14.2028 14.2028 k = 0.2692-0.6741-0.3988 ( 3875 PWs) bands (ev): -52.5298 -52.5298 -52.5120 -52.5120 -26.9151 -26.9151 -26.8438 -26.8438 -19.4278 -19.4278 -19.2947 -19.2947 -19.1630 -19.1630 -19.0547 -19.0547 -6.2369 -6.2369 -6.0017 -6.0017 -4.8873 -4.8873 -4.2775 -4.2775 3.5357 3.5357 4.0431 4.0431 4.5906 4.5906 4.8519 4.8519 5.0019 5.0019 5.5447 5.5447 5.8252 5.8252 6.3747 6.3747 6.4267 6.4267 6.7444 6.7444 6.9972 6.9972 7.7420 7.7420 12.1462 12.1462 12.2475 12.2475 13.0085 13.0085 13.4731 13.4731 14.1792 14.1792 k = 0.2788-0.6982-0.4130 ( 3867 PWs) bands (ev): -52.5292 -52.5292 -52.5119 -52.5119 -26.9158 -26.9158 -26.8465 -26.8465 -19.4300 -19.4300 -19.3032 -19.3032 -19.1678 -19.1678 -19.0565 -19.0565 -6.2113 -6.2113 -5.9869 -5.9869 -4.8678 -4.8678 -4.2649 -4.2649 3.4985 3.4985 4.0571 4.0571 4.5980 4.5980 4.8634 4.8634 4.9771 4.9771 5.4902 5.4902 5.8733 5.8733 6.3632 6.3632 6.4095 6.4095 6.7574 6.7574 6.9988 6.9988 7.7209 7.7209 12.1631 12.1631 12.2710 12.2710 13.0273 13.0273 13.4901 13.4901 14.1412 14.1412 k = 0.2885-0.7222-0.4273 ( 3864 PWs) bands (ev): -52.5287 -52.5287 -52.5119 -52.5119 -26.9164 -26.9164 -26.8492 -26.8492 -19.4323 -19.4323 -19.3116 -19.3116 -19.1723 -19.1723 -19.0585 -19.0585 -6.1863 -6.1863 -5.9725 -5.9725 -4.8477 -4.8477 -4.2526 -4.2526 3.4607 3.4607 4.0736 4.0736 4.6045 4.6045 4.8597 4.8597 4.9685 4.9685 5.4403 5.4403 5.9200 5.9200 6.3449 6.3449 6.3947 6.3947 6.7713 6.7713 7.0029 7.0029 7.7027 7.7027 12.1797 12.1797 12.2935 12.2935 13.0380 13.0380 13.5063 13.5063 14.0940 14.0940 k = 0.2981-0.7463-0.4415 ( 3863 PWs) bands (ev): -52.5282 -52.5282 -52.5119 -52.5119 -26.9171 -26.9171 -26.8519 -26.8519 -19.4347 -19.4347 -19.3200 -19.3200 -19.1765 -19.1765 -19.0604 -19.0604 -6.1619 -6.1619 -5.9586 -5.9586 -4.8271 -4.8271 -4.2406 -4.2406 3.4224 3.4224 4.0924 4.0924 4.6100 4.6100 4.8399 4.8399 4.9769 4.9769 5.3957 5.3957 5.9647 5.9647 6.3231 6.3231 6.3786 6.3786 6.7861 6.7861 7.0096 7.0096 7.6874 7.6874 12.1960 12.1960 12.3144 12.3144 13.0398 13.0398 13.5217 13.5217 14.0431 14.0431 k = 0.3077-0.7704-0.4558 ( 3869 PWs) bands (ev): -52.5277 -52.5277 -52.5118 -52.5118 -26.9177 -26.9177 -26.8546 -26.8546 -19.4372 -19.4372 -19.3283 -19.3283 -19.1803 -19.1803 -19.0624 -19.0624 -6.1383 -6.1383 -5.9452 -5.9452 -4.8062 -4.8062 -4.2291 -4.2291 3.3837 3.3837 4.1133 4.1133 4.6140 4.6140 4.8121 4.8121 4.9940 4.9940 5.3571 5.3571 6.0070 6.0070 6.2999 6.2999 6.3596 6.3596 6.8017 6.8017 7.0191 7.0191 7.6750 7.6750 12.2117 12.2117 12.3328 12.3328 13.0328 13.0328 13.5363 13.5363 13.9929 13.9929 k = 0.3173-0.7945-0.4700 ( 3872 PWs) bands (ev): -52.5271 -52.5271 -52.5118 -52.5118 -26.9183 -26.9183 -26.8573 -26.8573 -19.4397 -19.4397 -19.3364 -19.3364 -19.1838 -19.1838 -19.0644 -19.0644 -6.1155 -6.1155 -5.9324 -5.9324 -4.7849 -4.7849 -4.2180 -4.2180 3.3449 3.3449 4.1360 4.1360 4.6161 4.6161 4.7823 4.7823 5.0142 5.0142 5.3251 5.3251 6.0464 6.0464 6.2761 6.2761 6.3370 6.3370 6.8178 6.8178 7.0315 7.0315 7.6654 7.6654 12.2261 12.2261 12.3480 12.3480 13.0181 13.0181 13.5503 13.5503 13.9462 13.9462 k = 0.3269-0.8185-0.4842 ( 3877 PWs) bands (ev): -52.5266 -52.5266 -52.5118 -52.5118 -26.9188 -26.9188 -26.8599 -26.8599 -19.4421 -19.4421 -19.3445 -19.3445 -19.1870 -19.1870 -19.0664 -19.0664 -6.0935 -6.0935 -5.9202 -5.9202 -4.7633 -4.7633 -4.2074 -4.2074 3.3062 3.3062 4.1602 4.1602 4.6156 4.6156 4.7535 4.7535 5.0351 5.0351 5.2997 5.2997 6.0828 6.0828 6.2519 6.2519 6.3112 6.3112 6.8342 6.8342 7.0469 7.0469 7.6583 7.6583 12.2386 12.2386 12.3593 12.3593 12.9979 12.9979 13.5634 13.5634 13.9041 13.9041 k = 0.3365-0.8426-0.4985 ( 3873 PWs) bands (ev): -52.5261 -52.5261 -52.5118 -52.5118 -26.9193 -26.9193 -26.8624 -26.8624 -19.4446 -19.4446 -19.3523 -19.3523 -19.1898 -19.1898 -19.0684 -19.0684 -6.0724 -6.0724 -5.9087 -5.9087 -4.7416 -4.7416 -4.1975 -4.1975 3.2678 3.2678 4.1851 4.1851 4.6112 4.6112 4.7283 4.7283 5.0557 5.0557 5.2812 5.2812 6.1157 6.1157 6.2270 6.2270 6.2831 6.2831 6.8508 6.8508 7.0653 7.0653 7.6534 7.6534 12.2475 12.2475 12.3664 12.3664 12.9756 12.9756 13.5755 13.5755 13.8667 13.8667 k = 0.3462-0.8667-0.5127 ( 3872 PWs) bands (ev): -52.5256 -52.5256 -52.5118 -52.5118 -26.9197 -26.9197 -26.8649 -26.8649 -19.4470 -19.4470 -19.3599 -19.3599 -19.1923 -19.1923 -19.0703 -19.0703 -6.0522 -6.0522 -5.8980 -5.8980 -4.7198 -4.7198 -4.1881 -4.1881 3.2300 3.2300 4.2100 4.2100 4.6018 4.6018 4.7093 4.7093 5.0753 5.0753 5.2693 5.2693 6.1447 6.1447 6.2007 6.2007 6.2542 6.2542 6.8673 6.8673 7.0865 7.0865 7.6506 7.6506 12.2503 12.2503 12.3703 12.3703 12.9546 12.9546 13.5859 13.5859 13.8335 13.8335 k = 0.3558-0.8908-0.5270 ( 3874 PWs) bands (ev): -52.5251 -52.5251 -52.5118 -52.5118 -26.9201 -26.9201 -26.8674 -26.8674 -19.4494 -19.4494 -19.3673 -19.3673 -19.1945 -19.1945 -19.0723 -19.0723 -6.0329 -6.0329 -5.8880 -5.8880 -4.6982 -4.6982 -4.1794 -4.1794 3.1930 3.1930 4.2337 4.2337 4.5876 4.5876 4.6976 4.6976 5.0937 5.0937 5.2634 5.2634 6.1626 6.1626 6.1784 6.1784 6.2270 6.2270 6.8835 6.8835 7.1103 7.1103 7.6493 7.6493 12.2434 12.2434 12.3735 12.3735 12.9383 12.9383 13.5938 13.5938 13.8042 13.8042 k = 0.3654-0.9148-0.5412 ( 3873 PWs) bands (ev): -52.5247 -52.5247 -52.5119 -52.5119 -26.9203 -26.9203 -26.8698 -26.8698 -19.4516 -19.4516 -19.3744 -19.3744 -19.1965 -19.1965 -19.0742 -19.0742 -6.0146 -6.0146 -5.8788 -5.8788 -4.6767 -4.6767 -4.1715 -4.1715 3.1570 3.1570 4.2546 4.2546 4.5719 4.5719 4.6920 4.6920 5.1108 5.1108 5.2628 5.2628 6.1339 6.1339 6.1903 6.1903 6.2074 6.2074 6.8992 6.8992 7.1363 7.1363 7.6495 7.6495 12.2243 12.2243 12.3785 12.3785 12.9284 12.9284 13.5975 13.5975 13.7794 13.7794 k = 0.3750-0.9389-0.5554 ( 3874 PWs) bands (ev): -52.5242 -52.5242 -52.5119 -52.5119 -26.9206 -26.9206 -26.8721 -26.8721 -19.4537 -19.4537 -19.3813 -19.3813 -19.1982 -19.1982 -19.0760 -19.0760 -5.9973 -5.9973 -5.8705 -5.8705 -4.6556 -4.6556 -4.1642 -4.1642 3.1224 3.1224 4.2705 4.2705 4.5590 4.5590 4.6906 4.6906 5.1266 5.1266 5.2667 5.2667 6.0958 6.0958 6.1768 6.1768 6.2185 6.2185 6.9141 6.9141 7.1642 7.1642 7.6507 7.6507 12.1935 12.1935 12.3863 12.3863 12.9254 12.9254 13.5948 13.5948 13.7608 13.7608 k = 0.3846-0.9630-0.5697 ( 3870 PWs) bands (ev): -52.5238 -52.5238 -52.5119 -52.5119 -26.9207 -26.9207 -26.8743 -26.8743 -19.4557 -19.4557 -19.3878 -19.3878 -19.1996 -19.1996 -19.0778 -19.0778 -5.9809 -5.9809 -5.8631 -5.8631 -4.6350 -4.6350 -4.1577 -4.1577 3.0893 3.0893 4.2791 4.2791 4.5531 4.5531 4.6917 4.6917 5.1416 5.1416 5.2738 5.2738 6.0543 6.0543 6.1583 6.1583 6.2347 6.2347 6.9283 6.9283 7.1932 7.1932 7.6527 7.6527 12.1536 12.1536 12.3961 12.3961 12.9285 12.9285 13.5840 13.5840 13.7501 13.7501 k = 0.3942-0.9871-0.5839 ( 3872 PWs) bands (ev): -52.5233 -52.5233 -52.5120 -52.5120 -26.9209 -26.9209 -26.8764 -26.8764 -19.4575 -19.4575 -19.3940 -19.3940 -19.2008 -19.2008 -19.0794 -19.0794 -5.9655 -5.9655 -5.8565 -5.8565 -4.6151 -4.6151 -4.1519 -4.1519 3.0580 3.0580 4.2791 4.2791 4.5561 4.5561 4.6944 4.6944 5.1562 5.1562 5.2834 5.2834 6.0107 6.0107 6.1412 6.1412 6.2491 6.2491 6.9414 6.9414 7.2228 7.2228 7.6553 7.6553 12.1081 12.1081 12.4067 12.4067 12.9363 12.9363 13.5654 13.5654 13.7471 13.7471 k = 0.4038-1.0111-0.5982 ( 3861 PWs) bands (ev): -52.5229 -52.5229 -52.5120 -52.5120 -26.9209 -26.9209 -26.8783 -26.8783 -19.4591 -19.4591 -19.3998 -19.3998 -19.2018 -19.2018 -19.0810 -19.0810 -5.9512 -5.9512 -5.8509 -5.8509 -4.5961 -4.5961 -4.1469 -4.1469 3.0286 3.0286 4.2714 4.2714 4.5679 4.5679 4.6984 4.6984 5.1706 5.1706 5.2943 5.2943 5.9659 5.9659 6.1258 6.1258 6.2613 6.2613 6.9535 6.9535 7.2524 7.2524 7.6583 7.6583 12.0600 12.0600 12.4174 12.4174 12.9472 12.9472 13.5415 13.5415 13.7500 13.7500 k = 0.4135-1.0352-0.6124 ( 3864 PWs) bands (ev): -52.5226 -52.5226 -52.5121 -52.5121 -26.9209 -26.9209 -26.8802 -26.8802 -19.4605 -19.4605 -19.4053 -19.4053 -19.2027 -19.2027 -19.0825 -19.0825 -5.9378 -5.9378 -5.8461 -5.8461 -4.5780 -4.5780 -4.1427 -4.1427 3.0015 3.0015 4.2581 4.2581 4.5859 4.5859 4.7033 4.7033 5.1850 5.1850 5.3060 5.3060 5.9206 5.9206 6.1118 6.1118 6.2715 6.2715 6.9645 6.9645 7.2812 7.2812 7.6615 7.6615 12.0117 12.0117 12.4275 12.4275 12.9597 12.9597 13.5156 13.5156 13.7566 13.7566 k = 0.4231-1.0593-0.6267 ( 3860 PWs) bands (ev): -52.5222 -52.5222 -52.5121 -52.5121 -26.9209 -26.9209 -26.8818 -26.8818 -19.4617 -19.4617 -19.4103 -19.4103 -19.2034 -19.2034 -19.0838 -19.0838 -5.9255 -5.9255 -5.8422 -5.8422 -4.5612 -4.5612 -4.1391 -4.1391 2.9767 2.9767 4.2419 4.2419 4.6076 4.6076 4.7090 4.7090 5.1998 5.1998 5.3180 5.3180 5.8754 5.8754 6.0994 6.0994 6.2801 6.2801 6.9744 6.9744 7.3088 7.3088 7.6647 7.6647 11.9651 11.9651 12.4368 12.4368 12.9725 12.9725 13.4903 13.4903 13.7649 13.7649 k = 0.4327-1.0834-0.6409 ( 3865 PWs) bands (ev): -52.5219 -52.5219 -52.5122 -52.5122 -26.9209 -26.9209 -26.8834 -26.8834 -19.4628 -19.4628 -19.4149 -19.4149 -19.2040 -19.2040 -19.0851 -19.0851 -5.9142 -5.9142 -5.8392 -5.8392 -4.5457 -4.5457 -4.1361 -4.1361 2.9544 2.9544 4.2248 4.2248 4.6302 4.6302 4.7156 4.7156 5.2147 5.2147 5.3298 5.3298 5.8308 5.8308 6.0883 6.0883 6.2872 6.2872 6.9831 6.9831 7.3345 7.3345 7.6679 7.6679 11.9215 11.9215 12.4449 12.4449 12.9844 12.9844 13.4674 13.4674 13.7741 13.7741 k = 0.4423-1.1074-0.6551 ( 3865 PWs) bands (ev): -52.5216 -52.5216 -52.5123 -52.5123 -26.9208 -26.9208 -26.8848 -26.8848 -19.4636 -19.4636 -19.4190 -19.4190 -19.2045 -19.2045 -19.0862 -19.0862 -5.9040 -5.9040 -5.8370 -5.8370 -4.5319 -4.5319 -4.1338 -4.1338 2.9348 2.9348 4.2082 4.2082 4.6515 4.6515 4.7233 4.7233 5.2298 5.2298 5.3413 5.3413 5.7876 5.7876 6.0787 6.0787 6.2930 6.2930 6.9906 6.9906 7.3578 7.3578 7.6709 7.6709 11.8821 11.8821 12.4518 12.4518 12.9947 12.9947 13.4483 13.4483 13.7833 13.7833 k = 0.4519-1.1315-0.6694 ( 3862 PWs) bands (ev): -52.5214 -52.5214 -52.5123 -52.5123 -26.9207 -26.9207 -26.8860 -26.8860 -19.4643 -19.4643 -19.4225 -19.4225 -19.2048 -19.2048 -19.0871 -19.0871 -5.8950 -5.8950 -5.8355 -5.8355 -4.5198 -4.5198 -4.1320 -4.1320 2.9180 2.9180 4.1930 4.1930 4.6698 4.6698 4.7322 4.7322 5.2446 5.2446 5.3525 5.3525 5.7466 5.7466 6.0706 6.0706 6.2976 6.2976 6.9969 6.9969 7.3782 7.3782 7.6737 7.6737 11.8476 11.8476 12.4574 12.4574 13.0029 13.0029 13.4335 13.4335 13.7920 13.7920 k = 0.4615-1.1556-0.6836 ( 3860 PWs) bands (ev): -52.5212 -52.5212 -52.5124 -52.5124 -26.9206 -26.9206 -26.8870 -26.8870 -19.4647 -19.4647 -19.4255 -19.4255 -19.2051 -19.2051 -19.0879 -19.0879 -5.8871 -5.8871 -5.8348 -5.8348 -4.5096 -4.5096 -4.1306 -4.1306 2.9041 2.9041 4.1799 4.1799 4.6839 4.6839 4.7422 4.7422 5.2586 5.2586 5.3633 5.3633 5.7087 5.7087 6.0639 6.0639 6.3012 6.3012 7.0020 7.0020 7.3954 7.3954 7.6761 7.6761 11.8187 11.8187 12.4618 12.4618 13.0087 13.0087 13.4232 13.4232 13.7998 13.7998 k = 0.4712-1.1797-0.6979 ( 3860 PWs) bands (ev): -52.5210 -52.5210 -52.5124 -52.5124 -26.9206 -26.9206 -26.8878 -26.8878 -19.4651 -19.4651 -19.4279 -19.4279 -19.2053 -19.2053 -19.0885 -19.0885 -5.8807 -5.8807 -5.8346 -5.8346 -4.5015 -4.5015 -4.1297 -4.1297 2.8932 2.8932 4.1694 4.1694 4.6937 4.6937 4.7523 4.7523 5.2709 5.2709 5.3736 5.3736 5.6754 5.6754 6.0586 6.0586 6.3039 6.3039 7.0060 7.0060 7.4090 7.4090 7.6781 7.6781 11.7958 11.7958 12.4650 12.4650 13.0125 13.0125 13.4167 13.4167 13.8065 13.8065 k = 0.4808-1.2037-0.7121 ( 3858 PWs) bands (ev): -52.5209 -52.5209 -52.5124 -52.5124 -26.9205 -26.9205 -26.8884 -26.8884 -19.4653 -19.4653 -19.4297 -19.4297 -19.2054 -19.2054 -19.0890 -19.0890 -5.8758 -5.8758 -5.8348 -5.8348 -4.4956 -4.4956 -4.1290 -4.1290 2.8854 2.8854 4.1617 4.1617 4.6998 4.6998 4.7609 4.7609 5.2806 5.2806 5.3828 5.3828 5.6486 5.6486 6.0549 6.0549 6.3058 6.3058 7.0088 7.0088 7.4189 7.4189 7.6796 7.6796 11.7792 11.7792 12.4671 12.4671 13.0147 13.0147 13.4130 13.4130 13.8118 13.8118 k = 0.4904-1.2278-0.7264 ( 3852 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8887 -26.8887 -19.4653 -19.4653 -19.4307 -19.4307 -19.2054 -19.2054 -19.0892 -19.0892 -5.8726 -5.8726 -5.8350 -5.8350 -4.4920 -4.4920 -4.1287 -4.1287 2.8807 2.8807 4.1570 4.1570 4.7033 4.7033 4.7667 4.7667 5.2868 5.2868 5.3896 5.3896 5.6307 5.6307 6.0526 6.0526 6.3069 6.3069 7.0105 7.0105 7.4249 7.4249 7.6806 7.6806 11.7692 11.7692 12.4684 12.4684 13.0158 13.0158 13.4114 13.4114 13.8152 13.8152 k = 0.5000-1.2519-0.7406 ( 3860 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2055 -19.2055 -19.0893 -19.0893 -5.8716 -5.8716 -5.8351 -5.8351 -4.4908 -4.4908 -4.1286 -4.1286 2.8791 2.8791 4.1554 4.1554 4.7043 4.7043 4.7687 4.7687 5.2889 5.2889 5.3921 5.3921 5.6244 5.6244 6.0519 6.0519 6.3073 6.3073 7.0110 7.0110 7.4269 7.4269 7.6809 7.6809 11.7659 11.7659 12.4688 12.4688 13.0161 13.0161 13.4109 13.4109 13.8164 13.8164 k = 0.5000-1.2519-0.7406 ( 3860 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2055 -19.2055 -19.0893 -19.0893 -5.8716 -5.8716 -5.8351 -5.8351 -4.4908 -4.4908 -4.1286 -4.1286 2.8791 2.8791 4.1554 4.1554 4.7043 4.7043 4.7687 4.7687 5.2889 5.2889 5.3921 5.3921 5.6244 5.6244 6.0519 6.0519 6.3073 6.3073 7.0110 7.0110 7.4269 7.4269 7.6809 7.6809 11.7659 11.7659 12.4688 12.4688 13.0161 13.0161 13.4109 13.4109 13.8164 13.8164 k = 0.5000-1.2367-0.7663 ( 3860 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8889 -26.8889 -19.4658 -19.4658 -19.4307 -19.4307 -19.2056 -19.2056 -19.0895 -19.0895 -5.8714 -5.8714 -5.8349 -5.8349 -4.4905 -4.4905 -4.1283 -4.1283 2.8806 2.8806 4.1560 4.1560 4.7041 4.7041 4.7688 4.7688 5.2843 5.2843 5.3965 5.3965 5.6207 5.6207 6.0555 6.0555 6.3040 6.3040 7.0077 7.0077 7.4301 7.4301 7.6803 7.6803 11.7555 11.7555 12.4790 12.4790 13.0118 13.0118 13.4123 13.4123 13.8136 13.8136 k = 0.5000-1.2214-0.7920 ( 3870 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9206 -26.9206 -26.8891 -26.8891 -19.4670 -19.4670 -19.4293 -19.4293 -19.2061 -19.2061 -19.0900 -19.0900 -5.8709 -5.8709 -5.8343 -5.8343 -4.4897 -4.4897 -4.1274 -4.1274 2.8851 2.8851 4.1575 4.1575 4.7035 4.7035 4.7689 4.7689 5.2724 5.2724 5.4073 5.4073 5.6103 5.6103 6.0658 6.0658 6.2940 6.2940 6.9978 6.9978 7.4393 7.4393 7.6786 7.6786 11.7263 11.7263 12.5079 12.5079 12.9992 12.9992 13.4165 13.4165 13.8063 13.8063 k = 0.5000-1.2062-0.8178 ( 3864 PWs) bands (ev): -52.5207 -52.5207 -52.5125 -52.5125 -26.9206 -26.9206 -26.8891 -26.8891 -19.4688 -19.4688 -19.4271 -19.4271 -19.2067 -19.2067 -19.0907 -19.0907 -5.8701 -5.8701 -5.8332 -5.8332 -4.4882 -4.4882 -4.1260 -4.1260 2.8926 2.8926 4.1600 4.1600 4.7024 4.7024 4.7690 4.7690 5.2566 5.2566 5.4204 5.4204 5.5955 5.5955 6.0817 6.0817 6.2777 6.2777 6.9822 6.9822 7.4537 7.4537 7.6757 7.6757 11.6823 11.6823 12.5509 12.5509 12.9790 12.9790 13.4235 13.4235 13.7970 13.7970 k = 0.5000-1.1910-0.8435 ( 3856 PWs) bands (ev): -52.5207 -52.5207 -52.5125 -52.5125 -26.9206 -26.9206 -26.8892 -26.8892 -19.4709 -19.4709 -19.4243 -19.4243 -19.2076 -19.2076 -19.0918 -19.0918 -5.8689 -5.8689 -5.8317 -5.8317 -4.4862 -4.4862 -4.1240 -4.1240 2.9030 2.9030 4.1635 4.1635 4.7008 4.7008 4.7689 4.7689 5.2394 5.2394 5.4314 5.4314 5.5797 5.5797 6.1015 6.1015 6.2556 6.2556 6.9616 6.9616 7.4721 7.4721 7.6717 7.6717 11.6279 11.6279 12.6031 12.6031 12.9521 12.9521 13.4333 13.4333 13.7875 13.7875 k = 0.5000-1.1758-0.8692 ( 3856 PWs) bands (ev): -52.5206 -52.5206 -52.5125 -52.5125 -26.9207 -26.9207 -26.8894 -26.8894 -19.4734 -19.4734 -19.4211 -19.4211 -19.2088 -19.2088 -19.0931 -19.0931 -5.8674 -5.8674 -5.8298 -5.8298 -4.4836 -4.4836 -4.1215 -4.1215 2.9165 2.9165 4.1679 4.1679 4.6986 4.6986 4.7683 4.7683 5.2221 5.2221 5.4359 5.4359 5.5683 5.5683 6.1233 6.1233 6.2288 6.2288 6.9371 6.9371 7.4933 7.4933 7.6668 7.6668 11.5667 11.5667 12.6594 12.6594 12.9207 12.9207 13.4461 13.4461 13.7788 13.7788 k = 0.5000-1.1606-0.8949 ( 3850 PWs) bands (ev): -52.5205 -52.5205 -52.5125 -52.5125 -26.9207 -26.9207 -26.8897 -26.8897 -19.4760 -19.4760 -19.4175 -19.4175 -19.2101 -19.2101 -19.0947 -19.0947 -5.8656 -5.8656 -5.8275 -5.8275 -4.4805 -4.4805 -4.1185 -4.1185 2.9328 2.9328 4.1732 4.1732 4.6958 4.6958 4.7668 4.7668 5.2054 5.2054 5.4295 5.4295 5.5662 5.5662 6.1420 6.1420 6.2017 6.2017 6.9091 6.9091 7.5158 7.5158 7.6613 7.6613 11.5013 11.5013 12.7133 12.7133 12.8892 12.8892 13.4621 13.4621 13.7713 13.7713 k = 0.5000-1.1453-0.9207 ( 3842 PWs) bands (ev): -52.5204 -52.5204 -52.5126 -52.5126 -26.9208 -26.9208 -26.8899 -26.8899 -19.4788 -19.4788 -19.4137 -19.4137 -19.2117 -19.2117 -19.0965 -19.0965 -5.8635 -5.8635 -5.8249 -5.8249 -4.4768 -4.4768 -4.1151 -4.1151 2.9521 2.9521 4.1793 4.1793 4.6922 4.6922 4.7640 4.7640 5.1900 5.1900 5.4128 5.4128 5.5740 5.5740 6.1349 6.1349 6.1968 6.1968 6.8783 6.8783 7.5376 7.5376 7.6565 7.6565 11.4335 11.4335 12.7485 12.7485 12.8728 12.8728 13.4812 13.4812 13.7654 13.7654 k = 0.5000-1.1301-0.9464 ( 3842 PWs) bands (ev): -52.5203 -52.5203 -52.5126 -52.5126 -26.9209 -26.9209 -26.8903 -26.8903 -19.4816 -19.4816 -19.4096 -19.4096 -19.2136 -19.2136 -19.0986 -19.0986 -5.8611 -5.8611 -5.8220 -5.8220 -4.4726 -4.4726 -4.1113 -4.1113 2.9742 2.9742 4.1861 4.1861 4.6876 4.6876 4.7594 4.7594 5.1762 5.1762 5.3903 5.3903 5.5883 5.5883 6.0982 6.0982 6.2181 6.2181 6.8450 6.8450 7.5553 7.5553 7.6550 7.6550 11.3646 11.3646 12.7384 12.7384 12.8973 12.8973 13.5036 13.5036 13.7612 13.7612 k = 0.5000-1.1149-0.9721 ( 3846 PWs) bands (ev): -52.5201 -52.5201 -52.5126 -52.5126 -26.9210 -26.9210 -26.8907 -26.8907 -19.4844 -19.4844 -19.4054 -19.4054 -19.2158 -19.2158 -19.1010 -19.1010 -5.8585 -5.8585 -5.8189 -5.8189 -4.4679 -4.4679 -4.1071 -4.1071 2.9991 2.9991 4.1935 4.1935 4.6821 4.6821 4.7523 4.7523 5.1646 5.1646 5.3661 5.3661 5.6058 5.6058 6.0522 6.0522 6.2454 6.2454 6.8095 6.8095 7.5642 7.5642 7.6610 7.6610 11.2955 11.2955 12.6986 12.6986 12.9467 12.9467 13.5289 13.5289 13.7592 13.7592 k = 0.5000-1.0997-0.9978 ( 3848 PWs) bands (ev): -52.5200 -52.5200 -52.5127 -52.5127 -26.9212 -26.9212 -26.8911 -26.8911 -19.4873 -19.4873 -19.4011 -19.4011 -19.2182 -19.2182 -19.1035 -19.1035 -5.8556 -5.8556 -5.8155 -5.8155 -4.4627 -4.4627 -4.1027 -4.1027 3.0268 3.0268 4.2012 4.2012 4.6753 4.6753 4.7424 4.7424 5.1555 5.1555 5.3428 5.3428 5.6249 5.6249 6.0015 6.0015 6.2745 6.2745 6.7719 6.7719 7.5615 7.5615 7.6768 7.6768 11.2268 11.2268 12.6490 12.6490 13.0012 13.0012 13.5566 13.5566 13.7596 13.7596 k = 0.5000-1.0845-1.0236 ( 3846 PWs) bands (ev): -52.5198 -52.5198 -52.5127 -52.5127 -26.9213 -26.9213 -26.8916 -26.8916 -19.4901 -19.4901 -19.3966 -19.3966 -19.2208 -19.2208 -19.1061 -19.1061 -5.8525 -5.8525 -5.8120 -5.8120 -4.4570 -4.4570 -4.0981 -4.0981 3.0571 3.0571 4.2092 4.2092 4.6672 4.6672 4.7293 4.7293 5.1493 5.1493 5.3222 5.3222 5.6444 5.6444 5.9476 5.9476 6.3044 6.3044 6.7324 6.7324 7.5499 7.5499 7.6995 7.6995 11.1590 11.1590 12.5954 12.5954 13.0551 13.0551 13.5854 13.5854 13.7631 13.7631 k = 0.5000-1.0693-1.0493 ( 3844 PWs) bands (ev): -52.5197 -52.5197 -52.5128 -52.5128 -26.9214 -26.9214 -26.8921 -26.8921 -19.4929 -19.4929 -19.3920 -19.3920 -19.2236 -19.2236 -19.1088 -19.1088 -5.8492 -5.8492 -5.8084 -5.8084 -4.4509 -4.4509 -4.0933 -4.0933 3.0900 3.0900 4.2169 4.2169 4.6574 4.6574 4.7134 4.7134 5.1463 5.1463 5.3053 5.3053 5.6635 5.6635 5.8915 5.8915 6.3349 6.3349 6.6910 6.6910 7.5324 7.5324 7.7256 7.7256 11.0928 11.0928 12.5401 12.5401 13.1068 13.1068 13.6137 13.6137 13.7705 13.7705 k = 0.5000-1.0540-1.0750 ( 3848 PWs) bands (ev): -52.5195 -52.5195 -52.5129 -52.5129 -26.9216 -26.9216 -26.8926 -26.8926 -19.4956 -19.4956 -19.3873 -19.3873 -19.2267 -19.2267 -19.1116 -19.1116 -5.8457 -5.8457 -5.8047 -5.8047 -4.4444 -4.4444 -4.0884 -4.0884 3.1255 3.1255 4.2240 4.2240 4.6455 4.6455 4.6953 4.6953 5.1466 5.1466 5.2926 5.2926 5.6810 5.6810 5.8348 5.8348 6.3657 6.3657 6.6480 6.6480 7.5110 7.5110 7.7531 7.7531 11.0283 11.0283 12.4841 12.4841 13.1557 13.1557 13.6394 13.6394 13.7831 13.7831 k = 0.5000-1.0388-1.1007 ( 3848 PWs) bands (ev): -52.5193 -52.5193 -52.5129 -52.5129 -26.9217 -26.9217 -26.8932 -26.8932 -19.4983 -19.4983 -19.3825 -19.3825 -19.2300 -19.2300 -19.1145 -19.1145 -5.8420 -5.8420 -5.8009 -5.8009 -4.4376 -4.4376 -4.0835 -4.0835 3.1633 3.1633 4.2298 4.2298 4.6309 4.6309 4.6769 4.6769 5.1501 5.1501 5.2843 5.2843 5.6926 5.6926 5.7820 5.7820 6.3967 6.3967 6.6035 6.6035 7.4864 7.4864 7.7810 7.7810 10.9661 10.9661 12.4284 12.4284 13.2018 13.2018 13.6606 13.6606 13.8015 13.8015 k = 0.5000-1.0236-1.1265 ( 3852 PWs) bands (ev): -52.5191 -52.5191 -52.5130 -52.5130 -26.9219 -26.9219 -26.8937 -26.8937 -19.5009 -19.5009 -19.3776 -19.3776 -19.2336 -19.2336 -19.1174 -19.1174 -5.8382 -5.8382 -5.7972 -5.7972 -4.4305 -4.4305 -4.0786 -4.0786 3.2033 3.2033 4.2334 4.2334 4.6133 4.6133 4.6598 4.6598 5.1568 5.1568 5.2801 5.2801 5.6783 5.6783 5.7537 5.7537 6.4272 6.4272 6.5582 6.5582 7.4593 7.4593 7.8086 7.8086 10.9063 10.9063 12.3735 12.3735 13.2452 13.2452 13.6770 13.6770 13.8248 13.8248 k = 0.5000-1.0084-1.1522 ( 3854 PWs) bands (ev): -52.5188 -52.5188 -52.5131 -52.5131 -26.9220 -26.9220 -26.8943 -26.8943 -19.5034 -19.5034 -19.3726 -19.3726 -19.2373 -19.2373 -19.1202 -19.1202 -5.8344 -5.8344 -5.7936 -5.7936 -4.4231 -4.4231 -4.0738 -4.0738 3.2454 3.2454 4.2335 4.2335 4.5938 4.5938 4.6449 4.6449 5.1662 5.1662 5.2798 5.2798 5.6292 5.6292 5.7594 5.7594 6.4541 6.4541 6.5154 6.5154 7.4298 7.4298 7.8357 7.8357 10.8493 10.8493 12.3200 12.3200 13.2861 13.2861 13.6894 13.6894 13.8512 13.8512 k = 0.5000-0.9932-1.1779 ( 3848 PWs) bands (ev): -52.5186 -52.5186 -52.5132 -52.5132 -26.9221 -26.9221 -26.8949 -26.8949 -19.5057 -19.5057 -19.3676 -19.3676 -19.2412 -19.2412 -19.1230 -19.1230 -5.8305 -5.8305 -5.7901 -5.7901 -4.4157 -4.4157 -4.0692 -4.0692 3.2894 3.2894 4.2290 4.2290 4.5747 4.5747 4.6322 4.6322 5.1778 5.1778 5.2828 5.2828 5.5702 5.5702 5.7746 5.7746 6.4466 6.4466 6.5059 6.5059 7.3983 7.3983 7.8618 7.8618 10.7953 10.7953 12.2682 12.2682 13.3247 13.3247 13.6993 13.6993 13.8783 13.8783 k = 0.5000-0.9779-1.2037 ( 3842 PWs) bands (ev): -52.5184 -52.5184 -52.5133 -52.5133 -26.9221 -26.9221 -26.8955 -26.8955 -19.5080 -19.5080 -19.3625 -19.3625 -19.2453 -19.2453 -19.1257 -19.1257 -5.8265 -5.8265 -5.7867 -5.7867 -4.4081 -4.4081 -4.0648 -4.0648 3.3351 3.3351 4.2186 4.2186 4.5584 4.5584 4.6215 4.6215 5.1913 5.1913 5.2884 5.2884 5.5098 5.5098 5.7918 5.7918 6.4019 6.4019 6.5330 6.5330 7.3649 7.3649 7.8868 7.8868 10.7447 10.7447 12.2187 12.2187 13.3611 13.3611 13.7077 13.7077 13.9042 13.9042 k = 0.5000-0.9627-1.2294 ( 3846 PWs) bands (ev): -52.5181 -52.5181 -52.5134 -52.5134 -26.9222 -26.9222 -26.8961 -26.8961 -19.5102 -19.5102 -19.3574 -19.3574 -19.2496 -19.2496 -19.1283 -19.1283 -5.8226 -5.8226 -5.7835 -5.7835 -4.4005 -4.4005 -4.0606 -4.0606 3.3822 3.3822 4.2015 4.2015 4.5459 4.5459 4.6133 4.6133 5.2057 5.2057 5.2957 5.2957 5.4507 5.4507 5.8096 5.8096 6.3518 6.3518 6.5648 6.5648 7.3299 7.3299 7.9105 7.9105 10.6976 10.6976 12.1718 12.1718 13.3952 13.3952 13.7153 13.7153 13.9277 13.9277 k = 0.5000-0.9475-1.2551 ( 3848 PWs) bands (ev): -52.5179 -52.5179 -52.5136 -52.5136 -26.9223 -26.9223 -26.8967 -26.8967 -19.5122 -19.5122 -19.3523 -19.3523 -19.2541 -19.2541 -19.1308 -19.1308 -5.8187 -5.8187 -5.7806 -5.7806 -4.3931 -4.3931 -4.0568 -4.0568 3.4306 3.4306 4.1780 4.1780 4.5368 4.5368 4.6085 4.6085 5.2195 5.2195 5.3020 5.3020 5.3969 5.3969 5.8278 5.8278 6.3003 6.3003 6.5976 6.5976 7.2934 7.2934 7.9328 7.9328 10.6542 10.6542 12.1277 12.1277 13.4269 13.4269 13.7226 13.7226 13.9481 13.9481 k = 0.5000-0.9323-1.2808 ( 3836 PWs) bands (ev): -52.5176 -52.5176 -52.5137 -52.5137 -26.9223 -26.9223 -26.8972 -26.8972 -19.5141 -19.5141 -19.3471 -19.3471 -19.2586 -19.2586 -19.1330 -19.1330 -5.8150 -5.8150 -5.7780 -5.7780 -4.3858 -4.3858 -4.0533 -4.0533 3.4799 3.4799 4.1490 4.1490 4.5298 4.5298 4.6084 4.6084 5.2281 5.2281 5.2997 5.2997 5.3604 5.3604 5.8463 5.8463 6.2485 6.2485 6.6309 6.6309 7.2557 7.2557 7.9534 7.9534 10.6147 10.6147 12.0868 12.0868 13.4562 13.4562 13.7298 13.7298 13.9650 13.9650 k = 0.5000-0.9171-1.3066 ( 3834 PWs) bands (ev): -52.5174 -52.5174 -52.5139 -52.5139 -26.9223 -26.9223 -26.8977 -26.8977 -19.5158 -19.5158 -19.3420 -19.3420 -19.2633 -19.2633 -19.1350 -19.1350 -5.8114 -5.8114 -5.7756 -5.7756 -4.3788 -4.3788 -4.0501 -4.0501 3.5297 3.5297 4.1158 4.1158 4.5231 4.5231 4.6138 4.6138 5.2148 5.2148 5.2911 5.2911 5.3547 5.3547 5.8653 5.8653 6.1970 6.1970 6.6644 6.6644 7.2169 7.2169 7.9723 7.9723 10.5794 10.5794 12.0494 12.0494 13.4830 13.4830 13.7369 13.7369 13.9784 13.9784 k = 0.5000-0.9018-1.3323 ( 3832 PWs) bands (ev): -52.5171 -52.5171 -52.5140 -52.5140 -26.9223 -26.9223 -26.8983 -26.8983 -19.5173 -19.5173 -19.3369 -19.3369 -19.2680 -19.2680 -19.1369 -19.1369 -5.8079 -5.8079 -5.7736 -5.7736 -4.3723 -4.3723 -4.0474 -4.0474 3.5796 3.5796 4.0800 4.0800 4.5160 4.5160 4.6246 4.6246 5.1739 5.1739 5.2983 5.2983 5.3629 5.3629 5.8849 5.8849 6.1465 6.1465 6.6979 6.6979 7.1773 7.1773 7.9892 7.9892 10.5483 10.5483 12.0155 12.0155 13.5069 13.5069 13.7440 13.7440 13.9884 13.9884 k = 0.5000-0.8866-1.3580 ( 3832 PWs) bands (ev): -52.5168 -52.5168 -52.5142 -52.5142 -26.9223 -26.9223 -26.8987 -26.8987 -19.5187 -19.5187 -19.3319 -19.3319 -19.2728 -19.2728 -19.1385 -19.1385 -5.8047 -5.8047 -5.7720 -5.7720 -4.3663 -4.3663 -4.0451 -4.0451 3.6294 3.6294 4.0428 4.0428 4.5084 4.5084 4.6401 4.6401 5.1241 5.1241 5.3129 5.3129 5.3737 5.3737 5.9054 5.9054 6.0980 6.0980 6.7313 6.7313 7.1372 7.1372 8.0042 8.0042 10.5216 10.5216 11.9856 11.9856 13.5281 13.5281 13.7510 13.7510 13.9951 13.9951 k = 0.5000-0.8714-1.3837 ( 3836 PWs) bands (ev): -52.5166 -52.5166 -52.5144 -52.5144 -26.9224 -26.9224 -26.8992 -26.8992 -19.5199 -19.5199 -19.3271 -19.3271 -19.2776 -19.2776 -19.1399 -19.1399 -5.8019 -5.8019 -5.7707 -5.7707 -4.3610 -4.3610 -4.0432 -4.0432 3.6783 3.6783 4.0051 4.0051 4.5008 4.5008 4.6592 4.6592 5.0734 5.0734 5.3290 5.3290 5.3838 5.3838 5.9270 5.9270 6.0526 6.0526 6.7645 6.7645 7.0967 7.0967 8.0171 8.0171 10.4994 10.4994 11.9597 11.9597 13.5463 13.5463 13.7577 13.7577 13.9988 13.9988 k = 0.5000-0.8562-1.4095 ( 3840 PWs) bands (ev): -52.5163 -52.5163 -52.5146 -52.5146 -26.9224 -26.9224 -26.8996 -26.8996 -19.5209 -19.5209 -19.3224 -19.3224 -19.2823 -19.2823 -19.1410 -19.1410 -5.7993 -5.7993 -5.7697 -5.7697 -4.3565 -4.3565 -4.0417 -4.0417 3.7260 3.7260 3.9677 3.9677 4.4935 4.4935 4.6811 4.6811 5.0246 5.0246 5.3444 5.3444 5.3917 5.3917 5.9497 5.9497 6.0119 6.0119 6.7972 6.7972 7.0561 7.0561 8.0277 8.0277 10.4819 10.4819 11.9380 11.9380 13.5618 13.5618 13.7639 13.7639 13.9995 13.9995 k = 0.5000-0.8410-1.4352 ( 3840 PWs) bands (ev): -52.5161 -52.5161 -52.5148 -52.5148 -26.9224 -26.9224 -26.8999 -26.8999 -19.5216 -19.5216 -19.3180 -19.3180 -19.2866 -19.2866 -19.1419 -19.1419 -5.7973 -5.7973 -5.7691 -5.7691 -4.3529 -4.3529 -4.0406 -4.0406 3.7717 3.7717 3.9313 3.9313 4.4867 4.4867 4.7050 4.7050 4.9787 4.9787 5.3573 5.3573 5.3966 5.3966 5.9675 5.9675 5.9839 5.9839 6.8293 6.8293 7.0159 7.0159 8.0360 8.0360 10.4691 10.4691 11.9206 11.9206 13.5745 13.5745 13.7694 13.7694 13.9975 13.9975 k = 0.5000-0.8258-1.4609 ( 3844 PWs) bands (ev): -52.5158 -52.5158 -52.5150 -52.5150 -26.9224 -26.9224 -26.9001 -26.9001 -19.5222 -19.5222 -19.3143 -19.3143 -19.2903 -19.2903 -19.1425 -19.1425 -5.7957 -5.7957 -5.7687 -5.7687 -4.3504 -4.3504 -4.0399 -4.0399 3.8147 3.8147 3.8965 3.8965 4.4808 4.4808 4.7302 4.7302 4.9369 4.9369 5.3640 5.3640 5.4000 5.4000 5.9463 5.9463 6.0041 6.0041 6.8604 6.8604 6.9763 6.9763 8.0420 8.0420 10.4612 10.4612 11.9078 11.9078 13.5847 13.5847 13.7740 13.7740 13.9928 13.9928 k = 0.5000-0.8105-1.4866 ( 3844 PWs) bands (ev): -52.5155 -52.5155 -52.5153 -52.5153 -26.9224 -26.9224 -26.9002 -26.9002 -19.5224 -19.5224 -19.3119 -19.3119 -19.2927 -19.2927 -19.1428 -19.1428 -5.7948 -5.7948 -5.7687 -5.7687 -4.3491 -4.3491 -4.0395 -4.0395 3.8499 3.8499 3.8683 3.8683 4.4755 4.4755 4.7559 4.7559 4.9002 4.9002 5.3598 5.3598 5.4054 5.4054 5.9273 5.9273 6.0328 6.0328 6.8890 6.8890 6.9392 6.9392 8.0454 8.0454 10.4581 10.4581 11.8997 11.8997 13.5925 13.5925 13.7775 13.7775 13.9851 13.9851 k = 0.5000-0.7953-1.5124 ( 3840 PWs) bands (ev): -52.5155 -52.5155 -52.5153 -52.5153 -26.9223 -26.9223 -26.9002 -26.9002 -19.5224 -19.5224 -19.3118 -19.3118 -19.2927 -19.2927 -19.1427 -19.1427 -5.7946 -5.7946 -5.7688 -5.7688 -4.3491 -4.3491 -4.0395 -4.0395 3.8296 3.8296 3.8938 3.8938 4.4708 4.4708 4.7806 4.7806 4.8703 4.8703 5.3444 5.3444 5.4128 5.4128 5.9166 5.9166 6.0641 6.0641 6.8910 6.8910 6.9286 6.9286 8.0463 8.0463 10.4601 10.4601 11.8963 11.8963 13.5983 13.5983 13.7799 13.7799 13.9745 13.9745 k = 0.5000-0.7801-1.5381 ( 3846 PWs) bands (ev): -52.5158 -52.5158 -52.5150 -52.5150 -26.9224 -26.9224 -26.9002 -26.9002 -19.5222 -19.5222 -19.3140 -19.3140 -19.2906 -19.2906 -19.1425 -19.1425 -5.7953 -5.7953 -5.7692 -5.7692 -4.3504 -4.3504 -4.0399 -4.0399 3.8012 3.8012 3.9256 3.9256 4.4665 4.4665 4.7996 4.7996 4.8523 4.8523 5.3207 5.3207 5.4196 5.4196 5.9141 5.9141 6.0977 6.0977 6.8576 6.8576 6.9536 6.9536 8.0445 8.0445 10.4671 10.4671 11.8977 11.8977 13.6022 13.6022 13.7809 13.7809 13.9608 13.9608 k = 0.8250-0.7176-1.4243 ( 3846 PWs) bands (ev): -52.5158 -52.5158 -52.5150 -52.5150 -26.9224 -26.9224 -26.9002 -26.9002 -19.5222 -19.5222 -19.3140 -19.3140 -19.2906 -19.2906 -19.1425 -19.1425 -5.7953 -5.7953 -5.7692 -5.7692 -4.3504 -4.3504 -4.0399 -4.0399 3.8012 3.8012 3.9256 3.9256 4.4665 4.4665 4.7996 4.7996 4.8523 4.8523 5.3207 5.3207 5.4196 5.4196 5.9141 5.9141 6.0977 6.0977 6.8576 6.8576 6.9536 6.9536 8.0445 8.0445 10.4671 10.4671 11.8977 11.8977 13.6022 13.6022 13.7809 13.7809 13.9608 13.9608 k = 0.8194-0.7036-1.3988 ( 3846 PWs) bands (ev): -52.5161 -52.5161 -52.5148 -52.5148 -26.9224 -26.9224 -26.8999 -26.8999 -19.5217 -19.5217 -19.3173 -19.3173 -19.2872 -19.2872 -19.1419 -19.1419 -5.7967 -5.7967 -5.7697 -5.7697 -4.3533 -4.3533 -4.0405 -4.0405 3.7750 3.7750 3.9529 3.9529 4.4620 4.4620 4.8025 4.8025 4.8562 4.8562 5.2922 5.2922 5.4246 5.4246 5.9187 5.9187 6.1333 6.1333 6.8229 6.8229 6.9803 6.9803 8.0400 8.0400 10.4792 10.4792 11.9040 11.9040 13.6044 13.6044 13.7806 13.7806 13.9441 13.9441 k = 0.8138-0.6895-1.3732 ( 3846 PWs) bands (ev): -52.5164 -52.5164 -52.5145 -52.5145 -26.9224 -26.9224 -26.8995 -26.8995 -19.5209 -19.5209 -19.3210 -19.3210 -19.2833 -19.2833 -19.1411 -19.1411 -5.7991 -5.7991 -5.7705 -5.7705 -4.3577 -4.3577 -4.0414 -4.0414 3.7514 3.7514 3.9755 3.9755 4.4570 4.4570 4.7965 4.7965 4.8740 4.8740 5.2618 5.2618 5.4273 5.4273 5.9289 5.9289 6.1708 6.1708 6.7897 6.7897 7.0060 7.0060 8.0328 8.0328 10.4965 10.4965 11.9152 11.9152 13.6052 13.6052 13.7788 13.7788 13.9247 13.9247 k = 0.8082-0.6755-1.3477 ( 3848 PWs) bands (ev): -52.5167 -52.5167 -52.5143 -52.5143 -26.9225 -26.9225 -26.8991 -26.8991 -19.5198 -19.5198 -19.3248 -19.3248 -19.2793 -19.2793 -19.1400 -19.1400 -5.8023 -5.8023 -5.7715 -5.7715 -4.3636 -4.3636 -4.0427 -4.0427 3.7304 3.7304 3.9933 3.9933 4.4513 4.4513 4.7929 4.7929 4.8922 4.8922 5.2332 5.2332 5.4275 5.4275 5.9433 5.9433 6.2098 6.2098 6.7583 6.7583 7.0304 7.0304 8.0229 8.0229 10.5190 10.5190 11.9313 11.9313 13.6044 13.6044 13.7750 13.7750 13.9031 13.9031 k = 0.8026-0.6615-1.3222 ( 3848 PWs) bands (ev): -52.5170 -52.5170 -52.5141 -52.5141 -26.9226 -26.9226 -26.8984 -26.8984 -19.5183 -19.5183 -19.3286 -19.3286 -19.2752 -19.2752 -19.1387 -19.1387 -5.8063 -5.8063 -5.7728 -5.7728 -4.3712 -4.3712 -4.0443 -4.0443 3.7122 3.7122 4.0065 4.0065 4.4452 4.4452 4.7937 4.7937 4.9057 4.9057 5.2105 5.2105 5.4250 5.4250 5.9606 5.9606 6.2500 6.2500 6.7292 6.7292 7.0532 7.0532 8.0102 8.0102 10.5468 10.5468 11.9523 11.9523 13.6023 13.6023 13.7685 13.7685 13.8805 13.8805 k = 0.7970-0.6474-1.2966 ( 3848 PWs) bands (ev): -52.5174 -52.5174 -52.5139 -52.5139 -26.9226 -26.9226 -26.8976 -26.8976 -19.5167 -19.5167 -19.3322 -19.3322 -19.2711 -19.2711 -19.1371 -19.1371 -5.8112 -5.8112 -5.7746 -5.7746 -4.3803 -4.3803 -4.0462 -4.0462 3.6968 3.6968 4.0154 4.0154 4.4389 4.4389 4.7969 4.7969 4.9122 4.9122 5.1980 5.1980 5.4199 5.4199 5.9800 5.9800 6.2909 6.2909 6.7027 6.7027 7.0744 7.0744 7.9948 7.9948 10.5800 10.5800 11.9781 11.9781 13.5988 13.5988 13.7574 13.7574 13.8592 13.8592 k = 0.7914-0.6334-1.2711 ( 3856 PWs) bands (ev): -52.5177 -52.5177 -52.5137 -52.5137 -26.9227 -26.9227 -26.8968 -26.8968 -19.5147 -19.5147 -19.3356 -19.3356 -19.2671 -19.2671 -19.1353 -19.1353 -5.8169 -5.8169 -5.7768 -5.7768 -4.3910 -4.3910 -4.0486 -4.0486 3.6842 3.6842 4.0204 4.0204 4.4330 4.4330 4.7982 4.7982 4.9134 4.9134 5.1982 5.1982 5.4124 5.4124 6.0004 6.0004 6.3319 6.3319 6.6791 6.6791 7.0937 7.0937 7.9768 7.9768 10.6185 10.6185 12.0085 12.0085 13.5936 13.5936 13.7397 13.7397 13.8420 13.8420 k = 0.7858-0.6194-1.2455 ( 3850 PWs) bands (ev): -52.5181 -52.5181 -52.5135 -52.5135 -26.9228 -26.9228 -26.8957 -26.8957 -19.5124 -19.5124 -19.3387 -19.3387 -19.2631 -19.2631 -19.1331 -19.1331 -5.8233 -5.8233 -5.7796 -5.7796 -4.4032 -4.4032 -4.0513 -4.0513 3.6744 3.6744 4.0223 4.0223 4.4283 4.4283 4.7913 4.7913 4.9158 4.9158 5.2100 5.2100 5.4026 5.4026 6.0212 6.0212 6.3725 6.3725 6.6587 6.6587 7.1111 7.1111 7.9564 7.9564 10.6625 10.6625 12.0434 12.0434 13.5866 13.5866 13.7142 13.7142 13.8308 13.8308 k = 0.7802-0.6054-1.2200 ( 3858 PWs) bands (ev): -52.5185 -52.5185 -52.5133 -52.5133 -26.9229 -26.9229 -26.8945 -26.8945 -19.5099 -19.5099 -19.3415 -19.3415 -19.2592 -19.2592 -19.1309 -19.1309 -5.8304 -5.8304 -5.7831 -5.7831 -4.4169 -4.4169 -4.0545 -4.0545 3.6672 3.6672 4.0215 4.0215 4.4251 4.4251 4.7724 4.7724 4.9253 4.9253 5.2308 5.2308 5.3909 5.3909 6.0419 6.0419 6.4118 6.4118 6.6419 6.6419 7.1264 7.1264 7.9337 7.9337 10.7119 10.7119 12.0824 12.0824 13.5774 13.5774 13.6825 13.6825 13.8253 13.8253 k = 0.7746-0.5913-1.1945 ( 3850 PWs) bands (ev): -52.5189 -52.5189 -52.5131 -52.5131 -26.9229 -26.9229 -26.8931 -26.8931 -19.5070 -19.5070 -19.3440 -19.3440 -19.2554 -19.2554 -19.1283 -19.1283 -5.8383 -5.8383 -5.7872 -5.7872 -4.4320 -4.4320 -4.0582 -4.0582 3.6625 3.6625 4.0187 4.0187 4.4238 4.4238 4.7438 4.7438 4.9420 4.9420 5.2572 5.2572 5.3777 5.3777 6.0619 6.0619 6.4487 6.4487 6.6295 6.6295 7.1394 7.1394 7.9091 7.9091 10.7665 10.7665 12.1250 12.1250 13.5655 13.5655 13.6474 13.6474 13.8240 13.8240 k = 0.7690-0.5773-1.1689 ( 3852 PWs) bands (ev): -52.5193 -52.5193 -52.5129 -52.5129 -26.9230 -26.9230 -26.8916 -26.8916 -19.5039 -19.5039 -19.3462 -19.3462 -19.2516 -19.2516 -19.1257 -19.1257 -5.8468 -5.8468 -5.7920 -5.7920 -4.4483 -4.4483 -4.0625 -4.0625 3.6602 3.6602 4.0144 4.0144 4.4246 4.4246 4.7100 4.7100 4.9630 4.9630 5.2865 5.2865 5.3643 5.3643 6.0808 6.0808 6.4815 6.4815 6.6229 6.6229 7.1498 7.1498 7.8831 7.8831 10.8262 10.8262 12.1708 12.1708 13.5492 13.5492 13.6120 13.6120 13.8258 13.8258 k = 0.7634-0.5633-1.1434 ( 3850 PWs) bands (ev): -52.5197 -52.5197 -52.5128 -52.5128 -26.9230 -26.9230 -26.8900 -26.8900 -19.5006 -19.5006 -19.3479 -19.3479 -19.2479 -19.2479 -19.1228 -19.1228 -5.8560 -5.8560 -5.7976 -5.7976 -4.4658 -4.4658 -4.0673 -4.0673 3.6598 3.6598 4.0092 4.0092 4.4275 4.4275 4.6745 4.6745 4.9861 4.9861 5.3123 5.3123 5.3557 5.3557 6.0983 6.0983 6.5075 6.5075 6.6243 6.6243 7.1573 7.1573 7.8563 7.8563 10.8908 10.8908 12.2191 12.2191 13.5257 13.5257 13.5807 13.5807 13.8300 13.8300 k = 0.7578-0.5492-1.1179 ( 3846 PWs) bands (ev): -52.5202 -52.5202 -52.5126 -52.5126 -26.9229 -26.9229 -26.8883 -26.8883 -19.4969 -19.4969 -19.3493 -19.3493 -19.2442 -19.2442 -19.1198 -19.1198 -5.8659 -5.8659 -5.8041 -5.8041 -4.4844 -4.4844 -4.0727 -4.0727 3.6612 3.6612 4.0035 4.0035 4.4325 4.4325 4.6396 4.6396 5.0096 5.0096 5.3156 5.3156 5.3707 5.3707 6.1139 6.1139 6.5244 6.5244 6.6359 6.6359 7.1615 7.1615 7.8293 7.8293 10.9600 10.9600 12.2689 12.2689 13.4935 13.4935 13.5564 13.5564 13.8360 13.8360 k = 0.7522-0.5352-1.0923 ( 3856 PWs) bands (ev): -52.5206 -52.5206 -52.5125 -52.5125 -26.9229 -26.9229 -26.8866 -26.8866 -19.4932 -19.4932 -19.3503 -19.3503 -19.2406 -19.2406 -19.1167 -19.1167 -5.8765 -5.8765 -5.8115 -5.8115 -4.5039 -4.5039 -4.0788 -4.0788 3.6638 3.6638 3.9977 3.9977 4.4394 4.4394 4.6068 4.6068 5.0322 5.0322 5.3029 5.3029 5.4028 5.4028 6.1276 6.1276 6.5330 6.5330 6.6562 6.6562 7.1618 7.1618 7.8030 7.8030 11.0332 11.0332 12.3193 12.3193 13.4558 13.4558 13.5369 13.5369 13.8433 13.8433 k = 0.7466-0.5212-1.0668 ( 3856 PWs) bands (ev): -52.5211 -52.5211 -52.5124 -52.5124 -26.9229 -26.9229 -26.8846 -26.8846 -19.4892 -19.4892 -19.3509 -19.3509 -19.2370 -19.2370 -19.1135 -19.1135 -5.8877 -5.8877 -5.8198 -5.8198 -4.5243 -4.5243 -4.0855 -4.0855 3.6673 3.6673 3.9921 3.9921 4.4479 4.4479 4.5777 4.5777 5.0527 5.0527 5.2881 5.2881 5.4386 5.4386 6.1390 6.1390 6.5370 6.5370 6.6814 6.6814 7.1577 7.1577 7.7784 7.7784 11.1098 11.1098 12.3692 12.3692 13.4165 13.4165 13.5195 13.5195 13.8511 13.8511 k = 0.7410-0.5071-1.0412 ( 3852 PWs) bands (ev): -52.5216 -52.5216 -52.5123 -52.5123 -26.9227 -26.9227 -26.8826 -26.8826 -19.4851 -19.4851 -19.3509 -19.3509 -19.2333 -19.2333 -19.1101 -19.1101 -5.8995 -5.8995 -5.8291 -5.8291 -4.5453 -4.5453 -4.0928 -4.0928 3.6709 3.6709 3.9871 3.9871 4.4575 4.4575 4.5536 4.5536 5.0697 5.0697 5.2748 5.2748 5.4753 5.4753 6.1480 6.1480 6.5395 6.5395 6.7082 6.7082 7.1487 7.1487 7.7565 7.7565 11.1892 11.1892 12.4171 12.4171 13.3776 13.3776 13.5030 13.5030 13.8590 13.8590 k = 0.7354-0.4931-1.0157 ( 3850 PWs) bands (ev): -52.5220 -52.5220 -52.5122 -52.5122 -26.9225 -26.9225 -26.8805 -26.8805 -19.4808 -19.4808 -19.3505 -19.3505 -19.2296 -19.2296 -19.1067 -19.1067 -5.9119 -5.9119 -5.8395 -5.8395 -4.5668 -4.5668 -4.1008 -4.1008 3.6742 3.6742 3.9828 3.9828 4.4673 4.4673 4.5362 4.5362 5.0816 5.0816 5.2653 5.2653 5.5122 5.5122 6.1546 6.1546 6.5420 6.5420 6.7349 6.7349 7.1341 7.1341 7.7382 7.7382 11.2704 11.2704 12.4616 12.4616 13.3406 13.3406 13.4870 13.4870 13.8670 13.8670 k = 0.7297-0.4791-0.9902 ( 3856 PWs) bands (ev): -52.5225 -52.5225 -52.5121 -52.5121 -26.9224 -26.9224 -26.8783 -26.8783 -19.4765 -19.4765 -19.3497 -19.3497 -19.2260 -19.2260 -19.1033 -19.1033 -5.9250 -5.9250 -5.8509 -5.8509 -4.5888 -4.5888 -4.1095 -4.1095 3.6766 3.6766 3.9794 3.9794 4.4757 4.4757 4.5275 4.5275 5.0868 5.0868 5.2615 5.2615 5.5486 5.5486 6.1587 6.1587 6.5452 6.5452 6.7605 6.7605 7.1139 7.1139 7.7241 7.7241 11.3522 11.3522 12.5014 12.5014 13.3064 13.3064 13.4714 13.4714 13.8759 13.8759 k = 0.7241-0.4651-0.9646 ( 3854 PWs) bands (ev): -52.5231 -52.5231 -52.5120 -52.5120 -26.9221 -26.9221 -26.8760 -26.8760 -19.4721 -19.4721 -19.3483 -19.3483 -19.2222 -19.2222 -19.0998 -19.0998 -5.9386 -5.9386 -5.8634 -5.8634 -4.6111 -4.6111 -4.1188 -4.1188 3.6775 3.6775 3.9772 3.9772 4.4819 4.4819 4.5289 4.5289 5.0844 5.0844 5.2644 5.2644 5.5841 5.5841 6.1605 6.1605 6.5493 6.5493 6.7848 6.7848 7.0880 7.0880 7.7148 7.7148 11.4335 11.4335 12.5350 12.5350 13.2758 13.2758 13.4559 13.4559 13.8874 13.8874 k = 0.7185-0.4510-0.9391 ( 3860 PWs) bands (ev): -52.5236 -52.5236 -52.5119 -52.5119 -26.9218 -26.9218 -26.8737 -26.8737 -19.4678 -19.4678 -19.3463 -19.3463 -19.2184 -19.2184 -19.0964 -19.0964 -5.9528 -5.9528 -5.8770 -5.8770 -4.6336 -4.6336 -4.1288 -4.1288 3.6765 3.6765 3.9761 3.9761 4.4883 4.4883 4.5381 4.5381 5.0756 5.0756 5.2734 5.2734 5.6182 5.6182 6.1599 6.1599 6.5545 6.5545 6.8074 6.8074 7.0570 7.0570 7.7101 7.7101 11.5127 11.5127 12.5616 12.5616 13.2493 13.2493 13.4404 13.4404 13.9034 13.9034 k = 0.7129-0.4370-0.9136 ( 3862 PWs) bands (ev): -52.5241 -52.5241 -52.5119 -52.5119 -26.9214 -26.9214 -26.8712 -26.8712 -19.4634 -19.4634 -19.3439 -19.3439 -19.2145 -19.2145 -19.0929 -19.0929 -5.9675 -5.9675 -5.8918 -5.8918 -4.6560 -4.6560 -4.1394 -4.1394 3.6735 3.6735 3.9763 3.9763 4.4985 4.4985 4.5516 4.5516 5.0620 5.0620 5.2871 5.2871 5.6503 5.6503 6.1573 6.1573 6.5607 6.5607 6.8282 6.8282 7.0217 7.0217 7.7099 7.7099 11.5883 11.5883 12.5805 12.5805 13.2273 13.2273 13.4246 13.4246 13.9254 13.9254 k = 0.7073-0.4230-0.8880 ( 3862 PWs) bands (ev): -52.5246 -52.5246 -52.5119 -52.5119 -26.9211 -26.9211 -26.8687 -26.8687 -19.4592 -19.4592 -19.3409 -19.3409 -19.2104 -19.2104 -19.0894 -19.0894 -5.9828 -5.9828 -5.9077 -5.9077 -4.6784 -4.6784 -4.1505 -4.1505 3.6683 3.6683 3.9779 3.9779 4.5142 4.5142 4.5669 4.5669 5.0455 5.0455 5.3042 5.3042 5.6797 5.6797 6.1531 6.1531 6.5681 6.5681 6.8470 6.8470 6.9836 6.9836 7.7138 7.7138 11.6588 11.6588 12.5916 12.5916 13.2100 13.2100 13.4085 13.4085 13.9545 13.9545 k = 0.7017-0.4089-0.8625 ( 3872 PWs) bands (ev): -52.5252 -52.5252 -52.5118 -52.5118 -26.9207 -26.9207 -26.8662 -26.8662 -19.4551 -19.4551 -19.3374 -19.3374 -19.2062 -19.2062 -19.0860 -19.0860 -5.9985 -5.9985 -5.9248 -5.9248 -4.7006 -4.7006 -4.1622 -4.1622 3.6613 3.6613 3.9809 3.9809 4.5357 4.5357 4.5834 4.5834 5.0274 5.0274 5.3238 5.3238 5.7055 5.7055 6.1476 6.1476 6.5764 6.5764 6.8624 6.8624 6.9449 6.9449 7.7211 7.7211 11.7227 11.7227 12.5953 12.5953 13.1970 13.1970 13.3921 13.3921 13.9911 13.9911 k = 0.6961-0.3949-0.8369 ( 3870 PWs) bands (ev): -52.5257 -52.5257 -52.5118 -52.5118 -26.9202 -26.9202 -26.8636 -26.8636 -19.4511 -19.4511 -19.3332 -19.3332 -19.2019 -19.2019 -19.0826 -19.0826 -6.0147 -6.0147 -5.9430 -5.9430 -4.7225 -4.7225 -4.1744 -4.1744 3.6527 3.6527 3.9854 3.9854 4.5613 4.5613 4.6018 4.6018 5.0085 5.0085 5.3458 5.3458 5.7266 5.7266 6.1416 6.1416 6.5858 6.5858 6.8672 6.8672 6.9144 6.9144 7.7314 7.7314 11.7786 11.7786 12.5924 12.5924 13.1875 13.1875 13.3756 13.3756 14.0357 14.0357 k = 0.6905-0.3809-0.8114 ( 3876 PWs) bands (ev): -52.5263 -52.5263 -52.5118 -52.5118 -26.9197 -26.9197 -26.8610 -26.8610 -19.4473 -19.4473 -19.3286 -19.3286 -19.1974 -19.1974 -19.0793 -19.0793 -6.0314 -6.0314 -5.9623 -5.9623 -4.7440 -4.7440 -4.1871 -4.1871 3.6430 3.6430 3.9915 3.9915 4.5862 4.5862 4.6259 4.6259 4.9893 4.9893 5.3700 5.3700 5.7421 5.7421 6.1355 6.1355 6.5960 6.5960 6.8432 6.8432 6.9114 6.9114 7.7440 7.7440 11.8259 11.8259 12.5836 12.5836 13.1802 13.1802 13.3592 13.3592 14.0886 14.0886 k = 0.6849-0.3668-0.7859 ( 3874 PWs) bands (ev): -52.5268 -52.5268 -52.5118 -52.5118 -26.9191 -26.9191 -26.8583 -26.8583 -19.4437 -19.4437 -19.3235 -19.3235 -19.1927 -19.1927 -19.0761 -19.0761 -6.0486 -6.0486 -5.9826 -5.9826 -4.7650 -4.7650 -4.2002 -4.2002 3.6327 3.6327 3.9991 3.9991 4.6043 4.6043 4.6608 4.6608 4.9703 4.9703 5.3967 5.3967 5.7508 5.7508 6.1298 6.1298 6.6070 6.6070 6.8065 6.8065 6.9216 6.9216 7.7585 7.7585 11.8640 11.8640 12.5698 12.5698 13.1733 13.1733 13.3434 13.3434 14.1498 14.1498 k = 0.6793-0.3528-0.7603 ( 3872 PWs) bands (ev): -52.5274 -52.5274 -52.5118 -52.5118 -26.9184 -26.9184 -26.8556 -26.8556 -19.4402 -19.4402 -19.3178 -19.3178 -19.1879 -19.1879 -19.0729 -19.0729 -6.0661 -6.0661 -6.0040 -6.0040 -4.7854 -4.7854 -4.2137 -4.2137 3.6224 3.6224 4.0084 4.0084 4.6161 4.6161 4.7047 4.7047 4.9515 4.9515 5.4260 5.4260 5.7522 5.7522 6.1246 6.1246 6.6186 6.6186 6.7702 6.7702 6.9332 6.9332 7.7746 7.7746 11.8933 11.8933 12.5520 12.5520 13.1650 13.1650 13.3285 13.3285 14.2191 14.2191 k = 0.6737-0.3388-0.7348 ( 3876 PWs) bands (ev): -52.5279 -52.5279 -52.5119 -52.5119 -26.9178 -26.9178 -26.8529 -26.8529 -19.4370 -19.4370 -19.3117 -19.3117 -19.1828 -19.1828 -19.0698 -19.0698 -6.0841 -6.0841 -6.0263 -6.0263 -4.8052 -4.8052 -4.2275 -4.2275 3.6124 3.6124 4.0192 4.0192 4.6238 4.6238 4.7547 4.7547 4.9333 4.9333 5.4583 5.4583 5.7457 5.7457 6.1192 6.1192 6.6304 6.6304 6.7380 6.7380 6.9443 6.9443 7.7918 7.7918 11.9144 11.9144 12.5308 12.5308 13.1535 13.1535 13.3147 13.3147 14.2939 14.2939 k = 0.6681-0.3247-0.7092 ( 3876 PWs) bands (ev): -52.5285 -52.5285 -52.5119 -52.5119 -26.9171 -26.9171 -26.8501 -26.8501 -19.4340 -19.4340 -19.3053 -19.3053 -19.1776 -19.1776 -19.0669 -19.0669 -6.1025 -6.1025 -6.0494 -6.0494 -4.8243 -4.8243 -4.2417 -4.2417 3.6033 3.6033 4.0316 4.0316 4.6281 4.6281 4.8081 4.8081 4.9165 4.9165 5.4937 5.4937 5.7319 5.7319 6.1127 6.1127 6.6415 6.6415 6.7126 6.7126 6.9546 6.9546 7.8100 7.8100 11.9281 11.9281 12.5068 12.5068 13.1376 13.1376 13.3020 13.3020 14.3630 14.3630 k = 0.6625-0.3107-0.6837 ( 3878 PWs) bands (ev): -52.5290 -52.5290 -52.5119 -52.5119 -26.9164 -26.9164 -26.8474 -26.8474 -19.4312 -19.4312 -19.2985 -19.2985 -19.1722 -19.1722 -19.0640 -19.0640 -6.1213 -6.1213 -6.0731 -6.0731 -4.8427 -4.8427 -4.2560 -4.2560 3.5953 3.5953 4.0457 4.0457 4.6296 4.6296 4.8581 4.8581 4.9070 4.9070 5.5322 5.5322 5.7114 5.7114 6.1039 6.1039 6.6497 6.6497 6.6977 6.6977 6.9639 6.9639 7.8288 7.8288 11.9358 11.9358 12.4806 12.4806 13.1165 13.1165 13.2904 13.2904 14.3947 14.3947 k = 0.6569-0.2967-0.6582 ( 3888 PWs) bands (ev): -52.5296 -52.5296 -52.5120 -52.5120 -26.9157 -26.9157 -26.8447 -26.8447 -19.4286 -19.4286 -19.2914 -19.2914 -19.1666 -19.1666 -19.0613 -19.0613 -6.1406 -6.1406 -6.0973 -6.0973 -4.8603 -4.8603 -4.2706 -4.2706 3.5889 3.5889 4.0612 4.0612 4.6283 4.6283 4.8677 4.8677 4.9406 4.9406 5.5737 5.5737 5.6852 5.6852 6.0917 6.0917 6.6521 6.6521 6.6966 6.6966 6.9721 6.9721 7.8480 7.8480 11.9385 11.9385 12.4525 12.4525 13.0902 13.0902 13.2795 13.2795 14.3931 14.3931 k = 0.6513-0.2827-0.6326 ( 3882 PWs) bands (ev): -52.5301 -52.5301 -52.5120 -52.5120 -26.9148 -26.9148 -26.8420 -26.8420 -19.4262 -19.4262 -19.2839 -19.2839 -19.1608 -19.1608 -19.0586 -19.0586 -6.1605 -6.1605 -6.1217 -6.1217 -4.8772 -4.8772 -4.2853 -4.2853 3.5842 3.5842 4.0784 4.0784 4.6248 4.6248 4.8534 4.8534 4.9999 4.9999 5.6173 5.6173 5.6551 5.6551 6.0758 6.0758 6.6524 6.6524 6.7059 6.7059 6.9793 6.9793 7.8675 7.8675 11.9373 11.9373 12.4230 12.4230 13.0586 13.0586 13.2691 13.2691 14.3767 14.3767 k = 0.6457-0.2686-0.6071 ( 3878 PWs) bands (ev): -52.5307 -52.5307 -52.5121 -52.5121 -26.9139 -26.9139 -26.8392 -26.8392 -19.4239 -19.4239 -19.2763 -19.2763 -19.1548 -19.1548 -19.0561 -19.0561 -6.1812 -6.1812 -6.1459 -6.1459 -4.8932 -4.8932 -4.3001 -4.3001 3.5816 3.5816 4.0969 4.0969 4.6192 4.6192 4.8364 4.8364 5.0626 5.0626 5.6171 5.6171 5.6679 5.6679 6.0567 6.0567 6.6561 6.6561 6.7193 6.7193 6.9855 6.9855 7.8870 7.8870 11.9332 11.9332 12.3923 12.3923 13.0222 13.0222 13.2590 13.2590 14.3508 14.3508 k = 0.6401-0.2546-0.5816 ( 3876 PWs) bands (ev): -52.5312 -52.5312 -52.5122 -52.5122 -26.9131 -26.9131 -26.8365 -26.8365 -19.4219 -19.4219 -19.2685 -19.2685 -19.1487 -19.1487 -19.0538 -19.0538 -6.2030 -6.2030 -6.1696 -6.1696 -4.9085 -4.9085 -4.3149 -4.3149 3.5811 3.5811 4.1169 4.1169 4.6118 4.6118 4.8189 4.8189 5.1251 5.1251 5.5800 5.5800 5.7172 5.7172 6.0360 6.0360 6.6647 6.6647 6.7343 6.7343 6.9908 6.9908 7.9065 7.9065 11.9271 11.9271 12.3607 12.3607 12.9815 12.9815 13.2491 13.2491 14.3176 14.3176 k = 0.6345-0.2406-0.5560 ( 3872 PWs) bands (ev): -52.5317 -52.5317 -52.5122 -52.5122 -26.9122 -26.9122 -26.8338 -26.8338 -19.4199 -19.4199 -19.2605 -19.2605 -19.1424 -19.1424 -19.0515 -19.0515 -6.2261 -6.2261 -6.1922 -6.1922 -4.9229 -4.9229 -4.3298 -4.3298 3.5829 3.5829 4.1381 4.1381 4.6030 4.6030 4.8014 4.8014 5.1852 5.1852 5.5400 5.5400 5.7691 5.7691 6.0160 6.0160 6.6777 6.6777 6.7498 6.7498 6.9954 6.9954 7.9257 7.9257 11.9195 11.9195 12.3285 12.3285 12.9368 12.9368 13.2393 13.2393 14.2782 14.2782 k = 0.6289-0.2265-0.5305 ( 3872 PWs) bands (ev): -52.5322 -52.5322 -52.5123 -52.5123 -26.9114 -26.9114 -26.8312 -26.8312 -19.4182 -19.4182 -19.2526 -19.2526 -19.1360 -19.1360 -19.0494 -19.0494 -6.2504 -6.2504 -6.2136 -6.2136 -4.9366 -4.9366 -4.3445 -4.3445 3.5871 3.5871 4.1604 4.1604 4.5931 4.5931 4.7842 4.7842 5.2402 5.2402 5.4985 5.4985 5.8228 5.8228 5.9996 5.9996 6.6940 6.6940 6.7655 6.7655 6.9994 6.9994 7.9446 7.9446 11.9110 11.9110 12.2960 12.2960 12.8888 12.8888 13.2294 13.2294 14.2332 14.2332 k = 0.6233-0.2125-0.5049 ( 3868 PWs) bands (ev): -52.5327 -52.5327 -52.5124 -52.5124 -26.9105 -26.9105 -26.8286 -26.8286 -19.4166 -19.4166 -19.2445 -19.2445 -19.1295 -19.1295 -19.0475 -19.0475 -6.2757 -6.2757 -6.2340 -6.2340 -4.9495 -4.9495 -4.3591 -4.3591 3.5939 3.5939 4.1836 4.1836 4.5823 4.5823 4.7674 4.7674 5.2869 5.2869 5.4563 5.4563 5.8771 5.8771 5.9910 5.9910 6.7126 6.7126 6.7808 6.7808 7.0032 7.0032 7.9631 7.9631 11.9022 11.9022 12.2633 12.2633 12.8382 12.8382 13.2196 13.2196 14.1830 14.1830 k = 0.6177-0.1985-0.4794 ( 3874 PWs) bands (ev): -52.5332 -52.5332 -52.5125 -52.5125 -26.9097 -26.9097 -26.8261 -26.8261 -19.4152 -19.4152 -19.2366 -19.2366 -19.1230 -19.1230 -19.0457 -19.0457 -6.3016 -6.3016 -6.2535 -6.2535 -4.9616 -4.9616 -4.3735 -4.3735 3.6033 3.6033 4.2074 4.2074 4.5709 4.5709 4.7514 4.7514 5.3207 5.3207 5.4145 5.4145 5.9303 5.9303 5.9954 5.9954 6.7325 6.7325 6.7956 6.7956 7.0070 7.0070 7.9808 7.9808 11.8933 11.8933 12.2307 12.2307 12.7854 12.7854 13.2095 13.2095 14.1278 14.1278 k = 0.6121-0.1844-0.4539 ( 3880 PWs) bands (ev): -52.5337 -52.5337 -52.5126 -52.5126 -26.9089 -26.9089 -26.8236 -26.8236 -19.4139 -19.4139 -19.2287 -19.2287 -19.1165 -19.1165 -19.0441 -19.0441 -6.3279 -6.3279 -6.2722 -6.2722 -4.9730 -4.9730 -4.3877 -4.3877 3.6153 3.6153 4.2314 4.2314 4.5593 4.5593 4.7364 4.7364 5.3347 5.3347 5.3778 5.3778 5.9778 5.9778 6.0202 6.0202 6.7526 6.7526 6.8097 6.8097 7.0113 7.0113 7.9978 7.9978 11.8845 11.8845 12.1984 12.1984 12.7312 12.7312 13.1991 13.1991 14.0679 14.0679 k = 0.6065-0.1704-0.4283 ( 3884 PWs) bands (ev): -52.5341 -52.5341 -52.5127 -52.5127 -26.9081 -26.9081 -26.8212 -26.8212 -19.4128 -19.4128 -19.2208 -19.2208 -19.1099 -19.1099 -19.0427 -19.0427 -6.3540 -6.3540 -6.2902 -6.2902 -4.9837 -4.9837 -4.4016 -4.4016 3.6299 3.6299 4.2552 4.2552 4.5479 4.5479 4.7227 4.7227 5.3141 5.3141 5.3597 5.3597 6.0205 6.0205 6.0657 6.0657 6.7716 6.7716 6.8234 6.8234 7.0165 7.0165 8.0138 8.0138 11.8761 11.8761 12.1666 12.1666 12.6762 12.6762 13.1884 13.1884 14.0039 14.0039 k = 0.6009-0.1564-0.4028 ( 3882 PWs) bands (ev): -52.5346 -52.5346 -52.5128 -52.5128 -26.9073 -26.9073 -26.8189 -26.8189 -19.4117 -19.4117 -19.2131 -19.2131 -19.1034 -19.1034 -19.0413 -19.0413 -6.3799 -6.3799 -6.3076 -6.3076 -4.9936 -4.9936 -4.4152 -4.4152 3.6472 3.6472 4.2779 4.2779 4.5373 4.5373 4.7105 4.7105 5.2756 5.2756 5.3449 5.3449 6.0694 6.0694 6.1190 6.1190 6.7883 6.7883 6.8373 6.8373 7.0229 7.0229 8.0287 8.0287 11.8681 11.8681 12.1356 12.1356 12.6210 12.6210 13.1771 13.1771 13.9365 13.9365 k = 0.5953-0.1424-0.3773 ( 3882 PWs) bands (ev): -52.5350 -52.5350 -52.5128 -52.5128 -26.9065 -26.9065 -26.8166 -26.8166 -19.4107 -19.4107 -19.2055 -19.2055 -19.0969 -19.0969 -19.0402 -19.0402 -6.4054 -6.4054 -6.3244 -6.3244 -5.0029 -5.0029 -4.4284 -4.4284 3.6671 3.6671 4.2988 4.2988 4.5282 4.5282 4.7002 4.7002 5.2349 5.2349 5.3206 5.3206 6.1277 6.1277 6.1737 6.1737 6.8012 6.8012 6.8526 6.8526 7.0308 7.0308 8.0422 8.0422 11.8607 11.8607 12.1055 12.1055 12.5662 12.5662 13.1650 13.1650 13.8668 13.8668 k = 0.5897-0.1283-0.3517 ( 3880 PWs) bands (ev): -52.5354 -52.5354 -52.5129 -52.5129 -26.9057 -26.9057 -26.8145 -26.8145 -19.4099 -19.4099 -19.1980 -19.1980 -19.0906 -19.0906 -19.0391 -19.0391 -6.4302 -6.4302 -6.3405 -6.3405 -5.0115 -5.0115 -4.4411 -4.4411 3.6897 3.6897 4.3165 4.3165 4.5214 4.5214 4.6921 4.6921 5.1944 5.1944 5.2876 5.2876 6.1934 6.1934 6.2280 6.2280 6.8099 6.8099 6.8695 6.8695 7.0402 7.0402 8.0543 8.0543 11.8537 11.8537 12.0766 12.0766 12.5124 12.5124 13.1521 13.1521 13.7960 13.7960 k = 0.5841-0.1143-0.3262 ( 3878 PWs) bands (ev): -52.5358 -52.5358 -52.5130 -52.5130 -26.9049 -26.9049 -26.8124 -26.8124 -19.4091 -19.4091 -19.1908 -19.1908 -19.0843 -19.0843 -19.0383 -19.0383 -6.4542 -6.4542 -6.3560 -6.3560 -5.0195 -5.0195 -4.4533 -4.4533 3.7148 3.7148 4.3298 4.3298 4.5177 4.5177 4.6868 4.6868 5.1546 5.1546 5.2483 5.2483 6.2610 6.2610 6.2836 6.2836 6.8155 6.8155 6.8875 6.8875 7.0510 7.0510 8.0645 8.0645 11.8470 11.8470 12.0492 12.0492 12.4601 12.4601 13.1383 13.1383 13.7254 13.7254 k = 0.5785-0.1003-0.3006 ( 3872 PWs) bands (ev): -52.5362 -52.5362 -52.5131 -52.5131 -26.9041 -26.9041 -26.8105 -26.8105 -19.4083 -19.4083 -19.1837 -19.1837 -19.0783 -19.0783 -19.0375 -19.0375 -6.4773 -6.4773 -6.3708 -6.3708 -5.0269 -5.0269 -4.4650 -4.4650 3.7425 3.7425 4.3377 4.3377 4.5174 4.5174 4.6847 4.6847 5.1156 5.1156 5.2048 5.2048 6.3174 6.3174 6.3504 6.3504 6.8194 6.8194 6.9058 6.9058 7.0630 7.0630 8.0729 8.0729 11.8406 11.8406 12.0235 12.0235 12.4100 12.4100 13.1232 13.1232 13.6563 13.6563 k = 0.5728-0.0862-0.2751 ( 3874 PWs) bands (ev): -52.5365 -52.5365 -52.5132 -52.5132 -26.9034 -26.9034 -26.8086 -26.8086 -19.4078 -19.4078 -19.1770 -19.1770 -19.0725 -19.0725 -19.0370 -19.0370 -6.4993 -6.4993 -6.3848 -6.3848 -5.0337 -5.0337 -4.4762 -4.4762 3.7726 3.7726 4.3403 4.3403 4.5200 4.5200 4.6865 4.6865 5.0771 5.0771 5.1590 5.1590 6.3619 6.3619 6.4265 6.4265 6.8232 6.8232 6.9238 6.9238 7.0757 7.0757 8.0791 8.0791 11.8342 11.8342 11.9997 11.9997 12.3624 12.3624 13.1068 13.1068 13.5898 13.5898 k = 0.5672-0.0722-0.2496 ( 3876 PWs) bands (ev): -52.5369 -52.5369 -52.5133 -52.5133 -26.9028 -26.9028 -26.8069 -26.8069 -19.4072 -19.4072 -19.1706 -19.1706 -19.0670 -19.0670 -19.0365 -19.0365 -6.5202 -6.5202 -6.3980 -6.3980 -5.0399 -5.0399 -4.4866 -4.4866 3.8051 3.8051 4.3382 4.3382 4.5240 4.5240 4.6926 4.6926 5.0382 5.0382 5.1131 5.1131 6.3988 6.3988 6.5047 6.5047 6.8284 6.8284 6.9414 6.9414 7.0889 7.0889 8.0830 8.0830 11.8275 11.8275 11.9782 11.9782 12.3179 12.3179 13.0890 13.0890 13.5268 13.5268 k = 0.5616-0.0582-0.2240 ( 3878 PWs) bands (ev): -52.5372 -52.5372 -52.5133 -52.5133 -26.9022 -26.9022 -26.8053 -26.8053 -19.4068 -19.4068 -19.1645 -19.1645 -19.0619 -19.0619 -19.0362 -19.0362 -6.5398 -6.5398 -6.4104 -6.4104 -5.0456 -5.0456 -4.4965 -4.4965 3.8399 3.8399 4.3329 4.3329 4.5278 4.5278 4.7029 4.7029 4.9972 4.9972 5.0698 5.0698 6.4284 6.4284 6.5827 6.5827 6.8363 6.8363 6.9582 6.9582 7.1023 7.1023 8.0845 8.0845 11.8202 11.8202 11.9593 11.9593 12.2769 12.2769 13.0696 13.0696 13.4681 13.4681 k = 0.5560-0.0441-0.1985 ( 3874 PWs) bands (ev): -52.5375 -52.5375 -52.5134 -52.5134 -26.9015 -26.9015 -26.8038 -26.8038 -19.4063 -19.4063 -19.1587 -19.1587 -19.0570 -19.0570 -19.0360 -19.0360 -6.5581 -6.5581 -6.4219 -6.4219 -5.0507 -5.0507 -4.5056 -4.5056 3.8768 3.8768 4.3257 4.3257 4.5305 4.5305 4.7168 4.7168 4.9525 4.9525 5.0316 5.0316 6.4502 6.4502 6.6590 6.6590 6.8476 6.8476 6.9744 6.9744 7.1156 7.1156 8.0835 8.0835 11.8122 11.8122 11.9430 11.9430 12.2397 12.2397 13.0486 13.0486 13.4144 13.4144 k = 0.5504-0.0301-0.1730 ( 3880 PWs) bands (ev): -52.5377 -52.5377 -52.5135 -52.5135 -26.9010 -26.9010 -26.8025 -26.8025 -19.4060 -19.4060 -19.1534 -19.1534 -19.0527 -19.0527 -19.0358 -19.0358 -6.5748 -6.5748 -6.4324 -6.4324 -5.0553 -5.0553 -4.5139 -4.5139 3.9158 3.9158 4.3175 4.3175 4.5317 4.5317 4.7328 4.7328 4.9041 4.9041 4.9994 4.9994 6.4645 6.4645 6.7322 6.7322 6.8625 6.8625 6.9899 6.9899 7.1287 7.1287 8.0800 8.0800 11.8033 11.8033 11.9293 11.9293 12.2068 12.2068 13.0261 13.0261 13.3662 13.3662 k = 0.5448-0.0161-0.1474 ( 3880 PWs) bands (ev): -52.5380 -52.5380 -52.5135 -52.5135 -26.9005 -26.9005 -26.8013 -26.8013 -19.4057 -19.4057 -19.1485 -19.1485 -19.0487 -19.0487 -19.0357 -19.0357 -6.5901 -6.5901 -6.4419 -6.4419 -5.0593 -5.0593 -4.5215 -4.5215 3.9565 3.9565 4.3091 4.3091 4.5316 4.5316 4.7488 4.7488 4.8540 4.8540 4.9727 4.9727 6.4721 6.4721 6.8003 6.8003 6.8811 6.8811 7.0048 7.0048 7.1416 7.1416 8.0742 8.0742 11.7937 11.7937 11.9180 11.9180 12.1782 12.1782 13.0025 13.0025 13.3237 13.3237 k = 0.5392-0.0021-0.1219 ( 3880 PWs) bands (ev): -52.5382 -52.5382 -52.5136 -52.5136 -26.9000 -26.9000 -26.8003 -26.8003 -19.4054 -19.4054 -19.1440 -19.1440 -19.0452 -19.0452 -19.0356 -19.0356 -6.6037 -6.6037 -6.4504 -6.4504 -5.0629 -5.0629 -4.5283 -4.5283 3.9989 3.9989 4.3012 4.3012 4.5305 4.5305 4.7576 4.7576 4.8095 4.8095 4.9508 4.9508 6.4745 6.4745 6.8584 6.8584 6.9054 6.9054 7.0194 7.0194 7.1544 7.1544 8.0662 8.0662 11.7838 11.7838 11.9086 11.9086 12.1542 12.1542 12.9784 12.9784 13.2872 13.2872 k = 0.5336 0.0120-0.0963 ( 3876 PWs) bands (ev): -52.5383 -52.5383 -52.5136 -52.5136 -26.8996 -26.8996 -26.7993 -26.7993 -19.4052 -19.4052 -19.1401 -19.1401 -19.0424 -19.0424 -19.0352 -19.0352 -6.6156 -6.6156 -6.4579 -6.4579 -5.0659 -5.0659 -4.5342 -4.5342 4.0424 4.0424 4.2941 4.2941 4.5282 4.5282 4.7312 4.7312 4.7987 4.7987 4.9335 4.9335 6.4730 6.4730 6.8964 6.8964 6.9424 6.9424 7.0340 7.0340 7.1674 7.1674 8.0566 8.0566 11.7741 11.7741 11.9008 11.9008 12.1347 12.1347 12.9547 12.9547 13.2563 13.2563 k = 0.5280 0.0260-0.0708 ( 3882 PWs) bands (ev): -52.5385 -52.5385 -52.5136 -52.5136 -26.8993 -26.8993 -26.7985 -26.7985 -19.4050 -19.4050 -19.1367 -19.1367 -19.0405 -19.0405 -19.0346 -19.0346 -6.6258 -6.6258 -6.4642 -6.4642 -5.0685 -5.0685 -4.5392 -4.5392 4.0866 4.0866 4.2884 4.2884 4.5247 4.5247 4.6834 4.6834 4.8078 4.8078 4.9206 4.9206 6.4693 6.4693 6.9181 6.9181 6.9846 6.9846 7.0490 7.0490 7.1811 7.1811 8.0458 8.0458 11.7649 11.7649 11.8943 11.8943 12.1194 12.1194 12.9322 12.9322 13.2307 13.2307 k = 0.5224 0.0400-0.0453 ( 3882 PWs) bands (ev): -52.5386 -52.5386 -52.5137 -52.5137 -26.8990 -26.8990 -26.7979 -26.7979 -19.4049 -19.4049 -19.1338 -19.1338 -19.0395 -19.0395 -19.0335 -19.0335 -6.6342 -6.6342 -6.4695 -6.4695 -5.0706 -5.0706 -4.5434 -4.5434 4.1304 4.1304 4.2849 4.2849 4.5185 4.5185 4.6356 4.6356 4.8167 4.8167 4.9123 4.9123 6.4646 6.4646 6.9335 6.9335 7.0187 7.0187 7.0650 7.0650 7.1958 7.1958 8.0348 8.0348 11.7569 11.7569 11.8888 11.8888 12.1080 12.1080 12.9122 12.9122 13.2103 13.2103 k = 0.5168 0.0541-0.0197 ( 3888 PWs) bands (ev): -52.5387 -52.5387 -52.5137 -52.5137 -26.8988 -26.8988 -26.7974 -26.7974 -19.4048 -19.4048 -19.1315 -19.1315 -19.0391 -19.0391 -19.0323 -19.0323 -6.6408 -6.6408 -6.4736 -6.4736 -5.0722 -5.0722 -4.5467 -4.5467 4.1716 4.1716 4.2848 4.2848 4.5063 4.5063 4.5951 4.5951 4.8224 4.8224 4.9083 4.9083 6.4599 6.4599 6.9448 6.9448 7.0411 7.0411 7.0814 7.0814 7.2110 7.2110 8.0245 8.0245 11.7502 11.7502 11.8844 11.8844 12.0999 12.0999 12.8955 12.8955 13.1947 13.1947 k = 0.5112 0.0681 0.0058 ( 3896 PWs) bands (ev): -52.5388 -52.5388 -52.5137 -52.5137 -26.8987 -26.8987 -26.7972 -26.7972 -19.4047 -19.4047 -19.1299 -19.1299 -19.0390 -19.0390 -19.0314 -19.0314 -6.6455 -6.6455 -6.4765 -6.4765 -5.0734 -5.0734 -4.5490 -4.5490 4.2052 4.2052 4.2914 4.2914 4.4834 4.4834 4.5693 4.5693 4.8252 4.8252 4.9072 4.9072 6.4560 6.4560 6.9528 6.9528 7.0543 7.0543 7.0947 7.0947 7.2250 7.2250 8.0160 8.0160 11.7453 11.7453 11.8811 11.8811 12.0946 12.0946 12.8829 12.8829 13.1836 13.1836 k = 0.5056 0.0821 0.0313 ( 3894 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7969 -26.7969 -19.4047 -19.4047 -19.1289 -19.1289 -19.0390 -19.0390 -19.0307 -19.0307 -6.6483 -6.6483 -6.4783 -6.4783 -5.0741 -5.0741 -4.5504 -4.5504 4.2248 4.2248 4.3061 4.3061 4.4551 4.4551 4.5580 4.5580 4.8261 4.8261 4.9075 4.9075 6.4534 6.4534 6.9574 6.9574 7.0615 7.0615 7.1029 7.1029 7.2350 7.2350 8.0104 8.0104 11.7422 11.7422 11.8791 11.8791 12.0916 12.0916 12.8751 12.8751 13.1770 13.1770 k = 0.5000 0.0962 0.0569 ( 3896 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7968 -26.7968 -19.4047 -19.4047 -19.1286 -19.1286 -19.0390 -19.0390 -19.0305 -19.0305 -6.6493 -6.6493 -6.4789 -6.4789 -5.0743 -5.0743 -4.5509 -4.5509 4.2304 4.2304 4.3159 4.3159 4.4408 4.4408 4.5550 4.5550 4.8263 4.8263 4.9077 4.9077 6.4526 6.4526 6.9590 6.9590 7.0637 7.0637 7.1055 7.1055 7.2386 7.2386 8.0084 8.0084 11.7412 11.7412 11.8784 11.8784 12.0906 12.0906 12.8725 12.8725 13.1748 13.1748 k = 0.5000 0.0962 0.0569 ( 3896 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7968 -26.7968 -19.4047 -19.4047 -19.1286 -19.1286 -19.0390 -19.0390 -19.0305 -19.0305 -6.6493 -6.6493 -6.4789 -6.4789 -5.0743 -5.0743 -4.5509 -4.5509 4.2304 4.2304 4.3159 4.3159 4.4408 4.4408 4.5550 4.5550 4.8263 4.8263 4.9077 4.9077 6.4526 6.4526 6.9590 6.9590 7.0637 7.0637 7.1055 7.1055 7.2386 7.2386 8.0084 8.0084 11.7412 11.7412 11.8784 11.8784 12.0906 12.0906 12.8725 12.8725 13.1748 13.1748 k = 0.4722 0.0908 0.0537 ( 3884 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8985 -26.8985 -26.7967 -26.7967 -19.4046 -19.4046 -19.1286 -19.1286 -19.0389 -19.0389 -19.0305 -19.0305 -6.6509 -6.6509 -6.4769 -6.4769 -5.0749 -5.0749 -4.5506 -4.5506 4.2292 4.2292 4.3159 4.3159 4.4362 4.4362 4.5630 4.5630 4.8264 4.8264 4.9077 4.9077 6.4478 6.4478 6.9592 6.9592 7.0640 7.0640 7.1052 7.1052 7.2383 7.2383 8.0118 8.0118 11.7412 11.7412 11.8784 11.8784 12.0906 12.0906 12.8727 12.8727 13.1751 13.1751 k = 0.4444 0.0855 0.0506 ( 3887 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7968 -26.7968 -19.4046 -19.4046 -19.1286 -19.1286 -19.0389 -19.0389 -19.0305 -19.0305 -6.6556 -6.6556 -6.4711 -6.4711 -5.0769 -5.0769 -4.5499 -4.5499 4.2255 4.2255 4.3158 4.3158 4.4251 4.4251 4.5839 4.5839 4.8265 4.8265 4.9079 4.9079 6.4338 6.4338 6.9600 6.9600 7.0649 7.0649 7.1041 7.1041 7.2372 7.2372 8.0215 8.0215 11.7412 11.7412 11.8783 11.8783 12.0907 12.0907 12.8734 12.8734 13.1761 13.1761 k = 0.4167 0.0801 0.0474 ( 3887 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7968 -26.7968 -19.4046 -19.4046 -19.1286 -19.1286 -19.0389 -19.0389 -19.0305 -19.0305 -6.6627 -6.6627 -6.4622 -6.4622 -5.0801 -5.0801 -4.5486 -4.5486 4.2195 4.2195 4.3157 4.3157 4.4124 4.4124 4.6128 4.6128 4.8267 4.8267 4.9082 4.9082 6.4111 6.4111 6.9612 6.9612 7.0664 7.0664 7.1023 7.1023 7.2354 7.2354 8.0372 8.0372 11.7412 11.7412 11.8783 11.8783 12.0907 12.0907 12.8745 12.8745 13.1776 13.1776 k = 0.3889 0.0748 0.0442 ( 3884 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7967 -26.7967 -19.4047 -19.4047 -19.1286 -19.1286 -19.0388 -19.0388 -19.0305 -19.0305 -6.6715 -6.6715 -6.4510 -6.4510 -5.0844 -5.0844 -4.5470 -4.5470 4.2115 4.2115 4.3155 4.3155 4.4003 4.4003 4.6469 4.6469 4.8270 4.8270 4.9085 4.9085 6.3803 6.3803 6.9628 6.9628 7.0685 7.0685 7.1000 7.1000 7.2329 7.2329 8.0580 8.0580 11.7411 11.7411 11.8782 11.8782 12.0907 12.0907 12.8760 12.8760 13.1797 13.1797 k = 0.3611 0.0694 0.0411 ( 3887 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7967 -26.7967 -19.4046 -19.4046 -19.1286 -19.1286 -19.0388 -19.0388 -19.0305 -19.0305 -6.6812 -6.6812 -6.4382 -6.4382 -5.0898 -5.0898 -4.5450 -4.5450 4.2020 4.2020 4.3152 4.3152 4.3899 4.3899 4.6850 4.6850 4.8274 4.8274 4.9089 4.9089 6.3424 6.3424 6.9650 6.9650 7.0712 7.0712 7.0970 7.0970 7.2298 7.2298 8.0828 8.0828 11.7410 11.7410 11.8782 11.8782 12.0906 12.0906 12.8778 12.8778 13.1823 13.1823 k = 0.3333 0.0641 0.0379 ( 3884 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7967 -26.7967 -19.4046 -19.4046 -19.1286 -19.1286 -19.0387 -19.0387 -19.0305 -19.0305 -6.6914 -6.6914 -6.4245 -6.4245 -5.0960 -5.0960 -4.5427 -4.5427 4.1913 4.1913 4.3149 4.3149 4.3812 4.3812 4.7261 4.7261 4.8278 4.8278 4.9095 4.9095 6.2985 6.2985 6.9675 6.9675 7.0744 7.0744 7.0935 7.0935 7.2260 7.2260 8.1108 8.1108 11.7410 11.7410 11.8781 11.8781 12.0905 12.0905 12.8799 12.8799 13.1853 13.1853 k = 0.3056 0.0588 0.0348 ( 3887 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8987 -26.8987 -26.7966 -26.7966 -19.4047 -19.4047 -19.1287 -19.1287 -19.0387 -19.0387 -19.0304 -19.0304 -6.7015 -6.7015 -6.4103 -6.4103 -5.1028 -5.1028 -4.5402 -4.5402 4.1801 4.1801 4.3146 4.3146 4.3743 4.3743 4.7697 4.7697 4.8283 4.8283 4.9100 4.9100 6.2495 6.2495 6.9705 6.9705 7.0782 7.0782 7.0895 7.0895 7.2216 7.2216 8.1407 8.1407 11.7409 11.7409 11.8780 11.8780 12.0903 12.0903 12.8822 12.8822 13.1886 13.1886 k = 0.2778 0.0534 0.0316 ( 3887 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8987 -26.8987 -26.7966 -26.7966 -19.4047 -19.4047 -19.1287 -19.1287 -19.0387 -19.0387 -19.0304 -19.0304 -6.7114 -6.7114 -6.3961 -6.3961 -5.1101 -5.1101 -4.5376 -4.5376 4.1688 4.1688 4.3143 4.3143 4.3687 4.3687 4.8154 4.8154 4.8288 4.8288 4.9107 4.9107 6.1966 6.1966 6.9740 6.9740 7.0825 7.0825 7.0851 7.0851 7.2167 7.2167 8.1715 8.1715 11.7407 11.7407 11.8779 11.8779 12.0899 12.0899 12.8846 12.8846 13.1921 13.1921 k = 0.2500 0.0481 0.0284 ( 3878 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7966 -26.7966 -19.4047 -19.4047 -19.1286 -19.1286 -19.0387 -19.0387 -19.0304 -19.0304 -6.7208 -6.7208 -6.3822 -6.3822 -5.1176 -5.1176 -4.5350 -4.5350 4.1578 4.1578 4.3140 4.3140 4.3642 4.3642 4.8293 4.8293 4.8627 4.8627 4.9117 4.9117 6.1407 6.1407 6.9778 6.9778 7.0803 7.0803 7.0873 7.0873 7.2112 7.2112 8.2024 8.2024 11.7406 11.7406 11.8778 11.8778 12.0894 12.0894 12.8872 12.8872 13.1957 13.1957 k = 0.2222 0.0427 0.0253 ( 3879 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7966 -26.7966 -19.4047 -19.4047 -19.1286 -19.1286 -19.0387 -19.0387 -19.0304 -19.0304 -6.7296 -6.7296 -6.3689 -6.3689 -5.1251 -5.1251 -4.5324 -4.5324 4.1475 4.1475 4.3136 4.3136 4.3607 4.3607 4.8298 4.8298 4.9060 4.9060 4.9180 4.9180 6.0828 6.0828 6.9819 6.9819 7.0751 7.0751 7.0925 7.0925 7.2053 7.2053 8.2323 8.2323 11.7405 11.7405 11.8777 11.8777 12.0887 12.0887 12.8897 12.8897 13.1994 13.1994 k = 0.1944 0.0374 0.0221 ( 3888 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8988 -26.8988 -26.7966 -26.7966 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0304 -19.0304 -6.7375 -6.7375 -6.3565 -6.3565 -5.1324 -5.1324 -4.5299 -4.5299 4.1380 4.1380 4.3133 4.3133 4.3579 4.3579 4.8303 4.8303 4.9114 4.9114 4.9630 4.9630 6.0240 6.0240 6.9865 6.9865 7.0697 7.0697 7.0982 7.0982 7.1990 7.1990 8.2605 8.2605 11.7404 11.7404 11.8776 11.8776 12.0879 12.0879 12.8922 12.8922 13.2029 13.2029 k = 0.1667 0.0321 0.0190 ( 3882 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8987 -26.8987 -26.7966 -26.7966 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0304 -19.0304 -6.7446 -6.7446 -6.3452 -6.3452 -5.1393 -5.1393 -4.5277 -4.5277 4.1295 4.1295 4.3130 4.3130 4.3556 4.3556 4.8308 4.8308 4.9122 4.9122 5.0127 5.0127 5.9654 5.9654 6.9913 6.9913 7.0641 7.0641 7.1042 7.1042 7.1923 7.1923 8.2864 8.2864 11.7402 11.7402 11.8775 11.8775 12.0871 12.0871 12.8945 12.8945 13.2063 13.2063 k = 0.1389 0.0267 0.0158 ( 3882 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8987 -26.8987 -26.7966 -26.7966 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0304 -19.0304 -6.7506 -6.7506 -6.3352 -6.3352 -5.1455 -5.1455 -4.5256 -4.5256 4.1221 4.1221 4.3127 4.3127 4.3539 4.3539 4.8312 4.8312 4.9128 4.9128 5.0619 5.0619 5.9083 5.9083 6.9964 6.9964 7.0583 7.0583 7.1106 7.1106 7.1854 7.1854 8.3093 8.3093 11.7401 11.7401 11.8775 11.8775 12.0862 12.0862 12.8966 12.8966 13.2093 13.2093 k = 0.1111 0.0214 0.0126 ( 3876 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8987 -26.8987 -26.7965 -26.7965 -19.4049 -19.4049 -19.1286 -19.1286 -19.0386 -19.0386 -19.0304 -19.0304 -6.7557 -6.7557 -6.3268 -6.3268 -5.1509 -5.1509 -4.5239 -4.5239 4.1160 4.1160 4.3125 4.3125 4.3525 4.3525 4.8316 4.8316 4.9133 4.9133 5.1089 5.1089 5.8544 5.8544 7.0017 7.0017 7.0524 7.0524 7.1172 7.1172 7.1783 7.1783 8.3288 8.3288 11.7400 11.7400 11.8774 11.8774 12.0854 12.0854 12.8985 12.8985 13.2119 13.2119 k = 0.0833 0.0160 0.0095 ( 3876 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8987 -26.8987 -26.7965 -26.7965 -19.4049 -19.4049 -19.1286 -19.1286 -19.0386 -19.0386 -19.0304 -19.0304 -6.7596 -6.7596 -6.3200 -6.3200 -5.1553 -5.1553 -4.5225 -4.5225 4.1112 4.1112 4.3123 4.3123 4.3515 4.3515 4.8319 4.8319 4.9136 4.9136 5.1517 5.1517 5.8060 5.8060 7.0071 7.0071 7.0465 7.0465 7.1240 7.1240 7.1710 7.1710 8.3443 8.3443 11.7399 11.7399 11.8774 11.8774 12.0846 12.0846 12.9000 12.9000 13.2140 13.2140 k = 0.0556 0.0107 0.0063 ( 3876 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8987 -26.8987 -26.7965 -26.7965 -19.4049 -19.4049 -19.1286 -19.1286 -19.0386 -19.0386 -19.0304 -19.0304 -6.7625 -6.7625 -6.3151 -6.3151 -5.1585 -5.1585 -4.5215 -4.5215 4.1078 4.1078 4.3121 4.3121 4.3508 4.3508 4.8321 4.8321 4.9139 4.9139 5.1871 5.1871 5.7665 5.7665 7.0125 7.0125 7.0407 7.0407 7.1309 7.1309 7.1639 7.1639 8.3557 8.3557 11.7398 11.7398 11.8773 11.8773 12.0840 12.0840 12.9011 12.9011 13.2156 13.2156 k = 0.0278 0.0053 0.0032 ( 3873 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8987 -26.8987 -26.7965 -26.7965 -19.4048 -19.4048 -19.1285 -19.1285 -19.0386 -19.0386 -19.0304 -19.0304 -6.7642 -6.7642 -6.3121 -6.3121 -5.1605 -5.1605 -4.5209 -4.5209 4.1057 4.1057 4.3121 4.3121 4.3504 4.3504 4.8322 4.8322 4.9141 4.9141 5.2111 5.2111 5.7400 5.7400 7.0173 7.0173 7.0357 7.0357 7.1372 7.1372 7.1574 7.1574 8.3626 8.3626 11.7397 11.7397 11.8773 11.8773 12.0836 12.0836 12.9018 12.9018 13.2165 13.2165 k = 0.0000 0.0000 0.0000 ( 3897 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8988 -26.8988 -26.7967 -26.7967 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0305 -19.0305 -6.7648 -6.7648 -6.3111 -6.3111 -5.1611 -5.1611 -4.5207 -4.5207 4.1050 4.1050 4.3120 4.3120 4.3502 4.3502 4.8322 4.8322 4.9141 4.9141 5.2197 5.2197 5.7305 5.7305 7.0197 7.0197 7.0332 7.0332 7.1406 7.1406 7.1539 7.1539 8.3649 8.3649 11.7397 11.7397 11.8773 11.8773 12.0835 12.0835 12.9020 12.9020 13.2168 13.2168 k = 0.0000 0.0000 0.0000 ( 3897 PWs) bands (ev): -52.5389 -52.5389 -52.5138 -52.5138 -26.8988 -26.8988 -26.7967 -26.7967 -19.4049 -19.4049 -19.1286 -19.1286 -19.0387 -19.0387 -19.0305 -19.0305 -6.7648 -6.7648 -6.3111 -6.3111 -5.1611 -5.1611 -4.5207 -4.5207 4.1050 4.1050 4.3120 4.3120 4.3502 4.3502 4.8322 4.8322 4.9141 4.9141 5.2197 5.2197 5.7305 5.7305 7.0197 7.0197 7.0332 7.0332 7.1406 7.1406 7.1539 7.1539 8.3649 8.3649 11.7397 11.7397 11.8773 11.8773 12.0835 12.0835 12.9020 12.9020 13.2168 13.2168 k = 0.0056-0.0141-0.0256 ( 3883 PWs) bands (ev): -52.5388 -52.5388 -52.5138 -52.5138 -26.8988 -26.8988 -26.7966 -26.7966 -19.4049 -19.4049 -19.1289 -19.1289 -19.0386 -19.0386 -19.0306 -19.0306 -6.7639 -6.7639 -6.3105 -6.3105 -5.1608 -5.1608 -4.5203 -4.5203 4.1047 4.1047 4.3110 4.3110 4.3492 4.3492 4.8320 4.8320 4.9137 4.9137 5.2221 5.2221 5.7335 5.7335 7.0169 7.0169 7.0300 7.0300 7.1395 7.1395 7.1531 7.1531 8.3640 8.3640 11.7410 11.7410 11.8782 11.8782 12.0852 12.0852 12.9035 12.9035 13.2175 13.2175 k = 0.0112-0.0282-0.0513 ( 3879 PWs) bands (ev): -52.5388 -52.5388 -52.5137 -52.5137 -26.8988 -26.8988 -26.7969 -26.7969 -19.4049 -19.4049 -19.1299 -19.1299 -19.0387 -19.0387 -19.0313 -19.0313 -6.7611 -6.7611 -6.3088 -6.3088 -5.1597 -5.1597 -4.5191 -4.5191 4.1038 4.1038 4.3074 4.3074 4.3468 4.3468 4.8307 4.8307 4.9131 4.9131 5.2293 5.2293 5.7423 5.7423 7.0085 7.0085 7.0205 7.0205 7.1362 7.1362 7.1507 7.1507 8.3614 8.3614 11.7446 11.7446 11.8808 11.8808 12.0904 12.0904 12.9082 12.9082 13.2196 13.2196 k = 0.0169-0.0423-0.0769 ( 3881 PWs) bands (ev): -52.5387 -52.5387 -52.5137 -52.5137 -26.8990 -26.8990 -26.7972 -26.7972 -19.4050 -19.4050 -19.1316 -19.1316 -19.0388 -19.0388 -19.0323 -19.0323 -6.7565 -6.7565 -6.3060 -6.3060 -5.1580 -5.1580 -4.5171 -4.5171 4.1023 4.1023 4.2996 4.2996 4.3450 4.3450 4.8272 4.8272 4.9139 4.9139 5.2408 5.2408 5.7565 5.7565 6.9946 6.9946 7.0046 7.0046 7.1310 7.1310 7.1467 7.1467 8.3570 8.3570 11.7505 11.7505 11.8850 11.8850 12.0990 12.0990 12.9161 12.9161 13.2235 13.2235 k = 0.0225-0.0563-0.1025 ( 3887 PWs) bands (ev): -52.5386 -52.5386 -52.5137 -52.5137 -26.8993 -26.8993 -26.7978 -26.7978 -19.4051 -19.4051 -19.1339 -19.1339 -19.0393 -19.0393 -19.0335 -19.0335 -6.7500 -6.7500 -6.3020 -6.3020 -5.1555 -5.1555 -4.5143 -4.5143 4.0999 4.0999 4.2871 4.2871 4.3452 4.3452 4.8203 4.8203 4.9179 4.9179 5.2559 5.2559 5.7756 5.7756 6.9750 6.9750 6.9828 6.9828 7.1242 7.1242 7.1412 7.1412 8.3507 8.3507 11.7584 11.7584 11.8908 11.8908 12.1112 12.1112 12.9272 12.9272 13.2296 13.2296 k = 0.0281-0.0704-0.1282 ( 3887 PWs) bands (ev): -52.5385 -52.5385 -52.5137 -52.5137 -26.8995 -26.8995 -26.7984 -26.7984 -19.4053 -19.4053 -19.1368 -19.1368 -19.0404 -19.0404 -19.0345 -19.0345 -6.7418 -6.7418 -6.2969 -6.2969 -5.1523 -5.1523 -4.5107 -4.5107 4.0964 4.0964 4.2702 4.2702 4.3476 4.3476 4.8095 4.8095 4.9261 4.9261 5.2739 5.2739 5.7988 5.7988 6.9489 6.9489 6.9565 6.9565 7.1159 7.1159 7.1344 7.1344 8.3426 8.3426 11.7680 11.7680 11.8981 11.8981 12.1268 12.1268 12.9416 12.9416 13.2385 13.2385 k = 0.0337-0.0845-0.1538 ( 3887 PWs) bands (ev): -52.5383 -52.5383 -52.5136 -52.5136 -26.8999 -26.8999 -26.7993 -26.7993 -19.4054 -19.4054 -19.1402 -19.1402 -19.0424 -19.0424 -19.0352 -19.0352 -6.7318 -6.7318 -6.2908 -6.2908 -5.1484 -5.1484 -4.5064 -4.5064 4.0917 4.0917 4.2504 4.2504 4.3517 4.3517 4.7954 4.7954 4.9388 4.9388 5.2939 5.2939 5.8254 5.8254 6.9153 6.9153 6.9274 6.9274 7.1062 7.1062 7.1265 7.1265 8.3324 8.3324 11.7788 11.7788 11.9067 11.9067 12.1460 12.1460 12.9591 12.9591 13.2508 13.2508 k = 0.0394-0.0986-0.1794 ( 3891 PWs) bands (ev): -52.5382 -52.5382 -52.5136 -52.5136 -26.9003 -26.9003 -26.8002 -26.8002 -19.4057 -19.4057 -19.1442 -19.1442 -19.0452 -19.0452 -19.0355 -19.0355 -6.7201 -6.7201 -6.2836 -6.2836 -5.1438 -5.1438 -4.5012 -4.5012 4.0853 4.0853 4.2288 4.2288 4.3573 4.3573 4.7793 4.7793 4.9555 4.9555 5.3149 5.3149 5.8547 5.8547 6.8752 6.8752 6.8958 6.8958 7.0951 7.0951 7.1174 7.1174 8.3201 8.3201 11.7901 11.7901 11.9169 11.9169 12.1689 12.1689 12.9792 12.9792 13.2674 13.2674 k = 0.0450-0.1127-0.2051 ( 3885 PWs) bands (ev): -52.5379 -52.5379 -52.5135 -52.5135 -26.9007 -26.9007 -26.8013 -26.8013 -19.4059 -19.4059 -19.1487 -19.1487 -19.0487 -19.0487 -19.0357 -19.0357 -6.7067 -6.7067 -6.2755 -6.2755 -5.1385 -5.1385 -4.4954 -4.4954 4.0769 4.0769 4.2065 4.2065 4.3640 4.3640 4.7624 4.7624 4.9757 4.9757 5.3359 5.3359 5.8861 5.8861 6.8296 6.8296 6.8618 6.8618 7.0827 7.0827 7.1073 7.1073 8.3058 8.3058 11.8012 11.8012 11.9288 11.9288 12.1953 12.1953 13.0014 13.0014 13.2892 13.2892 k = 0.0506-0.1268-0.2307 ( 3885 PWs) bands (ev): -52.5377 -52.5377 -52.5135 -52.5135 -26.9012 -26.9012 -26.8025 -26.8025 -19.4063 -19.4063 -19.1537 -19.1537 -19.0527 -19.0527 -19.0358 -19.0358 -6.6917 -6.6917 -6.2664 -6.2664 -5.1324 -5.1324 -4.4888 -4.4888 4.0662 4.0662 4.1844 4.1844 4.3715 4.3715 4.7458 4.7458 4.9993 4.9993 5.3558 5.3558 5.9190 5.9190 6.7791 6.7791 6.8263 6.8263 7.0691 7.0691 7.0961 7.0961 8.2894 8.2894 11.8114 11.8114 11.9429 11.9429 12.2254 12.2254 13.0245 13.0245 13.3173 13.3173 k = 0.0562-0.1408-0.2563 ( 3885 PWs) bands (ev): -52.5374 -52.5374 -52.5134 -52.5134 -26.9018 -26.9018 -26.8038 -26.8038 -19.4066 -19.4066 -19.1590 -19.1590 -19.0572 -19.0572 -19.0359 -19.0359 -6.6752 -6.6752 -6.2564 -6.2564 -5.1257 -5.1257 -4.4815 -4.4815 4.0529 4.0529 4.1631 4.1631 4.3798 4.3798 4.7303 4.7303 5.0257 5.0257 5.3738 5.3738 5.9529 5.9529 6.7242 6.7242 6.7901 6.7901 7.0542 7.0542 7.0839 7.0839 8.2709 8.2709 11.8201 11.8201 11.9595 11.9595 12.2591 12.2591 13.0476 13.0476 13.3527 13.3527 k = 0.0619-0.1549-0.2820 ( 3885 PWs) bands (ev): -52.5372 -52.5372 -52.5133 -52.5133 -26.9023 -26.9023 -26.8053 -26.8053 -19.4070 -19.4070 -19.1648 -19.1648 -19.0620 -19.0620 -19.0362 -19.0362 -6.6572 -6.6572 -6.2455 -6.2455 -5.1182 -5.1182 -4.4735 -4.4735 4.0370 4.0370 4.1430 4.1430 4.3884 4.3884 4.7167 4.7167 5.0550 5.0550 5.3888 5.3888 5.9874 5.9874 6.6655 6.6655 6.7544 6.7544 7.0383 7.0383 7.0706 7.0706 8.2504 8.2504 11.8269 11.8269 11.9788 11.9788 12.2962 12.2962 13.0698 13.0698 13.3961 13.3961 k = 0.0675-0.1690-0.3076 ( 3883 PWs) bands (ev): -52.5369 -52.5369 -52.5133 -52.5133 -26.9030 -26.9030 -26.8069 -26.8069 -19.4075 -19.4075 -19.1709 -19.1709 -19.0673 -19.0673 -19.0365 -19.0365 -6.6379 -6.6379 -6.2339 -6.2339 -5.1100 -5.1100 -4.4648 -4.4648 4.0188 4.0188 4.1243 4.1243 4.3971 4.3971 4.7056 4.7056 5.0869 5.0869 5.3999 5.3999 6.0221 6.0221 6.6034 6.6034 6.7202 6.7202 7.0213 7.0213 7.0562 7.0562 8.2280 8.2280 11.8317 11.8317 12.0008 12.0008 12.3365 12.3365 13.0906 13.0906 13.4477 13.4477 k = 0.0731-0.1831-0.3333 ( 3889 PWs) bands (ev): -52.5365 -52.5365 -52.5132 -52.5132 -26.9037 -26.9037 -26.8087 -26.8087 -19.4080 -19.4080 -19.1774 -19.1774 -19.0728 -19.0728 -19.0370 -19.0370 -6.6172 -6.6172 -6.2215 -6.2215 -5.1011 -5.1011 -4.4556 -4.4556 3.9990 3.9990 4.1066 4.1066 4.4057 4.4057 4.6977 4.6977 5.1212 5.1212 5.4064 5.4064 6.0568 6.0568 6.5384 6.5384 6.6884 6.6884 7.0035 7.0035 7.0407 7.0407 8.2038 8.2038 11.8347 11.8347 12.0254 12.0254 12.3798 12.3798 13.1098 13.1098 13.5072 13.5072 k = 0.0787-0.1972-0.3589 ( 3889 PWs) bands (ev): -52.5362 -52.5362 -52.5131 -52.5131 -26.9044 -26.9044 -26.8105 -26.8105 -19.4086 -19.4086 -19.1842 -19.1842 -19.0786 -19.0786 -19.0375 -19.0375 -6.5953 -6.5953 -6.2084 -6.2084 -5.0915 -5.0915 -4.4457 -4.4457 3.9781 3.9781 4.0896 4.0896 4.4139 4.4139 4.6933 4.6933 5.1577 5.1577 5.4076 5.4076 6.0912 6.0912 6.4710 6.4710 6.6598 6.6598 6.9849 6.9849 7.0244 7.0244 8.1780 8.1780 11.8363 11.8363 12.0523 12.0523 12.4257 12.4257 13.1278 13.1278 13.5738 13.5738 k = 0.0844-0.2113-0.3845 ( 3887 PWs) bands (ev): -52.5358 -52.5358 -52.5130 -52.5130 -26.9051 -26.9051 -26.8125 -26.8125 -19.4093 -19.4093 -19.1912 -19.1912 -19.0847 -19.0847 -19.0383 -19.0383 -6.5724 -6.5724 -6.1948 -6.1948 -5.0811 -5.0811 -4.4353 -4.4353 3.9570 3.9570 4.0730 4.0730 4.4215 4.4215 4.6925 4.6925 5.1962 5.1962 5.4030 5.4030 6.1250 6.1250 6.4015 6.4015 6.6352 6.6352 6.9656 6.9656 7.0071 7.0071 8.1507 8.1507 11.8369 11.8369 12.0813 12.0813 12.4739 12.4739 13.1447 13.1447 13.6465 13.6465 k = 0.0900-0.2253-0.4102 ( 3889 PWs) bands (ev): -52.5354 -52.5354 -52.5129 -52.5129 -26.9058 -26.9058 -26.8146 -26.8146 -19.4101 -19.4101 -19.1985 -19.1985 -19.0910 -19.0910 -19.0392 -19.0392 -6.5484 -6.5484 -6.1806 -6.1806 -5.0700 -5.0700 -4.4243 -4.4243 3.9359 3.9359 4.0565 4.0565 4.4285 4.4285 4.6953 4.6953 5.2363 5.2363 5.3927 5.3927 6.1580 6.1580 6.3306 6.3306 6.6149 6.6149 6.9459 6.9459 6.9892 6.9892 8.1221 8.1221 11.8370 11.8370 12.1119 12.1119 12.5240 12.5240 13.1610 13.1610 13.7240 13.7240 k = 0.0956-0.2394-0.4358 ( 3899 PWs) bands (ev): -52.5350 -52.5350 -52.5128 -52.5128 -26.9067 -26.9067 -26.8169 -26.8169 -19.4110 -19.4110 -19.2059 -19.2059 -19.0974 -19.0974 -19.0403 -19.0403 -6.5235 -6.5235 -6.1660 -6.1660 -5.0581 -5.0581 -4.4128 -4.4128 3.9155 3.9155 4.0402 4.0402 4.4348 4.4348 4.7015 4.7015 5.2772 5.2772 5.3772 5.3772 6.1898 6.1898 6.2588 6.2588 6.5991 6.5991 6.9257 6.9257 6.9707 6.9707 8.0923 8.0923 11.8368 11.8368 12.1439 12.1439 12.5756 12.5756 13.1770 13.1770 13.8048 13.8048 k = 0.1012-0.2535-0.4614 ( 3891 PWs) bands (ev): -52.5346 -52.5346 -52.5128 -52.5128 -26.9075 -26.9075 -26.8190 -26.8190 -19.4119 -19.4119 -19.2136 -19.2136 -19.1039 -19.1039 -19.0413 -19.0413 -6.4979 -6.4979 -6.1509 -6.1509 -5.0455 -5.0455 -4.4009 -4.4009 3.8959 3.8959 4.0241 4.0241 4.4406 4.4406 4.7109 4.7109 5.3142 5.3142 5.3613 5.3613 6.1835 6.1835 6.2234 6.2234 6.5875 6.5875 6.9053 6.9053 6.9521 6.9521 8.0616 8.0616 11.8367 11.8367 12.1772 12.1772 12.6282 12.6282 13.1931 13.1931 13.8873 13.8873 k = 0.1069-0.2676-0.4871 ( 3893 PWs) bands (ev): -52.5341 -52.5341 -52.5127 -52.5127 -26.9083 -26.9083 -26.8214 -26.8214 -19.4130 -19.4130 -19.2214 -19.2214 -19.1104 -19.1104 -19.0427 -19.0427 -6.4715 -6.4715 -6.1356 -6.1356 -5.0322 -5.0322 -4.3886 -4.3886 3.8772 3.8772 4.0082 4.0082 4.4461 4.4461 4.7227 4.7227 5.3150 5.3150 5.3776 5.3776 6.1112 6.1112 6.2525 6.2525 6.5796 6.5796 6.8848 6.8848 6.9335 6.9335 8.0301 8.0301 11.8369 11.8369 12.2115 12.2115 12.6814 12.6814 13.2093 13.2093 13.9696 13.9696 k = 0.1125-0.2817-0.5127 ( 3893 PWs) bands (ev): -52.5336 -52.5336 -52.5126 -52.5126 -26.9092 -26.9092 -26.8238 -26.8238 -19.4142 -19.4142 -19.2293 -19.2293 -19.1170 -19.1170 -19.0442 -19.0442 -6.4446 -6.4446 -6.1200 -6.1200 -5.0181 -5.0181 -4.3759 -4.3759 3.8597 3.8597 3.9928 3.9928 4.4515 4.4515 4.7365 4.7365 5.2867 5.2867 5.4193 5.4193 6.0379 6.0379 6.2813 6.2813 6.5745 6.5745 6.8644 6.8644 6.9155 6.9155 7.9981 7.9981 11.8376 11.8376 12.2465 12.2465 12.7348 12.7348 13.2260 13.2260 14.0496 14.0496 k = 0.1181-0.2958-0.5383 ( 3883 PWs) bands (ev): -52.5332 -52.5332 -52.5125 -52.5125 -26.9100 -26.9100 -26.8262 -26.8262 -19.4155 -19.4155 -19.2373 -19.2373 -19.1236 -19.1236 -19.0457 -19.0457 -6.4173 -6.4173 -6.1042 -6.1042 -5.0033 -5.0033 -4.3628 -4.3628 3.8433 3.8433 3.9780 3.9780 4.4571 4.4571 4.7518 4.7518 5.2521 5.2521 5.4643 5.4643 5.9649 5.9649 6.3090 6.3090 6.5713 6.5713 6.8444 6.8444 6.8986 6.8986 7.9656 7.9656 11.8390 11.8390 12.2821 12.2821 12.7876 12.7876 13.2431 13.2431 14.1255 14.1255 k = 0.1237-0.3098-0.5640 ( 3875 PWs) bands (ev): -52.5327 -52.5327 -52.5124 -52.5124 -26.9107 -26.9107 -26.8287 -26.8287 -19.4169 -19.4169 -19.2453 -19.2453 -19.1301 -19.1301 -19.0476 -19.0476 -6.3896 -6.3896 -6.0883 -6.0883 -4.9877 -4.9877 -4.3495 -4.3495 3.8281 3.8281 3.9639 3.9639 4.4631 4.4631 4.7679 4.7679 5.2144 5.2144 5.5099 5.5099 5.8927 5.8927 6.3353 6.3353 6.5689 6.5689 6.8250 6.8250 6.8834 6.8834 7.9330 7.9330 11.8412 11.8412 12.3180 12.3180 12.8395 12.8395 13.2608 13.2608 14.1954 14.1954 k = 0.1294-0.3239-0.5896 ( 3877 PWs) bands (ev): -52.5322 -52.5322 -52.5123 -52.5123 -26.9116 -26.9116 -26.8314 -26.8314 -19.4184 -19.4184 -19.2533 -19.2533 -19.1366 -19.1366 -19.0495 -19.0495 -6.3617 -6.3617 -6.0724 -6.0724 -4.9714 -4.9714 -4.3359 -4.3359 3.8139 3.8139 3.9506 3.9506 4.4696 4.4696 4.7842 4.7842 5.1750 5.1750 5.5548 5.5548 5.8218 5.8218 6.3603 6.3603 6.5661 6.5661 6.8063 6.8063 6.8708 6.8708 7.9003 7.9003 11.8442 11.8442 12.3541 12.3541 12.8896 12.8896 13.2790 13.2790 14.2578 14.2578 k = 0.1350-0.3380-0.6152 ( 3881 PWs) bands (ev): -52.5317 -52.5317 -52.5122 -52.5122 -26.9124 -26.9124 -26.8340 -26.8340 -19.4202 -19.4202 -19.2613 -19.2613 -19.1430 -19.1430 -19.0517 -19.0517 -6.3337 -6.3337 -6.0564 -6.0564 -4.9544 -4.9544 -4.3221 -4.3221 3.8008 3.8008 3.9384 3.9384 4.4767 4.4767 4.8002 4.8002 5.1349 5.1349 5.5977 5.5977 5.7531 5.7531 6.3838 6.3838 6.5619 6.5619 6.7884 6.7884 6.8617 6.8617 7.8679 7.8679 11.8479 11.8479 12.3900 12.3900 12.9372 12.9372 13.2977 13.2977 14.3103 14.3103 k = 0.1406-0.3521-0.6409 ( 3873 PWs) bands (ev): -52.5311 -52.5311 -52.5122 -52.5122 -26.9132 -26.9132 -26.8367 -26.8367 -19.4221 -19.4221 -19.2692 -19.2692 -19.1493 -19.1493 -19.0539 -19.0539 -6.3058 -6.3058 -6.0406 -6.0406 -4.9366 -4.9366 -4.3082 -4.3082 3.7884 3.7884 3.9273 3.9273 4.4847 4.4847 4.8154 4.8154 5.0953 5.0953 5.6323 5.6323 5.6927 5.6927 6.4059 6.4059 6.5554 6.5554 6.7715 6.7715 6.8569 6.8569 7.8359 7.8359 11.8522 11.8522 12.4254 12.4254 12.9812 12.9812 13.3166 13.3166 14.3457 14.3457 k = 0.1462-0.3662-0.6665 ( 3875 PWs) bands (ev): -52.5306 -52.5306 -52.5121 -52.5121 -26.9140 -26.9140 -26.8395 -26.8395 -19.4241 -19.4241 -19.2770 -19.2770 -19.1554 -19.1554 -19.0563 -19.0563 -6.2780 -6.2780 -6.0249 -6.0249 -4.9181 -4.9181 -4.2941 -4.2941 3.7768 3.7768 3.9174 3.9174 4.4934 4.4934 4.8291 4.8291 5.0570 5.0570 5.6069 5.6069 5.6917 5.6917 6.4265 6.4265 6.5463 6.5463 6.7555 6.7555 6.8568 6.8568 7.8046 7.8046 11.8568 11.8568 12.4602 12.4602 13.0205 13.0205 13.3357 13.3357 14.3422 14.3422 k = 0.1519-0.3803-0.6921 ( 3865 PWs) bands (ev): -52.5301 -52.5301 -52.5120 -52.5120 -26.9147 -26.9147 -26.8421 -26.8421 -19.4263 -19.4263 -19.2846 -19.2846 -19.1614 -19.1614 -19.0588 -19.0588 -6.2504 -6.2504 -6.0094 -6.0094 -4.8990 -4.8990 -4.2801 -4.2801 3.7657 3.7657 3.9087 3.9087 4.5031 4.5031 4.8406 4.8406 5.0210 5.0210 5.5470 5.5470 5.7241 5.7241 6.4456 6.4456 6.5348 6.5348 6.7403 6.7403 6.8617 6.8617 7.7742 7.7742 11.8613 11.8613 12.4940 12.4940 13.0535 13.0535 13.3545 13.3545 14.2857 14.2857 k = 0.1575-0.3943-0.7178 ( 3865 PWs) bands (ev): -52.5295 -52.5295 -52.5120 -52.5120 -26.9155 -26.9155 -26.8449 -26.8449 -19.4288 -19.4288 -19.2920 -19.2920 -19.1672 -19.1672 -19.0614 -19.0614 -6.2232 -6.2232 -5.9941 -5.9941 -4.8792 -4.8792 -4.2660 -4.2660 3.7549 3.7549 3.9014 3.9014 4.5138 4.5138 4.8492 4.8492 4.9882 4.9882 5.4871 5.4871 5.7551 5.7551 6.4628 6.4628 6.5215 6.5215 6.7261 6.7261 6.8714 6.8714 7.7450 7.7450 11.8651 11.8651 12.5263 12.5263 13.0781 13.0781 13.3728 13.3728 14.2061 14.2061 k = 0.1631-0.4084-0.7434 ( 3869 PWs) bands (ev): -52.5290 -52.5290 -52.5119 -52.5119 -26.9163 -26.9163 -26.8477 -26.8477 -19.4314 -19.4314 -19.2992 -19.2992 -19.1728 -19.1728 -19.0642 -19.0642 -6.1964 -6.1964 -5.9791 -5.9791 -4.8588 -4.8588 -4.2520 -4.2520 3.7443 3.7443 3.8954 3.8954 4.5255 4.5255 4.8539 4.8539 4.9597 4.9597 5.4299 5.4299 5.7814 5.7814 6.4778 6.4778 6.5075 6.5075 6.7129 6.7129 6.8857 6.8857 7.7171 7.7171 11.8674 11.8674 12.5569 12.5569 13.0921 13.0921 13.3906 13.3906 14.1267 14.1267 k = 0.1687-0.4225-0.7690 ( 3859 PWs) bands (ev): -52.5284 -52.5284 -52.5119 -52.5119 -26.9170 -26.9170 -26.8504 -26.8504 -19.4342 -19.4342 -19.3059 -19.3059 -19.1782 -19.1782 -19.0671 -19.0671 -6.1702 -6.1702 -5.9645 -5.9645 -4.8378 -4.8378 -4.2382 -4.2382 3.7336 3.7336 3.8907 3.8907 4.5382 4.5382 4.8537 4.8537 4.9364 4.9364 5.3764 5.3764 5.8018 5.8018 6.4840 6.4840 6.4997 6.4997 6.7008 6.7008 6.9042 6.9042 7.6911 7.6911 11.8670 11.8670 12.5852 12.5852 13.0932 13.0932 13.4079 13.4079 14.0577 14.0577 k = 0.1744-0.4366-0.7947 ( 3859 PWs) bands (ev): -52.5278 -52.5278 -52.5118 -52.5118 -26.9177 -26.9177 -26.8531 -26.8531 -19.4373 -19.4373 -19.3124 -19.3124 -19.1834 -19.1834 -19.0701 -19.0701 -6.1446 -6.1446 -5.9503 -5.9503 -4.8162 -4.8162 -4.2245 -4.2245 3.7227 3.7227 3.8874 3.8874 4.5520 4.5520 4.8484 4.8484 4.9184 4.9184 5.3272 5.3272 5.8156 5.8156 6.4715 6.4715 6.5084 6.5084 6.6899 6.6899 6.9266 6.9266 7.6670 7.6670 11.8624 11.8624 12.6106 12.6106 13.0808 13.0808 13.4250 13.4250 14.0043 14.0043 k = 0.1800-0.4507-0.8203 ( 3861 PWs) bands (ev): -52.5273 -52.5273 -52.5118 -52.5118 -26.9184 -26.9184 -26.8559 -26.8559 -19.4406 -19.4406 -19.3185 -19.3185 -19.1884 -19.1884 -19.0732 -19.0732 -6.1197 -6.1197 -5.9364 -5.9364 -4.7942 -4.7942 -4.2110 -4.2110 3.7115 3.7115 3.8855 3.8855 4.5668 4.5668 4.8394 4.8394 4.9043 4.9043 5.2827 5.2827 5.8225 5.8225 6.4554 6.4554 6.5182 6.5182 6.6803 6.6803 6.9525 6.9525 7.6453 7.6453 11.8519 11.8519 12.6326 12.6326 13.0562 13.0562 13.4419 13.4419 13.9682 13.9682 k = 0.1856-0.4648-0.8459 ( 3861 PWs) bands (ev): -52.5267 -52.5267 -52.5118 -52.5118 -26.9191 -26.9191 -26.8586 -26.8586 -19.4441 -19.4441 -19.3241 -19.3241 -19.1933 -19.1933 -19.0764 -19.0764 -6.0956 -6.0956 -5.9231 -5.9231 -4.7718 -4.7718 -4.1978 -4.1978 3.7000 3.7000 3.8848 3.8848 4.5826 4.5826 4.8289 4.8289 4.8918 4.8918 5.2434 5.2434 5.8225 5.8225 6.4384 6.4384 6.5262 6.5262 6.6722 6.6722 6.9816 6.9816 7.6262 7.6262 11.8335 11.8335 12.6507 12.6507 13.0238 13.0238 13.4584 13.4584 13.9479 13.9479 k = 0.1912-0.4788-0.8716 ( 3863 PWs) bands (ev): -52.5262 -52.5262 -52.5118 -52.5118 -26.9197 -26.9197 -26.8613 -26.8613 -19.4478 -19.4478 -19.3292 -19.3292 -19.1979 -19.1979 -19.0797 -19.0797 -6.0723 -6.0723 -5.9102 -5.9102 -4.7489 -4.7489 -4.1850 -4.1850 3.6881 3.6881 3.8853 3.8853 4.5991 4.5991 4.8184 4.8184 4.8800 4.8800 5.2091 5.2091 5.8158 5.8158 6.4207 6.4207 6.5317 6.5317 6.6658 6.6658 7.0131 7.0131 7.6102 7.6102 11.8052 11.8052 12.6644 12.6644 12.9891 12.9891 13.4744 13.4744 13.9405 13.9405 k = 0.1969-0.4929-0.8972 ( 3865 PWs) bands (ev): -52.5256 -52.5256 -52.5118 -52.5118 -26.9202 -26.9202 -26.8639 -26.8639 -19.4516 -19.4516 -19.3338 -19.3338 -19.2024 -19.2024 -19.0830 -19.0830 -6.0498 -6.0498 -5.8978 -5.8978 -4.7259 -4.7259 -4.1725 -4.1725 3.6761 3.6761 3.8871 3.8871 4.6161 4.6161 4.8075 4.8075 4.8699 4.8699 5.1796 5.1796 5.8032 5.8032 6.4018 6.4018 6.5341 6.5341 6.6615 6.6615 7.0463 7.0463 7.5977 7.5977 11.7655 11.7655 12.6735 12.6735 12.9575 12.9575 13.4894 13.4894 13.9426 13.9426 k = 0.2025-0.5070-0.9228 ( 3857 PWs) bands (ev): -52.5251 -52.5251 -52.5118 -52.5118 -26.9207 -26.9207 -26.8664 -26.8664 -19.4556 -19.4556 -19.3378 -19.3378 -19.2067 -19.2067 -19.0864 -19.0864 -6.0283 -6.0283 -5.8859 -5.8859 -4.7025 -4.7025 -4.1605 -4.1605 3.6639 3.6639 3.8898 3.8898 4.6328 4.6328 4.7953 4.7953 4.8640 4.8640 5.1540 5.1540 5.7852 5.7852 6.3817 6.3817 6.5331 6.5331 6.6592 6.6592 7.0801 7.0801 7.5893 7.5893 11.7137 11.7137 12.6778 12.6778 12.9325 12.9325 13.5034 13.5034 13.9509 13.9509 k = 0.2081-0.5211-0.9485 ( 3865 PWs) bands (ev): -52.5246 -52.5246 -52.5119 -52.5119 -26.9212 -26.9212 -26.8691 -26.8691 -19.4598 -19.4598 -19.3413 -19.3413 -19.2110 -19.2110 -19.0899 -19.0899 -6.0078 -6.0078 -5.8746 -5.8746 -4.6791 -4.6791 -4.1489 -4.1489 3.6519 3.6519 3.8936 3.8936 4.6478 4.6478 4.7820 4.7820 4.8642 4.8642 5.1316 5.1316 5.7626 5.7626 6.3599 6.3599 6.5287 6.5287 6.6591 6.6591 7.1132 7.1132 7.5854 7.5854 11.6505 11.6505 12.6770 12.6770 12.9162 12.9163 13.5166 13.5166 13.9631 13.9631 k = 0.2137-0.5352-0.9741 ( 3861 PWs) bands (ev): -52.5240 -52.5240 -52.5119 -52.5119 -26.9216 -26.9216 -26.8716 -26.8716 -19.4641 -19.4641 -19.3443 -19.3443 -19.2150 -19.2150 -19.0934 -19.0934 -5.9882 -5.9882 -5.8639 -5.8639 -4.6557 -4.6557 -4.1379 -4.1379 3.6403 3.6403 3.8982 3.8982 4.6582 4.6582 4.7714 4.7714 4.8704 4.8704 5.1115 5.1115 5.7363 5.7363 6.3364 6.3364 6.5209 6.5209 6.6608 6.6608 7.1442 7.1442 7.5868 7.5868 11.5774 11.5774 12.6698 12.6698 12.9099 12.9099 13.5293 13.5293 13.9775 13.9775 k = 0.2194-0.5493-0.9998 ( 3857 PWs) bands (ev): -52.5235 -52.5235 -52.5120 -52.5120 -26.9219 -26.9219 -26.8740 -26.8740 -19.4684 -19.4684 -19.3466 -19.3466 -19.2190 -19.2190 -19.0969 -19.0969 -5.9697 -5.9697 -5.8537 -5.8537 -4.6324 -4.6324 -4.1274 -4.1274 3.6293 3.6293 3.9036 3.9036 4.6598 4.6598 4.7686 4.7686 4.8819 4.8819 5.0932 5.0932 5.7067 5.7067 6.3112 6.3112 6.5099 6.5099 6.6640 6.6640 7.1715 7.1715 7.5941 7.5941 11.4969 11.4969 12.6546 12.6546 12.9143 12.9143 13.5422 13.5422 13.9926 13.9926 k = 0.2250-0.5633-1.0254 ( 3857 PWs) bands (ev): -52.5230 -52.5230 -52.5120 -52.5120 -26.9222 -26.9222 -26.8763 -26.8763 -19.4729 -19.4729 -19.3485 -19.3485 -19.2228 -19.2228 -19.1003 -19.1003 -5.9521 -5.9521 -5.8441 -5.8441 -4.6093 -4.6093 -4.1175 -4.1175 3.6193 3.6193 3.9097 3.9097 4.6514 4.6514 4.7760 4.7760 4.8976 4.8976 5.0766 5.0766 5.6747 5.6747 6.2842 6.2842 6.4962 6.4962 6.6682 6.6682 7.1940 7.1940 7.6077 7.6077 11.4113 11.4113 12.6303 12.6303 12.9293 12.9293 13.5556 13.5556 14.0077 14.0077 k = 0.2306-0.5774-1.0510 ( 3861 PWs) bands (ev): -52.5225 -52.5225 -52.5121 -52.5121 -26.9225 -26.9225 -26.8787 -26.8787 -19.4773 -19.4773 -19.3498 -19.3498 -19.2266 -19.2266 -19.1038 -19.1038 -5.9356 -5.9356 -5.8352 -5.8352 -4.5864 -4.5864 -4.1083 -4.1083 3.6105 3.6105 3.9163 3.9163 4.6362 4.6362 4.7903 4.7903 4.9164 4.9164 5.0624 5.0624 5.6406 5.6406 6.2556 6.2556 6.4799 6.4799 6.6732 6.6732 7.2109 7.2109 7.6274 7.6274 11.3232 11.3232 12.5971 12.5971 12.9537 12.9537 13.5701 13.5701 14.0219 14.0219 k = 0.2362-0.5915-1.0767 ( 3859 PWs) bands (ev): -52.5220 -52.5220 -52.5122 -52.5122 -26.9227 -26.9227 -26.8808 -26.8808 -19.4816 -19.4816 -19.3507 -19.3507 -19.2303 -19.2303 -19.1073 -19.1073 -5.9200 -5.9200 -5.8268 -5.8268 -4.5640 -4.5640 -4.0996 -4.0996 3.6033 3.6033 3.9233 3.9233 4.6185 4.6185 4.8068 4.8068 4.9371 4.9371 5.0521 5.0521 5.6049 5.6049 6.2257 6.2257 6.4611 6.4611 6.6788 6.6788 7.2220 7.2220 7.6526 7.6526 11.2346 11.2346 12.5563 12.5563 12.9859 12.9859 13.5857 13.5857 14.0349 14.0349 k = 0.2419-0.6056-1.1023 ( 3851 PWs) bands (ev): -52.5215 -52.5215 -52.5123 -52.5123 -26.9228 -26.9228 -26.8829 -26.8829 -19.4858 -19.4858 -19.3509 -19.3509 -19.2339 -19.2339 -19.1107 -19.1107 -5.9055 -5.9055 -5.8190 -5.8190 -4.5422 -4.5422 -4.0917 -4.0917 3.5978 3.5978 3.9306 3.9306 4.6007 4.6007 4.8215 4.8215 4.9580 4.9580 5.0488 5.0488 5.5680 5.5680 6.1949 6.1949 6.4398 6.4398 6.6850 6.6850 7.2276 7.2276 7.6822 7.6822 11.1474 11.1474 12.5095 12.5095 13.0239 13.0239 13.6025 13.6025 14.0463 14.0463 k = 0.2475-0.6197-1.1279 ( 3851 PWs) bands (ev): -52.5210 -52.5210 -52.5124 -52.5124 -26.9229 -26.9229 -26.8849 -26.8849 -19.4899 -19.4899 -19.3508 -19.3508 -19.2376 -19.2376 -19.1140 -19.1140 -5.8919 -5.8919 -5.8118 -5.8118 -4.5210 -4.5210 -4.0844 -4.0844 3.5943 3.5943 3.9379 3.9379 4.5838 4.5838 4.8306 4.8306 4.9778 4.9778 5.0557 5.0557 5.5305 5.5305 6.1634 6.1634 6.4159 6.4159 6.6916 6.6916 7.2284 7.2284 7.7147 7.7147 11.0630 11.0630 12.4584 12.4584 13.0663 13.0663 13.6201 13.6201 14.0558 14.0558 k = 0.2531-0.6338-1.1536 ( 3851 PWs) bands (ev): -52.5205 -52.5205 -52.5125 -52.5125 -26.9230 -26.9230 -26.8868 -26.8868 -19.4939 -19.4939 -19.3502 -19.3502 -19.2412 -19.2412 -19.1172 -19.1172 -5.8793 -5.8793 -5.8052 -5.8052 -4.5006 -4.5006 -4.0777 -4.0777 3.5931 3.5931 3.9453 3.9453 4.5687 4.5687 4.8311 4.8311 4.9980 4.9980 5.0732 5.0732 5.4926 5.4926 6.1318 6.1318 6.3896 6.3896 6.6989 6.6989 7.2251 7.2251 7.7490 7.7490 10.9824 10.9824 12.4046 12.4046 13.1115 13.1115 13.6382 13.6382 14.0633 14.0633 k = 0.2587-0.6478-1.1792 ( 3849 PWs) bands (ev): -52.5201 -52.5201 -52.5127 -52.5127 -26.9230 -26.9230 -26.8886 -26.8886 -19.4976 -19.4976 -19.3491 -19.3491 -19.2449 -19.2449 -19.1203 -19.1203 -5.8677 -5.8677 -5.7992 -5.7992 -4.4810 -4.4810 -4.0717 -4.0717 3.5944 3.5944 3.9523 3.9523 4.5556 4.5556 4.8229 4.8229 5.0212 5.0212 5.0977 5.0977 5.4550 5.4550 6.1005 6.1005 6.3608 6.3608 6.7067 6.7067 7.2182 7.2182 7.7839 7.7839 10.9066 10.9066 12.3498 12.3498 13.1585 13.1585 13.6564 13.6564 14.0686 14.0686 k = 0.2644-0.6619-1.2048 ( 3853 PWs) bands (ev): -52.5196 -52.5196 -52.5128 -52.5128 -26.9231 -26.9231 -26.8903 -26.8903 -19.5012 -19.5012 -19.3477 -19.3477 -19.2486 -19.2486 -19.1233 -19.1233 -5.8570 -5.8570 -5.7938 -5.7938 -4.4625 -4.4625 -4.0664 -4.0664 3.5982 3.5982 3.9589 3.9589 4.5447 4.5447 4.8079 4.8079 5.0483 5.0483 5.1250 5.1250 5.4186 5.4186 6.0700 6.0700 6.3295 6.3295 6.7153 6.7153 7.2081 7.2081 7.8183 7.8183 10.8362 10.8362 12.2951 12.2951 13.2061 13.2061 13.6743 13.6743 14.0718 14.0718 k = 0.2700-0.6760-1.2305 ( 3853 PWs) bands (ev): -52.5192 -52.5192 -52.5130 -52.5130 -26.9230 -26.9230 -26.8919 -26.8919 -19.5045 -19.5045 -19.3458 -19.3458 -19.2523 -19.2523 -19.1261 -19.1261 -5.8472 -5.8472 -5.7890 -5.7890 -4.4451 -4.4451 -4.0616 -4.0616 3.6047 3.6047 3.9646 3.9646 4.5360 4.5360 4.7888 4.7888 5.0786 5.0786 5.1513 5.1513 5.3850 5.3850 6.0411 6.0411 6.2959 6.2959 6.7247 6.7247 7.1953 7.1953 7.8515 7.8515 10.7716 10.7716 12.2415 12.2415 13.2533 13.2533 13.6915 13.6915 14.0730 14.0730 k = 0.2756-0.6901-1.2561 ( 3849 PWs) bands (ev): -52.5188 -52.5188 -52.5131 -52.5131 -26.9229 -26.9229 -26.8933 -26.8933 -19.5076 -19.5076 -19.3436 -19.3436 -19.2561 -19.2561 -19.1288 -19.1288 -5.8383 -5.8383 -5.7848 -5.7848 -4.4289 -4.4289 -4.0574 -4.0574 3.6141 3.6141 3.9692 3.9692 4.5294 4.5294 4.7676 4.7676 5.1107 5.1107 5.1721 5.1721 5.3576 5.3576 6.0143 6.0143 6.2603 6.2603 6.7350 6.7350 7.1800 7.1800 7.8829 7.8829 10.7132 10.7132 12.1901 12.1901 13.2993 13.2993 13.7079 13.7079 14.0723 14.0723 k = 0.2812-0.7042-1.2817 ( 3852 PWs) bands (ev): -52.5184 -52.5184 -52.5133 -52.5133 -26.9229 -26.9229 -26.8947 -26.8947 -19.5104 -19.5104 -19.3410 -19.3410 -19.2600 -19.2600 -19.1313 -19.1313 -5.8303 -5.8303 -5.7811 -5.7811 -4.4141 -4.4141 -4.0538 -4.0538 3.6264 3.6264 3.9723 3.9723 4.5246 4.5246 4.7462 4.7462 5.1432 5.1432 5.1813 5.1813 5.3419 5.3419 5.9905 5.9905 6.2230 6.2230 6.7463 6.7463 7.1623 7.1623 7.9121 7.9121 10.6610 10.6610 12.1416 12.1416 13.3433 13.3433 13.7231 13.7231 14.0697 14.0697 k = 0.2869-0.7183-1.3074 ( 3848 PWs) bands (ev): -52.5180 -52.5180 -52.5135 -52.5135 -26.9228 -26.9228 -26.8958 -26.8958 -19.5129 -19.5129 -19.3381 -19.3381 -19.2639 -19.2639 -19.1335 -19.1335 -5.8231 -5.8231 -5.7780 -5.7780 -4.4006 -4.4006 -4.0507 -4.0507 3.6416 3.6416 3.9734 3.9734 4.5210 4.5210 4.7262 4.7262 5.1627 5.1627 5.1863 5.1863 5.3419 5.3419 5.9706 5.9706 6.1844 6.1844 6.7587 6.7587 7.1425 7.1425 7.9388 7.9388 10.6151 10.6151 12.0965 12.0965 13.3846 13.3846 13.7371 13.7371 14.0655 14.0655 k = 0.2925-0.7323-1.3330 ( 3838 PWs) bands (ev): -52.5176 -52.5176 -52.5137 -52.5137 -26.9226 -26.9226 -26.8968 -26.8968 -19.5151 -19.5151 -19.3349 -19.3349 -19.2678 -19.2678 -19.1355 -19.1355 -5.8167 -5.8167 -5.7753 -5.7753 -4.3887 -4.3887 -4.0480 -4.0480 3.6597 3.6597 3.9721 3.9721 4.5177 4.5177 4.7095 4.7095 5.1431 5.1431 5.2157 5.2157 5.3534 5.3534 5.9557 5.9557 6.1452 6.1452 6.7722 6.7722 7.1206 7.1206 7.9627 7.9627 10.5755 10.5755 12.0553 12.0553 13.4227 13.4227 13.7498 13.7498 14.0598 14.0598 k = 0.2981-0.7464-1.3586 ( 3846 PWs) bands (ev): -52.5173 -52.5173 -52.5139 -52.5139 -26.9226 -26.9226 -26.8978 -26.8978 -19.5170 -19.5170 -19.3315 -19.3315 -19.2719 -19.2719 -19.1374 -19.1374 -5.8112 -5.8112 -5.7732 -5.7732 -4.3782 -4.3782 -4.0457 -4.0457 3.6808 3.6808 3.9677 3.9677 4.5140 4.5140 4.6976 4.6976 5.1118 5.1118 5.2479 5.2479 5.3687 5.3687 5.9468 5.9468 6.1059 6.1059 6.7870 6.7870 7.0968 7.0968 7.9837 7.9837 10.5421 10.5421 12.0184 12.0184 13.4571 13.4571 13.7611 13.7611 14.0524 14.0524 k = 0.3037-0.7605-1.3843 ( 3840 PWs) bands (ev): -52.5170 -52.5170 -52.5141 -52.5141 -26.9225 -26.9225 -26.8985 -26.8985 -19.5186 -19.5186 -19.3278 -19.3278 -19.2760 -19.2760 -19.1389 -19.1389 -5.8065 -5.8065 -5.7715 -5.7715 -4.3694 -4.3694 -4.0439 -4.0439 3.7048 3.7048 3.9597 3.9597 4.5088 4.5088 4.6922 4.6922 5.0763 5.0763 5.2788 5.2788 5.3829 5.3829 5.9448 5.9448 6.0676 6.0676 6.8030 6.8030 7.0712 7.0712 8.0016 8.0016 10.5145 10.5145 11.9861 11.9861 13.4876 13.4876 13.7711 13.7711 14.0435 14.0435 k = 0.3094-0.7746-1.4099 ( 3836 PWs) bands (ev): -52.5166 -52.5166 -52.5144 -52.5144 -26.9224 -26.9224 -26.8991 -26.8991 -19.5200 -19.5200 -19.3240 -19.3240 -19.2801 -19.2801 -19.1402 -19.1402 -5.8025 -5.8025 -5.7703 -5.7703 -4.3622 -4.3622 -4.0424 -4.0424 3.7316 3.7316 3.9478 3.9478 4.5022 4.5022 4.6941 4.6941 5.0390 5.0390 5.3070 5.3070 5.3934 5.3934 5.9501 5.9501 6.0312 6.0312 6.8203 6.8203 7.0440 7.0440 8.0166 8.0166 10.4928 10.4928 11.9586 11.9586 13.5142 13.5142 13.7796 13.7796 14.0327 14.0327 k = 0.3150-0.7887-1.4355 ( 3836 PWs) bands (ev): -52.5163 -52.5163 -52.5146 -52.5146 -26.9224 -26.9224 -26.8995 -26.8995 -19.5210 -19.5210 -19.3202 -19.3202 -19.2841 -19.2841 -19.1412 -19.1412 -5.7994 -5.7994 -5.7694 -5.7694 -4.3566 -4.3566 -4.0412 -4.0412 3.7612 3.7612 3.9314 3.9314 4.4945 4.4945 4.7031 4.7031 5.0011 5.0011 5.3313 5.3313 5.3994 5.3994 5.9621 5.9621 5.9986 5.9986 6.8388 6.8388 7.0155 7.0155 8.0284 8.0284 10.4765 10.4765 11.9360 11.9360 13.5370 13.5370 13.7868 13.7868 14.0200 14.0200 k = 0.3206-0.8028-1.4612 ( 3838 PWs) bands (ev): -52.5160 -52.5160 -52.5148 -52.5148 -26.9224 -26.9224 -26.8999 -26.8999 -19.5218 -19.5218 -19.3165 -19.3165 -19.2880 -19.2880 -19.1420 -19.1420 -5.7970 -5.7970 -5.7689 -5.7689 -4.3525 -4.3525 -4.0403 -4.0403 3.7933 3.7933 3.9105 3.9105 4.4866 4.4866 4.7186 4.7186 4.9631 4.9631 5.3501 5.3501 5.4015 5.4015 5.9637 5.9637 5.9873 5.9873 6.8585 6.8585 6.9860 6.9860 8.0372 8.0372 10.4654 10.4654 11.9184 11.9184 13.5563 13.5563 13.7926 13.7926 14.0051 14.0051 k = 0.3262-0.8168-1.4868 ( 3846 PWs) bands (ev): -52.5157 -52.5157 -52.5151 -52.5151 -26.9224 -26.9224 -26.9002 -26.9002 -19.5223 -19.5223 -19.3134 -19.3134 -19.2912 -19.2912 -19.1426 -19.1426 -5.7955 -5.7955 -5.7687 -5.7687 -4.3500 -4.3500 -4.0397 -4.0397 3.8274 3.8274 3.8854 3.8854 4.4796 4.4796 4.7396 4.7396 4.9257 4.9257 5.3614 5.3614 5.4012 5.4012 5.9420 5.9420 6.0105 6.0105 6.8789 6.8789 6.9560 6.9560 8.0430 8.0430 10.4594 10.4594 11.9059 11.9059 13.5722 13.5722 13.7971 13.7971 13.9879 13.9879 k = 0.3319-0.8309-1.5124 ( 3844 PWs) bands (ev): -52.5155 -52.5155 -52.5153 -52.5153 -26.9224 -26.9224 -26.9003 -26.9003 -19.5225 -19.5225 -19.3117 -19.3117 -19.2930 -19.2930 -19.1428 -19.1428 -5.7947 -5.7947 -5.7687 -5.7687 -4.3489 -4.3489 -4.0395 -4.0395 3.8493 3.8493 3.8704 3.8704 4.4739 4.4739 4.7648 4.7648 4.8893 4.8893 5.3635 5.3635 5.4003 5.4003 5.9248 5.9248 6.0402 6.0402 6.8968 6.8968 6.9291 6.9291 8.0459 8.0459 10.4581 10.4581 11.8984 11.8984 13.5852 13.5852 13.8001 13.8001 13.9683 13.9683 k = 0.3375-0.8450-1.5381 ( 3846 PWs) bands (ev): -52.5156 -52.5156 -52.5152 -52.5152 -26.9224 -26.9224 -26.9002 -26.9002 -19.5224 -19.5224 -19.3123 -19.3123 -19.2923 -19.2923 -19.1427 -19.1427 -5.7947 -5.7947 -5.7689 -5.7689 -4.3493 -4.3493 -4.0396 -4.0396 3.8188 3.8188 3.9059 3.9059 4.4698 4.4698 4.7919 4.7919 4.8560 4.8560 5.3581 5.3581 5.3980 5.3980 5.9144 5.9144 6.0732 6.0732 6.8854 6.8854 6.9322 6.9322 8.0459 8.0459 10.4614 10.4614 11.8960 11.8960 13.5956 13.5956 13.8014 13.8014 13.9467 13.9467 k = 0.6625-0.7488-1.4812 ( 3846 PWs) bands (ev): -52.5156 -52.5156 -52.5152 -52.5152 -26.9224 -26.9224 -26.9002 -26.9002 -19.5224 -19.5224 -19.3123 -19.3123 -19.2923 -19.2923 -19.1427 -19.1427 -5.7947 -5.7947 -5.7689 -5.7689 -4.3493 -4.3493 -4.0396 -4.0396 3.8188 3.8188 3.9059 3.9059 4.4698 4.4698 4.7919 4.7919 4.8560 4.8560 5.3581 5.3581 5.3980 5.3980 5.9144 5.9144 6.0732 6.0732 6.8854 6.8854 6.9322 6.9322 8.0459 8.0459 10.4614 10.4614 11.8960 11.8960 13.5956 13.5956 13.8014 13.8014 13.9467 13.9467 k = 0.6569-0.7197-1.4812 ( 3852 PWs) bands (ev): -52.5159 -52.5159 -52.5150 -52.5150 -26.9224 -26.9224 -26.9002 -26.9002 -19.5221 -19.5221 -19.3150 -19.3150 -19.2897 -19.2897 -19.1424 -19.1424 -5.7955 -5.7955 -5.7693 -5.7693 -4.3509 -4.3509 -4.0400 -4.0400 3.7817 3.7817 3.9463 3.9463 4.4673 4.4673 4.8021 4.8021 4.8440 4.8440 5.3483 5.3483 5.3922 5.3922 5.9110 5.9110 6.1081 6.1081 6.8557 6.8557 6.9548 6.9548 8.0432 8.0432 10.4690 10.4690 11.8987 11.8987 13.6037 13.6037 13.8005 13.8005 13.9240 13.9240 k = 0.6513-0.6906-1.4812 ( 3840 PWs) bands (ev): -52.5161 -52.5161 -52.5148 -52.5148 -26.9224 -26.9224 -26.8998 -26.8998 -19.5215 -19.5215 -19.3188 -19.3188 -19.2858 -19.2858 -19.1417 -19.1417 -5.7969 -5.7969 -5.7698 -5.7698 -4.3536 -4.3536 -4.0408 -4.0408 3.7413 3.7413 3.9886 3.9886 4.4661 4.4661 4.7759 4.7759 4.8727 4.8727 5.3365 5.3365 5.3826 5.3826 5.9139 5.9139 6.1436 6.1436 6.8246 6.8246 6.9802 6.9802 8.0377 8.0377 10.4808 10.4808 11.9062 11.9062 13.6096 13.6096 13.7959 13.7959 13.9016 13.9016 k = 0.6457-0.6614-1.4812 ( 3840 PWs) bands (ev): -52.5164 -52.5164 -52.5145 -52.5145 -26.9224 -26.9224 -26.8995 -26.8995 -19.5207 -19.5207 -19.3233 -19.3233 -19.2813 -19.2813 -19.1409 -19.1409 -5.7990 -5.7990 -5.7706 -5.7706 -4.3573 -4.3573 -4.0420 -4.0420 3.6986 3.6986 4.0321 4.0321 4.4660 4.4660 4.7444 4.7444 4.9103 4.9103 5.3238 5.3238 5.3701 5.3701 5.9218 5.9218 6.1789 6.1789 6.7939 6.7939 7.0068 7.0068 8.0297 8.0297 10.4967 10.4967 11.9186 11.9186 13.6137 13.6137 13.7850 13.7850 13.8825 13.8825 k = 0.6401-0.6323-1.4812 ( 3842 PWs) bands (ev): -52.5166 -52.5166 -52.5143 -52.5143 -26.9224 -26.9224 -26.8992 -26.8992 -19.5197 -19.5197 -19.3280 -19.3280 -19.2767 -19.2767 -19.1397 -19.1397 -5.8017 -5.8017 -5.7715 -5.7715 -4.3620 -4.3620 -4.0436 -4.0436 3.6541 3.6541 4.0764 4.0764 4.4667 4.4667 4.7133 4.7133 4.9507 4.9507 5.3112 5.3112 5.3564 5.3564 5.9334 5.9334 6.2129 6.2129 6.7644 6.7644 7.0344 7.0344 8.0191 8.0191 10.5164 10.5164 11.9357 11.9357 13.6159 13.6159 13.7654 13.7654 13.8695 13.8695 k = 0.6345-0.6032-1.4812 ( 3842 PWs) bands (ev): -52.5169 -52.5169 -52.5142 -52.5142 -26.9224 -26.9224 -26.8988 -26.8988 -19.5185 -19.5185 -19.3329 -19.3329 -19.2720 -19.2720 -19.1383 -19.1383 -5.8049 -5.8049 -5.7726 -5.7726 -4.3675 -4.3675 -4.0455 -4.0455 3.6083 3.6083 4.1209 4.1209 4.4679 4.4679 4.6835 4.6835 4.9924 4.9924 5.2994 5.2994 5.3431 5.3431 5.9475 5.9475 6.2446 6.2446 6.7369 6.7369 7.0627 7.0627 8.0061 8.0061 10.5399 10.5399 11.9573 11.9573 13.6163 13.6163 13.7375 13.7375 13.8629 13.8629 k = 0.6289-0.5740-1.4812 ( 3840 PWs) bands (ev): -52.5172 -52.5172 -52.5140 -52.5140 -26.9223 -26.9223 -26.8983 -26.8983 -19.5171 -19.5171 -19.3379 -19.3379 -19.2672 -19.2672 -19.1367 -19.1367 -5.8085 -5.8085 -5.7738 -5.7738 -4.3735 -4.3735 -4.0479 -4.0479 3.5618 3.5618 4.1650 4.1650 4.4693 4.4693 4.6553 4.6553 5.0342 5.0342 5.2891 5.2891 5.3320 5.3320 5.9629 5.9629 6.2729 6.2729 6.7122 6.7122 7.0915 7.0915 7.9908 7.9908 10.5672 10.5672 11.9835 11.9835 13.6140 13.6140 13.7043 13.7043 13.8605 13.8605 k = 0.6233-0.5449-1.4812 ( 3832 PWs) bands (ev): -52.5174 -52.5174 -52.5138 -52.5138 -26.9223 -26.9223 -26.8977 -26.8977 -19.5155 -19.5155 -19.3429 -19.3429 -19.2625 -19.2625 -19.1347 -19.1347 -5.8125 -5.8125 -5.7753 -5.7753 -4.3802 -4.3802 -4.0507 -4.0507 3.5150 3.5150 4.2077 4.2077 4.4709 4.4709 4.6290 4.6290 5.0741 5.0741 5.2817 5.2817 5.3248 5.3248 5.9790 5.9790 6.2966 6.2966 6.6915 6.6915 7.1207 7.1207 7.9733 7.9733 10.5980 10.5980 12.0138 12.0138 13.6061 13.6061 13.6711 13.6711 13.8604 13.8604 k = 0.6177-0.5157-1.4812 ( 3840 PWs) bands (ev): -52.5177 -52.5177 -52.5137 -52.5137 -26.9223 -26.9223 -26.8972 -26.8972 -19.5138 -19.5138 -19.3480 -19.3480 -19.2579 -19.2579 -19.1327 -19.1327 -5.8168 -5.8168 -5.7769 -5.7769 -4.3872 -4.3872 -4.0538 -4.0538 3.4682 3.4682 4.2481 4.2481 4.4728 4.4728 4.6050 4.6050 5.1091 5.1091 5.2784 5.2784 5.3240 5.3240 5.9948 5.9948 6.3145 6.3145 6.6757 6.6757 7.1499 7.1499 7.9536 7.9536 10.6324 10.6324 12.0483 12.0483 13.5846 13.5846 13.6474 13.6474 13.8614 13.8614 k = 0.6121-0.4866-1.4812 ( 3836 PWs) bands (ev): -52.5179 -52.5179 -52.5135 -52.5135 -26.9222 -26.9222 -26.8966 -26.8966 -19.5119 -19.5119 -19.3530 -19.3530 -19.2533 -19.2533 -19.1304 -19.1304 -5.8214 -5.8214 -5.7787 -5.7787 -4.3945 -4.3945 -4.0574 -4.0574 3.4219 3.4219 4.2845 4.2845 4.4752 4.4752 4.5835 4.5835 5.1360 5.1360 5.2797 5.2797 5.3334 5.3334 6.0102 6.0102 6.3257 6.3257 6.6659 6.6659 7.1791 7.1791 7.9320 7.9320 10.6702 10.6702 12.0866 12.0866 13.5468 13.5468 13.6368 13.6368 13.8629 13.8629 k = 0.6065-0.4575-1.4812 ( 3840 PWs) bands (ev): -52.5182 -52.5182 -52.5134 -52.5134 -26.9222 -26.9222 -26.8960 -26.8960 -19.5098 -19.5098 -19.3581 -19.3581 -19.2490 -19.2490 -19.1280 -19.1280 -5.8262 -5.8262 -5.7806 -5.7806 -4.4021 -4.4021 -4.0612 -4.0612 3.3764 3.3764 4.3152 4.3152 4.4788 4.4788 4.5652 4.5652 5.1534 5.1534 5.2841 5.2841 5.3563 5.3563 6.0246 6.0246 6.3298 6.3298 6.6623 6.6623 7.2079 7.2079 7.9085 7.9085 10.7114 10.7114 12.1284 12.1284 13.5005 13.5005 13.6323 13.6323 13.8643 13.8643 k = 0.6009-0.4283-1.4812 ( 3840 PWs) bands (ev): -52.5184 -52.5184 -52.5133 -52.5133 -26.9221 -26.9221 -26.8954 -26.8954 -19.5077 -19.5077 -19.3632 -19.3632 -19.2447 -19.2447 -19.1254 -19.1254 -5.8311 -5.8311 -5.7826 -5.7826 -4.4097 -4.4097 -4.0654 -4.0654 3.3319 3.3319 4.3379 4.3379 4.4840 4.4840 4.5509 4.5509 5.1635 5.1635 5.2909 5.2909 5.3915 5.3915 6.0378 6.0378 6.3273 6.3273 6.6644 6.6644 7.2362 7.2362 7.8833 7.8833 10.7558 10.7558 12.1735 12.1735 13.4498 13.4498 13.6300 13.6300 13.8653 13.8653 k = 0.5953-0.3992-1.4812 ( 3840 PWs) bands (ev): -52.5186 -52.5186 -52.5132 -52.5132 -26.9220 -26.9220 -26.8948 -26.8948 -19.5054 -19.5054 -19.3682 -19.3682 -19.2407 -19.2407 -19.1227 -19.1227 -5.8362 -5.8362 -5.7847 -5.7847 -4.4173 -4.4173 -4.0698 -4.0698 3.2887 3.2887 4.3514 4.3514 4.4893 4.4893 4.5429 4.5429 5.1702 5.1702 5.3007 5.3007 5.4345 5.4345 6.0497 6.0497 6.3194 6.3194 6.6712 6.6712 7.2637 7.2637 7.8566 7.8566 10.8033 10.8033 12.2215 12.2215 13.3963 13.3963 13.6288 13.6288 13.8657 13.8657 k = 0.5897-0.3701-1.4812 ( 3846 PWs) bands (ev): -52.5189 -52.5189 -52.5131 -52.5131 -26.9219 -26.9219 -26.8942 -26.8942 -19.5030 -19.5030 -19.3732 -19.3732 -19.2368 -19.2368 -19.1199 -19.1199 -5.8413 -5.8413 -5.7869 -5.7869 -4.4249 -4.4249 -4.0744 -4.0744 3.2471 3.2471 4.3563 4.3563 4.4903 4.4903 4.5443 4.5443 5.1760 5.1760 5.3145 5.3145 5.4819 5.4819 6.0603 6.0603 6.3077 6.3077 6.6809 6.6809 7.2903 7.2903 7.8285 7.8285 10.8539 10.8539 12.2721 12.2721 13.3407 13.3407 13.6282 13.6282 13.8653 13.8653 k = 0.5841-0.3409-1.4812 ( 3842 PWs) bands (ev): -52.5191 -52.5191 -52.5130 -52.5130 -26.9218 -26.9218 -26.8936 -26.8936 -19.5005 -19.5005 -19.3781 -19.3781 -19.2331 -19.2331 -19.1171 -19.1171 -5.8464 -5.8464 -5.7891 -5.7891 -4.4323 -4.4323 -4.0791 -4.0791 3.2072 3.2072 4.3548 4.3548 4.4858 4.4858 4.5541 4.5541 5.1822 5.1822 5.3326 5.3326 5.5314 5.5314 6.0695 6.0695 6.2938 6.2938 6.6923 6.6923 7.3156 7.3156 7.7993 7.7993 10.9072 10.9072 12.3248 12.3248 13.2832 13.2832 13.6278 13.6278 13.8643 13.8643 k = 0.5785-0.3118-1.4812 ( 3846 PWs) bands (ev): -52.5193 -52.5193 -52.5129 -52.5129 -26.9217 -26.9217 -26.8931 -26.8931 -19.4980 -19.4980 -19.3829 -19.3829 -19.2297 -19.2297 -19.1142 -19.1142 -5.8515 -5.8515 -5.7913 -5.7913 -4.4395 -4.4395 -4.0839 -4.0839 3.1692 3.1692 4.3492 4.3492 4.4786 4.4786 4.5672 4.5672 5.1892 5.1892 5.3554 5.3554 5.5814 5.5814 6.0773 6.0773 6.2790 6.2790 6.7041 6.7041 7.3396 7.3396 7.7693 7.7693 10.9632 10.9632 12.3792 12.3792 13.2240 13.2240 13.6276 13.6276 13.8628 13.8628 k = 0.5728-0.2826-1.4812 ( 3838 PWs) bands (ev): -52.5195 -52.5195 -52.5129 -52.5129 -26.9215 -26.9215 -26.8925 -26.8925 -19.4953 -19.4953 -19.3877 -19.3877 -19.2264 -19.2264 -19.1113 -19.1113 -5.8565 -5.8565 -5.7935 -5.7935 -4.4464 -4.4464 -4.0888 -4.0888 3.1333 3.1333 4.3413 4.3413 4.4705 4.4705 4.5800 4.5800 5.1970 5.1970 5.3826 5.3826 5.6309 5.6309 6.0839 6.0839 6.2642 6.2642 6.7155 6.7155 7.3620 7.3620 7.7387 7.7387 11.0216 11.0216 12.4346 12.4346 13.1634 13.1634 13.6270 13.6270 13.8611 13.8611 k = 0.5672-0.2535-1.4812 ( 3838 PWs) bands (ev): -52.5197 -52.5197 -52.5128 -52.5128 -26.9214 -26.9214 -26.8920 -26.8920 -19.4926 -19.4926 -19.3924 -19.3924 -19.2233 -19.2233 -19.1085 -19.1085 -5.8613 -5.8613 -5.7957 -5.7957 -4.4530 -4.4530 -4.0936 -4.0936 3.0996 3.0996 4.3323 4.3323 4.4623 4.4623 4.5914 4.5914 5.2055 5.2055 5.4136 5.4136 5.6790 5.6790 6.0893 6.0893 6.2504 6.2504 6.7259 6.7259 7.3825 7.3825 7.7080 7.7080 11.0822 11.0822 12.4904 12.4904 13.1016 13.1016 13.6258 13.6258 13.8597 13.8597 k = 0.5616-0.2244-1.4812 ( 3832 PWs) bands (ev): -52.5198 -52.5198 -52.5127 -52.5127 -26.9212 -26.9212 -26.8914 -26.8914 -19.4898 -19.4898 -19.3969 -19.3969 -19.2205 -19.2205 -19.1058 -19.1058 -5.8660 -5.8660 -5.7978 -5.7978 -4.4592 -4.4592 -4.0983 -4.0983 3.0682 3.0682 4.3230 4.3230 4.4542 4.4542 4.6007 4.6007 5.2145 5.2145 5.4475 5.4475 5.7250 5.7250 6.0938 6.0938 6.2381 6.2381 6.7349 6.7349 7.4010 7.4010 7.6776 7.6776 11.1446 11.1446 12.5458 12.5458 13.0389 13.0389 13.6235 13.6235 13.8593 13.8593 k = 0.5560-0.1952-1.4812 ( 3832 PWs) bands (ev): -52.5200 -52.5200 -52.5127 -52.5127 -26.9211 -26.9211 -26.8910 -26.8910 -19.4870 -19.4870 -19.4013 -19.4013 -19.2179 -19.2179 -19.1032 -19.1032 -5.8704 -5.8704 -5.7998 -5.7998 -4.4650 -4.4650 -4.1029 -4.1029 3.0392 3.0392 4.3139 4.3139 4.4463 4.4463 4.6080 4.6080 5.2237 5.2237 5.4832 5.4832 5.7680 5.7680 6.0976 6.0976 6.2279 6.2279 6.7423 6.7423 7.4170 7.4170 7.6482 7.6482 11.2084 11.2084 12.5996 12.5996 12.9762 12.9762 13.6199 13.6199 13.8605 13.8605 k = 0.5504-0.1661-1.4812 ( 3838 PWs) bands (ev): -52.5201 -52.5201 -52.5126 -52.5126 -26.9210 -26.9210 -26.8906 -26.8906 -19.4842 -19.4842 -19.4057 -19.4057 -19.2156 -19.2156 -19.1008 -19.1008 -5.8746 -5.8746 -5.8017 -5.8017 -4.4703 -4.4703 -4.1072 -4.1072 3.0128 3.0128 4.3052 4.3052 4.4387 4.4387 4.6137 4.6137 5.2330 5.2330 5.5198 5.5198 5.8072 5.8072 6.1012 6.1012 6.2202 6.2202 6.7478 6.7478 7.4302 7.4302 7.6205 7.6205 11.2733 11.2733 12.6498 12.6498 12.9150 12.9150 13.6149 13.6149 13.8635 13.8635 k = 0.5448-0.1369-1.4812 ( 3840 PWs) bands (ev): -52.5203 -52.5203 -52.5126 -52.5126 -26.9209 -26.9209 -26.8902 -26.8902 -19.4814 -19.4814 -19.4099 -19.4099 -19.2135 -19.2135 -19.0985 -19.0985 -5.8784 -5.8784 -5.8035 -5.8035 -4.4751 -4.4751 -4.1113 -4.1113 2.9890 2.9890 4.2971 4.2971 4.4316 4.4316 4.6178 4.6178 5.2422 5.2422 5.5559 5.5559 5.8419 5.8419 6.1051 6.1051 6.2151 6.2151 6.7515 6.7515 7.4400 7.4400 7.5956 7.5956 11.3387 11.3387 12.6910 12.6910 12.8602 12.8602 13.6087 13.6087 13.8685 13.8685 k = 0.5392-0.1078-1.4812 ( 3842 PWs) bands (ev): -52.5204 -52.5204 -52.5126 -52.5126 -26.9208 -26.9208 -26.8899 -26.8899 -19.4786 -19.4786 -19.4139 -19.4139 -19.2116 -19.2116 -19.0964 -19.0964 -5.8819 -5.8819 -5.8051 -5.8051 -4.4795 -4.4795 -4.1150 -4.1150 2.9678 2.9678 4.2899 4.2899 4.4251 4.4251 4.6208 4.6208 5.2509 5.2509 5.5904 5.5904 5.8711 5.8711 6.1098 6.1098 6.2127 6.2127 6.7533 6.7533 7.4455 7.4455 7.5749 7.5749 11.4038 11.4038 12.7054 12.7054 12.8297 12.8297 13.6016 13.6016 13.8754 13.8754 k = 0.5336-0.0787-1.4812 ( 3842 PWs) bands (ev): -52.5205 -52.5205 -52.5125 -52.5125 -26.9207 -26.9207 -26.8896 -26.8896 -19.4759 -19.4759 -19.4176 -19.4176 -19.2100 -19.2100 -19.0946 -19.0946 -5.8849 -5.8849 -5.8065 -5.8065 -4.4832 -4.4832 -4.1184 -4.1184 2.9494 2.9494 4.2835 4.2835 4.4192 4.4192 4.6229 4.6229 5.2591 5.2591 5.6225 5.6225 5.8944 5.8944 6.1159 6.1159 6.2127 6.2127 6.7536 6.7536 7.4461 7.4461 7.5595 7.5595 11.4676 11.4676 12.6744 12.6744 12.8418 12.8418 13.5941 13.5941 13.8836 13.8836 k = 0.5280-0.0495-1.4812 ( 3842 PWs) bands (ev): -52.5206 -52.5206 -52.5125 -52.5125 -26.9206 -26.9206 -26.8893 -26.8893 -19.4733 -19.4733 -19.4211 -19.4211 -19.2086 -19.2086 -19.0930 -19.0930 -5.8876 -5.8876 -5.8078 -5.8078 -4.4865 -4.4865 -4.1213 -4.1213 2.9337 2.9337 4.2781 4.2781 4.4141 4.4141 4.6244 4.6244 5.2665 5.2665 5.6511 5.6511 5.9116 5.9116 6.1234 6.1234 6.2146 6.2146 6.7525 6.7525 7.4417 7.4417 7.5500 7.5500 11.5290 11.5290 12.6230 12.6230 12.8720 12.8720 13.5868 13.5868 13.8926 13.8926 k = 0.5224-0.0204-1.4812 ( 3846 PWs) bands (ev): -52.5207 -52.5207 -52.5125 -52.5125 -26.9206 -26.9206 -26.8891 -26.8891 -19.4708 -19.4708 -19.4243 -19.4243 -19.2075 -19.2075 -19.0916 -19.0916 -5.8898 -5.8898 -5.8088 -5.8088 -4.4891 -4.4891 -4.1237 -4.1237 2.9209 2.9209 4.2736 4.2736 4.4098 4.4098 4.6253 4.6253 5.2728 5.2728 5.6754 5.6754 5.9234 5.9234 6.1318 6.1318 6.2178 6.2178 6.7504 6.7504 7.4341 7.4341 7.5454 7.5454 11.5862 11.5862 12.5695 12.5695 12.9028 12.9028 13.5801 13.5801 13.9015 13.9015 k = 0.5168 0.0087-1.4812 ( 3842 PWs) bands (ev): -52.5207 -52.5207 -52.5125 -52.5125 -26.9205 -26.9205 -26.8889 -26.8889 -19.4686 -19.4686 -19.4270 -19.4270 -19.2066 -19.2066 -19.0906 -19.0906 -5.8916 -5.8916 -5.8096 -5.8096 -4.4912 -4.4912 -4.1256 -4.1256 2.9108 2.9108 4.2701 4.2701 4.4064 4.4064 4.6259 4.6259 5.2779 5.2779 5.6950 5.6950 5.9308 5.9308 6.1402 6.1402 6.2214 6.2214 6.7480 6.7480 7.4257 7.4257 7.5437 7.5437 11.6365 11.6365 12.5207 12.5207 12.9292 12.9292 13.5745 13.5745 13.9095 13.9095 k = 0.5112 0.0379-1.4812 ( 3854 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9205 -26.9205 -26.8889 -26.8889 -19.4670 -19.4670 -19.4292 -19.4292 -19.2061 -19.2061 -19.0898 -19.0898 -5.8928 -5.8928 -5.8102 -5.8102 -4.4927 -4.4927 -4.1270 -4.1270 2.9036 2.9036 4.2676 4.2676 4.4039 4.4039 4.6263 4.6263 5.2817 5.2817 5.7093 5.7093 5.9349 5.9349 6.1472 6.1472 6.2248 6.2248 6.7456 6.7456 7.4183 7.4183 7.5435 7.5435 11.6769 11.6769 12.4810 12.4810 12.9490 12.9490 13.5703 13.5703 13.9159 13.9159 k = 0.5056 0.0670-1.4812 ( 3854 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9205 -26.9205 -26.8888 -26.8888 -19.4659 -19.4659 -19.4306 -19.4306 -19.2057 -19.2057 -19.0894 -19.0894 -5.8936 -5.8936 -5.8106 -5.8106 -4.4936 -4.4936 -4.1279 -4.1279 2.8993 2.8993 4.2661 4.2661 4.4024 4.4024 4.6265 4.6265 5.2840 5.2840 5.7180 5.7180 5.9369 5.9369 6.1519 6.1519 6.2271 6.2271 6.7440 6.7440 7.4135 7.4135 7.5436 7.5436 11.7034 11.7034 12.4548 12.4548 12.9613 12.9613 13.5676 13.5676 13.9201 13.9201 k = 0.5000 0.0962-1.4812 ( 3852 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8888 -26.8888 -19.4654 -19.4654 -19.4310 -19.4310 -19.2055 -19.2055 -19.0892 -19.0892 -5.8938 -5.8938 -5.8107 -5.8107 -4.4939 -4.4939 -4.1282 -4.1282 2.8979 2.8979 4.2656 4.2656 4.4019 4.4019 4.6265 4.6265 5.2848 5.2848 5.7209 5.7209 5.9375 5.9375 6.1536 6.1536 6.2280 6.2280 6.7434 6.7434 7.4118 7.4118 7.5437 7.5437 11.7127 11.7127 12.4455 12.4455 12.9655 12.9655 13.5667 13.5667 13.9215 13.9215 k = 0.5000 0.0962-1.4812 ( 3852 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8888 -26.8888 -19.4654 -19.4654 -19.4310 -19.4310 -19.2055 -19.2055 -19.0892 -19.0892 -5.8938 -5.8938 -5.8107 -5.8107 -4.4939 -4.4939 -4.1282 -4.1282 2.8979 2.8979 4.2656 4.2656 4.4019 4.4019 4.6265 4.6265 5.2848 5.2848 5.7209 5.7209 5.9375 5.9375 6.1536 6.1536 6.2280 6.2280 6.7434 6.7434 7.4118 7.4118 7.5437 7.5437 11.7127 11.7127 12.4455 12.4455 12.9655 12.9655 13.5667 13.5667 13.9215 13.9215 k = 0.5271 0.1014-1.4717 ( 3856 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9205 -26.9205 -26.8888 -26.8888 -19.4655 -19.4655 -19.4310 -19.4310 -19.2056 -19.2056 -19.0892 -19.0892 -5.8938 -5.8938 -5.8108 -5.8108 -4.4939 -4.4939 -4.1282 -4.1282 2.8979 2.8979 4.2639 4.2639 4.4043 4.4043 4.6273 4.6273 5.2847 5.2847 5.7200 5.7200 5.9341 5.9341 6.1529 6.1529 6.2285 6.2285 6.7457 6.7457 7.4120 7.4120 7.5448 7.5448 11.7134 11.7134 12.4457 12.4457 12.9659 12.9659 13.5659 13.5659 13.9205 13.9205 k = 0.5542 0.1066-1.4622 ( 3858 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9206 -26.9206 -26.8887 -26.8887 -19.4655 -19.4655 -19.4310 -19.4310 -19.2056 -19.2056 -19.0892 -19.0892 -5.8937 -5.8937 -5.8110 -5.8110 -4.4941 -4.4941 -4.1282 -4.1282 2.8981 2.8981 4.2591 4.2591 4.4110 4.4110 4.6298 4.6298 5.2845 5.2845 5.7171 5.7171 5.9244 5.9244 6.1508 6.1508 6.2299 6.2299 6.7524 6.7524 7.4127 7.4127 7.5479 7.5479 11.7154 11.7154 12.4462 12.4462 12.9672 12.9672 13.5632 13.5632 13.9176 13.9176 k = 0.5813 0.1118-1.4528 ( 3853 PWs) bands (ev): -52.5208 -52.5208 -52.5125 -52.5125 -26.9205 -26.9205 -26.8887 -26.8887 -19.4655 -19.4655 -19.4308 -19.4308 -19.2056 -19.2056 -19.0892 -19.0892 -5.8936 -5.8936 -5.8114 -5.8114 -4.4943 -4.4943 -4.1282 -4.1282 2.8983 2.8983 4.2519 4.2519 4.4214 4.4214 4.6338 4.6338 5.2841 5.2841 5.7123 5.7123 5.9088 5.9088 6.1473 6.1473 6.2326 6.2326 6.7630 6.7630 7.4136 7.4136 7.5532 7.5532 11.7187 11.7187 12.4471 12.4471 12.9693 12.9693 13.5590 13.5590 13.9128 13.9128 k = 0.6083 0.1170-1.4433 ( 3855 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8887 -26.8887 -19.4654 -19.4654 -19.4307 -19.4307 -19.2056 -19.2056 -19.0892 -19.0892 -5.8934 -5.8934 -5.8120 -5.8120 -4.4946 -4.4946 -4.1283 -4.1283 2.8986 2.8986 4.2433 4.2433 4.4347 4.4347 4.6392 4.6392 5.2835 5.2835 5.7055 5.7055 5.8882 5.8882 6.1424 6.1424 6.2363 6.2363 6.7769 6.7769 7.4145 7.4145 7.5604 7.5604 11.7232 11.7232 12.4482 12.4482 12.9722 12.9722 13.5531 13.5531 13.9063 13.9063 k = 0.6354 0.1222-1.4338 ( 3849 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8886 -26.8886 -19.4654 -19.4654 -19.4306 -19.4306 -19.2055 -19.2055 -19.0891 -19.0891 -5.8932 -5.8932 -5.8127 -5.8127 -4.4949 -4.4949 -4.1284 -4.1284 2.8989 2.8989 4.2340 4.2340 4.4503 4.4503 4.6457 4.6457 5.2827 5.2827 5.6968 5.6968 5.8637 5.8637 6.1364 6.1364 6.2410 6.2410 6.7933 6.7933 7.4154 7.4154 7.5694 7.5694 11.7288 11.7288 12.4495 12.4495 12.9758 12.9758 13.5460 13.5460 13.8985 13.8985 k = 0.6625 0.1274-1.4243 ( 3846 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8885 -26.8885 -19.4654 -19.4654 -19.4304 -19.4304 -19.2055 -19.2055 -19.0890 -19.0890 -5.8929 -5.8929 -5.8136 -5.8136 -4.4954 -4.4954 -4.1285 -4.1285 2.8993 2.8993 4.2245 4.2245 4.4678 4.4678 4.6530 4.6530 5.2818 5.2818 5.6859 5.6859 5.8365 5.8365 6.1297 6.1297 6.2464 6.2464 6.8116 6.8116 7.4160 7.4160 7.5801 7.5801 11.7354 11.7354 12.4511 12.4511 12.9801 12.9801 13.5376 13.5376 13.8896 13.8896 k = 0.6625 0.1274-1.4243 ( 3846 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8885 -26.8885 -19.4654 -19.4654 -19.4304 -19.4304 -19.2055 -19.2055 -19.0890 -19.0890 -5.8929 -5.8929 -5.8136 -5.8136 -4.4954 -4.4954 -4.1285 -4.1285 2.8993 2.8993 4.2245 4.2245 4.4678 4.4678 4.6530 4.6530 5.2818 5.2818 5.6859 5.6859 5.8365 5.8365 6.1297 6.1297 6.2464 6.2464 6.8116 6.8116 7.4160 7.4160 7.5801 7.5801 11.7354 11.7354 12.4511 12.4511 12.9801 12.9801 13.5376 13.5376 13.8896 13.8896 k = 0.6593 0.1268-1.3947 ( 3847 PWs) bands (ev): -52.5209 -52.5209 -52.5124 -52.5124 -26.9205 -26.9205 -26.8881 -26.8881 -19.4652 -19.4652 -19.4291 -19.4291 -19.2054 -19.2054 -19.0887 -19.0887 -5.8966 -5.8966 -5.8133 -5.8133 -4.4999 -4.4999 -4.1289 -4.1289 2.9080 2.9080 4.2278 4.2278 4.4548 4.4548 4.6519 4.6519 5.2774 5.2774 5.6661 5.6661 5.8760 5.8760 6.1371 6.1371 6.2420 6.2420 6.7968 6.7968 7.4094 7.4094 7.5825 7.5825 11.7528 11.7528 12.4496 12.4496 12.9847 12.9847 13.5472 13.5472 13.8851 13.8851 k = 0.6560 0.1262-1.3651 ( 3851 PWs) bands (ev): -52.5211 -52.5211 -52.5124 -52.5124 -26.9206 -26.9206 -26.8875 -26.8875 -19.4650 -19.4650 -19.4272 -19.4272 -19.2052 -19.2052 -19.0882 -19.0882 -5.9011 -5.9011 -5.8142 -5.8142 -4.5066 -4.5066 -4.1296 -4.1296 2.9199 2.9199 4.2339 4.2339 4.4395 4.4395 4.6506 4.6506 5.2714 5.2714 5.6426 5.6426 5.9200 5.9200 6.1442 6.1442 6.2388 6.2388 6.7817 6.7817 7.3987 7.3987 7.5847 7.5847 11.7776 11.7776 12.4470 12.4470 12.9888 12.9888 13.5589 13.5589 13.8791 13.8791 k = 0.6528 0.1255-1.3354 ( 3859 PWs) bands (ev): -52.5212 -52.5212 -52.5123 -52.5123 -26.9208 -26.9208 -26.8866 -26.8866 -19.4647 -19.4647 -19.4245 -19.4245 -19.2051 -19.2051 -19.0875 -19.0875 -5.9065 -5.9065 -5.8162 -5.8162 -4.5156 -4.5156 -4.1307 -4.1307 2.9349 2.9349 4.2424 4.2424 4.4226 4.4226 4.6494 4.6494 5.2637 5.2637 5.6180 5.6180 5.9654 5.9654 6.1502 6.1502 6.2376 6.2376 6.7661 6.7661 7.3839 7.3839 7.5872 7.5872 11.8094 11.8094 12.4431 12.4431 12.9928 12.9928 13.5726 13.5726 13.8722 13.8722 k = 0.6495 0.1249-1.3058 ( 3857 PWs) bands (ev): -52.5215 -52.5215 -52.5123 -52.5123 -26.9208 -26.9208 -26.8855 -26.8855 -19.4641 -19.4641 -19.4213 -19.4213 -19.2047 -19.2047 -19.0867 -19.0867 -5.9127 -5.9127 -5.8194 -5.8194 -4.5265 -4.5265 -4.1322 -4.1322 2.9529 2.9529 4.2530 4.2530 4.4048 4.4048 4.6482 4.6482 5.2544 5.2544 5.5933 5.5933 6.0112 6.0112 6.1542 6.1542 6.2396 6.2396 6.7500 6.7500 7.3651 7.3651 7.5902 7.5902 11.8474 11.8474 12.4381 12.4381 12.9969 12.9969 13.5876 13.5876 13.8648 13.8648 k = 0.6463 0.1243-1.2762 ( 3853 PWs) bands (ev): -52.5217 -52.5217 -52.5122 -52.5122 -26.9209 -26.9209 -26.8841 -26.8841 -19.4634 -19.4634 -19.4175 -19.4175 -19.2043 -19.2043 -19.0856 -19.0856 -5.9198 -5.9198 -5.8238 -5.8238 -4.5393 -4.5393 -4.1342 -4.1342 2.9738 2.9738 4.2648 4.2648 4.3871 4.3871 4.6472 4.6472 5.2436 5.2436 5.5689 5.5689 6.0563 6.0563 6.1554 6.1554 6.2456 6.2456 6.7333 6.7333 7.3426 7.3426 7.5940 7.5940 11.8907 11.8907 12.4317 12.4317 13.0016 13.0016 13.6035 13.6035 13.8576 13.8576 k = 0.6430 0.1237-1.2466 ( 3849 PWs) bands (ev): -52.5220 -52.5220 -52.5122 -52.5122 -26.9209 -26.9209 -26.8826 -26.8826 -19.4624 -19.4624 -19.4131 -19.4131 -19.2038 -19.2038 -19.0845 -19.0845 -5.9278 -5.9278 -5.8294 -5.8294 -4.5537 -4.5537 -4.1368 -4.1368 2.9972 2.9972 4.2758 4.2758 4.3715 4.3715 4.6467 4.6467 5.2313 5.2313 5.5452 5.5452 6.0999 6.0999 6.1539 6.1539 6.2560 6.2560 6.7160 6.7160 7.3167 7.3167 7.5986 7.5986 11.9380 11.9380 12.4242 12.4242 13.0070 13.0070 13.6196 13.6196 13.8512 13.8512 k = 0.6398 0.1230-1.2169 ( 3853 PWs) bands (ev): -52.5223 -52.5223 -52.5121 -52.5121 -26.9209 -26.9209 -26.8810 -26.8810 -19.4613 -19.4613 -19.4083 -19.4083 -19.2031 -19.2031 -19.0832 -19.0832 -5.9365 -5.9365 -5.8362 -5.8362 -4.5696 -4.5696 -4.1400 -4.1400 3.0229 3.0229 4.2822 4.2822 4.3621 4.3621 4.6471 4.6471 5.2176 5.2176 5.5223 5.5223 6.1380 6.1380 6.1529 6.1529 6.2708 6.2708 6.6980 6.6980 7.2879 7.2879 7.6043 7.6043 11.9880 11.9880 12.4155 12.4155 13.0135 13.0135 13.6349 13.6349 13.8466 13.8466 k = 0.6365 0.1224-1.1873 ( 3858 PWs) bands (ev): -52.5227 -52.5227 -52.5121 -52.5121 -26.9210 -26.9210 -26.8792 -26.8792 -19.4600 -19.4600 -19.4031 -19.4031 -19.2024 -19.2024 -19.0817 -19.0817 -5.9460 -5.9460 -5.8443 -5.8443 -4.5868 -4.5868 -4.1439 -4.1439 3.0508 3.0508 4.2790 4.2790 4.3637 4.3637 4.6489 4.6489 5.2025 5.2025 5.5005 5.5005 6.1404 6.1404 6.1819 6.1819 6.2904 6.2904 6.6795 6.6795 7.2568 7.2568 7.6111 7.6111 12.0389 12.0389 12.4058 12.4058 13.0212 13.0212 13.6482 13.6482 13.8452 13.8452 k = 0.6333 0.1218-1.1577 ( 3854 PWs) bands (ev): -52.5231 -52.5231 -52.5120 -52.5120 -26.9209 -26.9209 -26.8773 -26.8773 -19.4584 -19.4584 -19.3974 -19.3974 -19.2014 -19.2014 -19.0802 -19.0802 -5.9563 -5.9563 -5.8537 -5.8537 -4.6049 -4.6049 -4.1486 -4.1486 3.0804 3.0804 4.2669 4.2669 4.3756 4.3756 4.6527 4.6527 5.1861 5.1861 5.4799 5.4799 6.1323 6.1323 6.2150 6.2150 6.3147 6.3147 6.6606 6.6606 7.2239 7.2239 7.6191 7.6191 12.0888 12.0888 12.3955 12.3955 13.0304 13.0304 13.6581 13.6581 13.8484 13.8484 k = 0.6300 0.1212-1.1281 ( 3862 PWs) bands (ev): -52.5235 -52.5235 -52.5120 -52.5120 -26.9208 -26.9208 -26.8753 -26.8753 -19.4567 -19.4567 -19.3913 -19.3913 -19.2003 -19.2003 -19.0786 -19.0786 -5.9673 -5.9673 -5.8644 -5.8644 -4.6240 -4.6240 -4.1540 -4.1540 3.1113 3.1113 4.2504 4.2504 4.3927 4.3927 4.6594 4.6594 5.1686 5.1686 5.4609 5.4609 6.1219 6.1219 6.2435 6.2435 6.3430 6.3430 6.6418 6.6418 7.1899 7.1899 7.6282 7.6282 12.1354 12.1354 12.3851 12.3851 13.0411 13.0411 13.6635 13.6635 13.8576 13.8576 k = 0.6268 0.1205-1.0984 ( 3868 PWs) bands (ev): -52.5239 -52.5239 -52.5119 -52.5119 -26.9207 -26.9207 -26.8732 -26.8732 -19.4548 -19.4548 -19.3849 -19.3849 -19.1990 -19.1990 -19.0769 -19.0769 -5.9791 -5.9791 -5.8764 -5.8764 -4.6437 -4.6437 -4.1603 -4.1603 3.1433 3.1433 4.2328 4.2328 4.4116 4.4116 4.6696 4.6696 5.1500 5.1500 5.4436 5.4436 6.1096 6.1096 6.2680 6.2680 6.3729 6.3729 6.6242 6.6242 7.1555 7.1555 7.6384 7.6384 12.1761 12.1761 12.3755 12.3755 13.0532 13.0532 13.6639 13.6639 13.8739 13.8739 k = 0.6235 0.1199-1.0688 ( 3868 PWs) bands (ev): -52.5244 -52.5244 -52.5119 -52.5119 -26.9205 -26.9205 -26.8709 -26.8709 -19.4527 -19.4527 -19.3781 -19.3781 -19.1974 -19.1974 -19.0751 -19.0751 -5.9916 -5.9916 -5.8897 -5.8897 -4.6638 -4.6638 -4.1673 -4.1673 3.1758 3.1758 4.2155 4.2155 4.4306 4.4306 4.6840 4.6840 5.1306 5.1306 5.4285 5.4285 6.0952 6.0952 6.2896 6.2896 6.4011 6.4011 6.6096 6.6096 7.1215 7.1215 7.6498 7.6498 12.2078 12.2078 12.3680 12.3680 13.0660 13.0660 13.6601 13.6601 13.8977 13.8977 k = 0.6203 0.1193-1.0392 ( 3874 PWs) bands (ev): -52.5249 -52.5249 -52.5119 -52.5119 -26.9202 -26.9202 -26.8686 -26.8686 -19.4505 -19.4505 -19.3711 -19.3711 -19.1956 -19.1956 -19.0732 -19.0732 -6.0047 -6.0047 -5.9043 -5.9043 -4.6843 -4.6843 -4.1751 -4.1751 3.2085 3.2085 4.1992 4.1992 4.4486 4.4486 4.7029 4.7029 5.1104 5.1104 5.4160 5.4160 6.0785 6.0785 6.3092 6.3092 6.4227 6.4227 6.6017 6.6017 7.0884 7.0884 7.6622 7.6622 12.2282 12.2282 12.3638 12.3638 13.0787 13.0787 13.6532 13.6532 13.9295 13.9295 k = 0.6170 0.1187-1.0096 ( 3871 PWs) bands (ev): -52.5254 -52.5254 -52.5118 -52.5118 -26.9199 -26.9199 -26.8661 -26.8661 -19.4482 -19.4482 -19.3637 -19.3637 -19.1935 -19.1935 -19.0713 -19.0713 -6.0185 -6.0185 -5.9203 -5.9203 -4.7049 -4.7049 -4.1837 -4.1837 3.2407 3.2407 4.1847 4.1847 4.4654 4.4654 4.7262 4.7262 5.0898 5.0898 5.4064 5.4064 6.0592 6.0592 6.3268 6.3268 6.4334 6.4334 6.6046 6.6046 7.0571 7.0571 7.6757 7.6757 12.2363 12.2363 12.3631 12.3631 13.0899 13.0899 13.6440 13.6440 13.9700 13.9700 k = 0.6138 0.1180-0.9799 ( 3870 PWs) bands (ev): -52.5259 -52.5259 -52.5118 -52.5118 -26.9195 -26.9195 -26.8637 -26.8637 -19.4458 -19.4458 -19.3561 -19.3561 -19.1910 -19.1910 -19.0693 -19.0693 -6.0330 -6.0330 -5.9375 -5.9375 -4.7254 -4.7254 -4.1930 -4.1930 3.2722 3.2722 4.1722 4.1722 4.4809 4.4809 4.7533 4.7533 5.0690 5.0690 5.4005 5.4005 6.0371 6.0371 6.3411 6.3411 6.4330 6.4330 6.6194 6.6194 7.0282 7.0282 7.6901 7.6901 12.2342 12.2342 12.3637 12.3637 13.0981 13.0981 13.6332 13.6332 14.0186 14.0186 k = 0.6105 0.1174-0.9503 ( 3874 PWs) bands (ev): -52.5264 -52.5264 -52.5118 -52.5118 -26.9191 -26.9191 -26.8611 -26.8611 -19.4433 -19.4433 -19.3483 -19.3483 -19.1883 -19.1883 -19.0673 -19.0673 -6.0480 -6.0480 -5.9559 -5.9559 -4.7459 -4.7459 -4.2031 -4.2031 3.3025 3.3025 4.1621 4.1621 4.4954 4.4954 4.7831 4.7831 5.0487 5.0487 5.3987 5.3987 6.0119 6.0119 6.3482 6.3482 6.4287 6.4287 6.6427 6.6427 7.0022 7.0022 7.7055 7.7055 12.2255 12.2255 12.3624 12.3624 13.1022 13.1022 13.6211 13.6211 14.0681 14.0681 k = 0.6073 0.1168-0.9207 ( 3859 PWs) bands (ev): -52.5269 -52.5269 -52.5118 -52.5118 -26.9184 -26.9184 -26.8584 -26.8584 -19.4407 -19.4407 -19.3402 -19.3402 -19.1852 -19.1852 -19.0653 -19.0653 -6.0637 -6.0637 -5.9755 -5.9755 -4.7660 -4.7660 -4.2138 -4.2138 3.3312 3.3312 4.1546 4.1546 4.5090 4.5090 4.8138 4.8138 5.0300 5.0300 5.4018 5.4018 5.9835 5.9835 6.3422 6.3422 6.4308 6.4308 6.6702 6.6702 6.9797 6.9797 7.7218 7.7218 12.2128 12.2128 12.3575 12.3575 13.1012 13.1012 13.6079 13.6079 14.1058 14.1058 k = 0.6040 0.1162-0.8911 ( 3865 PWs) bands (ev): -52.5274 -52.5274 -52.5118 -52.5118 -26.9180 -26.9180 -26.8557 -26.8557 -19.4383 -19.4383 -19.3320 -19.3320 -19.1819 -19.1819 -19.0632 -19.0632 -6.0798 -6.0798 -5.9963 -5.9963 -4.7858 -4.7858 -4.2251 -4.2251 3.3581 3.3581 4.1500 4.1500 4.5220 4.5220 4.8427 4.8427 5.0150 5.0150 5.4102 5.4102 5.9519 5.9519 6.3231 6.3231 6.4420 6.4420 6.6989 6.6989 6.9608 6.9608 7.7389 7.7389 12.1980 12.1980 12.3480 12.3480 13.0950 13.0950 13.5936 13.5936 14.1362 14.1362 k = 0.6008 0.1155-0.8615 ( 3862 PWs) bands (ev): -52.5279 -52.5279 -52.5119 -52.5119 -26.9174 -26.9174 -26.8530 -26.8530 -19.4358 -19.4358 -19.3236 -19.3236 -19.1781 -19.1781 -19.0612 -19.0612 -6.0966 -6.0966 -6.0181 -6.0181 -4.8051 -4.8051 -4.2370 -4.2370 3.3829 3.3829 4.1483 4.1483 4.5341 4.5341 4.8647 4.8647 5.0084 5.0084 5.4245 5.4245 5.9171 5.9171 6.2963 6.2963 6.4586 6.4586 6.7270 6.7270 6.9460 6.9460 7.7568 7.7568 12.1820 12.1820 12.3343 12.3343 13.0835 13.0835 13.5782 13.5782 14.1632 14.1632 k = 0.5975 0.1149-0.8318 ( 3865 PWs) bands (ev): -52.5285 -52.5285 -52.5119 -52.5119 -26.9167 -26.9167 -26.8503 -26.8503 -19.4333 -19.4333 -19.3152 -19.3152 -19.1741 -19.1741 -19.0593 -19.0593 -6.1138 -6.1138 -6.0407 -6.0407 -4.8238 -4.8238 -4.2494 -4.2494 3.4058 3.4058 4.1496 4.1496 4.5452 4.5452 4.8734 4.8734 5.0165 5.0165 5.4450 5.4450 5.8793 5.8793 6.2657 6.2657 6.4777 6.4777 6.7538 6.7538 6.9351 6.9351 7.7755 7.7755 12.1653 12.1653 12.3168 12.3168 13.0672 13.0672 13.5616 13.5616 14.1867 14.1867 k = 0.5943 0.1143-0.8022 ( 3863 PWs) bands (ev): -52.5290 -52.5290 -52.5119 -52.5119 -26.9161 -26.9161 -26.8476 -26.8476 -19.4309 -19.4309 -19.3066 -19.3066 -19.1696 -19.1696 -19.0573 -19.0573 -6.1316 -6.1316 -6.0642 -6.0642 -4.8419 -4.8419 -4.2623 -4.2623 3.4267 3.4267 4.1538 4.1538 4.5547 4.5547 4.8678 4.8678 5.0405 5.0405 5.4715 5.4715 5.8389 5.8389 6.2332 6.2332 6.4984 6.4984 6.7783 6.7783 6.9282 6.9282 7.7948 7.7948 12.1483 12.1483 12.2961 12.2961 13.0465 13.0465 13.5440 13.5440 14.2059 14.2059 k = 0.5910 0.1137-0.7726 ( 3861 PWs) bands (ev): -52.5295 -52.5295 -52.5120 -52.5120 -26.9153 -26.9153 -26.8448 -26.8448 -19.4286 -19.4286 -19.2980 -19.2980 -19.1649 -19.1649 -19.0554 -19.0554 -6.1500 -6.1500 -6.0882 -6.0882 -4.8594 -4.8594 -4.2756 -4.2756 3.4459 3.4459 4.1608 4.1608 4.5622 4.5622 4.8532 4.8532 5.0751 5.0751 5.5037 5.5037 5.7963 5.7963 6.2002 6.2002 6.5199 6.5199 6.8003 6.8003 6.9251 6.9251 7.8148 7.8148 12.1312 12.1312 12.2728 12.2728 13.0218 13.0218 13.5253 13.5253 14.2198 14.2198 k = 0.5878 0.1130-0.7430 ( 3869 PWs) bands (ev): -52.5301 -52.5301 -52.5120 -52.5120 -26.9146 -26.9146 -26.8422 -26.8422 -19.4264 -19.4264 -19.2894 -19.2894 -19.1598 -19.1598 -19.0536 -19.0536 -6.1690 -6.1690 -6.1126 -6.1126 -4.8761 -4.8761 -4.2892 -4.2892 3.4637 3.4637 4.1705 4.1705 4.5673 4.5673 4.8344 4.8344 5.1154 5.1154 5.5408 5.5408 5.7520 5.7520 6.1678 6.1678 6.5421 6.5421 6.8195 6.8195 6.9256 6.9256 7.8353 7.8353 12.1140 12.1140 12.2478 12.2478 12.9933 12.9933 13.5055 13.5055 14.2272 14.2272 k = 0.5845 0.1124-0.7133 ( 3873 PWs) bands (ev): -52.5306 -52.5306 -52.5121 -52.5121 -26.9139 -26.9139 -26.8395 -26.8395 -19.4243 -19.4243 -19.2808 -19.2808 -19.1545 -19.1545 -19.0517 -19.0517 -6.1887 -6.1887 -6.1371 -6.1371 -4.8921 -4.8921 -4.3030 -4.3030 3.4806 3.4806 4.1827 4.1827 4.5696 4.5696 4.8141 4.8141 5.1590 5.1590 5.5811 5.5811 5.7070 5.7070 6.1373 6.1373 6.5649 6.5649 6.8357 6.8357 6.9292 6.9292 7.8562 7.8562 12.0970 12.0970 12.2214 12.2214 12.9615 12.9615 13.4847 13.4847 14.2267 14.2267 k = 0.5813 0.1118-0.6837 ( 3872 PWs) bands (ev): -52.5311 -52.5311 -52.5122 -52.5122 -26.9131 -26.9131 -26.8367 -26.8367 -19.4223 -19.4223 -19.2722 -19.2722 -19.1488 -19.1488 -19.0500 -19.0500 -6.2092 -6.2092 -6.1613 -6.1613 -4.9073 -4.9073 -4.3170 -4.3170 3.4968 3.4968 4.1972 4.1972 4.5690 4.5690 4.7935 4.7935 5.2038 5.2038 5.6179 5.6179 5.6677 5.6677 6.1105 6.1105 6.5880 6.5880 6.8491 6.8491 6.9354 6.9354 7.8774 7.8774 12.0800 12.0800 12.1943 12.1943 12.9265 12.9265 13.4629 13.4629 14.2170 14.2170 k = 0.5780 0.1112-0.6541 ( 3868 PWs) bands (ev): -52.5317 -52.5317 -52.5122 -52.5122 -26.9122 -26.9122 -26.8340 -26.8340 -19.4204 -19.4204 -19.2636 -19.2636 -19.1428 -19.1428 -19.0483 -19.0483 -6.2309 -6.2309 -6.1850 -6.1850 -4.9218 -4.9218 -4.3312 -4.3312 3.5129 3.5129 4.2137 4.2137 4.5655 4.5655 4.7734 4.7734 5.2478 5.2478 5.6018 5.6018 5.6825 5.6825 6.0894 6.0894 6.6114 6.6114 6.8599 6.8599 6.9436 6.9436 7.8987 7.8987 12.0632 12.0632 12.1671 12.1671 12.8887 12.8887 13.4401 13.4401 14.1964 14.1964 k = 0.5748 0.1105-0.6245 ( 3874 PWs) bands (ev): -52.5322 -52.5322 -52.5123 -52.5123 -26.9115 -26.9115 -26.8314 -26.8314 -19.4186 -19.4186 -19.2551 -19.2551 -19.1368 -19.1368 -19.0467 -19.0467 -6.2536 -6.2536 -6.2076 -6.2076 -4.9355 -4.9355 -4.3453 -4.3453 3.5292 3.5292 4.2321 4.2321 4.5593 4.5593 4.7544 4.7544 5.2881 5.2881 5.5568 5.5568 5.7268 5.7268 6.0767 6.0767 6.6351 6.6351 6.8685 6.8685 6.9531 6.9531 7.9199 7.9199 12.0463 12.0463 12.1401 12.1401 12.8481 12.8481 13.4164 13.4164 14.1639 14.1639 k = 0.5715 0.1099-0.5948 ( 3872 PWs) bands (ev): -52.5327 -52.5327 -52.5124 -52.5124 -26.9106 -26.9106 -26.8288 -26.8288 -19.4170 -19.4170 -19.2466 -19.2466 -19.1304 -19.1304 -19.0453 -19.0453 -6.2775 -6.2775 -6.2292 -6.2292 -4.9484 -4.9484 -4.3595 -4.3595 3.5461 3.5461 4.2520 4.2520 4.5505 4.5505 4.7368 4.7368 5.3214 5.3214 5.5098 5.5098 5.7737 5.7737 6.0752 6.0752 6.6589 6.6589 6.8751 6.8751 6.9637 6.9637 7.9409 7.9409 12.0294 12.0294 12.1139 12.1139 12.8050 12.8050 13.3920 13.3920 14.1194 14.1194 k = 0.5683 0.1093-0.5652 ( 3876 PWs) bands (ev): -52.5332 -52.5332 -52.5125 -52.5125 -26.9098 -26.9098 -26.8263 -26.8263 -19.4156 -19.4156 -19.2382 -19.2382 -19.1240 -19.1240 -19.0439 -19.0439 -6.3023 -6.3023 -6.2497 -6.2497 -4.9606 -4.9606 -4.3736 -4.3736 3.5640 3.5640 4.2732 4.2732 4.5397 4.5397 4.7209 4.7209 5.3437 5.3437 5.4633 5.4633 5.8219 5.8219 6.0870 6.0870 6.6826 6.6826 6.8798 6.8798 6.9750 6.9750 7.9613 7.9613 12.0123 12.0123 12.0889 12.0889 12.7598 12.7598 13.3668 13.3668 14.0648 14.0648 k = 0.5650 0.1087-0.5356 ( 3875 PWs) bands (ev): -52.5336 -52.5336 -52.5126 -52.5126 -26.9089 -26.9089 -26.8238 -26.8238 -19.4142 -19.4142 -19.2300 -19.2300 -19.1175 -19.1175 -19.0425 -19.0425 -6.3277 -6.3277 -6.2692 -6.2692 -4.9721 -4.9721 -4.3875 -4.3875 3.5830 3.5830 4.2952 4.2952 4.5275 4.5275 4.7067 4.7067 5.3509 5.3509 5.4191 5.4191 5.8729 5.8729 6.1118 6.1118 6.7062 6.7062 6.8827 6.8827 6.9870 6.9870 7.9810 7.9810 11.9949 11.9949 12.0655 12.0655 12.7127 12.7127 13.3410 13.3410 14.0032 14.0032 k = 0.5618 0.1080-0.5060 ( 3879 PWs) bands (ev): -52.5341 -52.5341 -52.5127 -52.5127 -26.9081 -26.9081 -26.8214 -26.8214 -19.4130 -19.4130 -19.2219 -19.2219 -19.1109 -19.1109 -19.0414 -19.0414 -6.3533 -6.3533 -6.2878 -6.2878 -4.9828 -4.9828 -4.4013 -4.4013 3.6035 3.6035 4.3173 4.3173 4.5145 4.5145 4.6943 4.6943 5.3387 5.3387 5.3810 5.3810 5.9287 5.9287 6.1475 6.1475 6.7296 6.7296 6.8840 6.8840 6.9995 6.9995 7.9996 7.9996 11.9771 11.9771 12.0441 12.0441 12.6640 12.6640 13.3146 13.3146 13.9375 13.9375 k = 0.5585 0.1074-0.4763 ( 3873 PWs) bands (ev): -52.5345 -52.5345 -52.5127 -52.5127 -26.9072 -26.9072 -26.8191 -26.8191 -19.4118 -19.4118 -19.2139 -19.2139 -19.1043 -19.1043 -19.0403 -19.0403 -6.3789 -6.3789 -6.3056 -6.3056 -4.9929 -4.9929 -4.4147 -4.4147 3.6257 3.6257 4.3388 4.3388 4.5019 4.5019 4.6838 4.6838 5.3070 5.3070 5.3505 5.3505 5.9902 5.9902 6.1909 6.1909 6.7524 6.7524 6.8840 6.8840 7.0126 7.0126 8.0170 8.0170 11.9589 11.9589 12.0248 12.0248 12.6142 12.6142 13.2877 13.2877 13.8702 13.8702 k = 0.5553 0.1068-0.4467 ( 3877 PWs) bands (ev): -52.5350 -52.5350 -52.5128 -52.5128 -26.9064 -26.9064 -26.8168 -26.8168 -19.4108 -19.4108 -19.2062 -19.2062 -19.0978 -19.0978 -19.0394 -19.0394 -6.4041 -6.4041 -6.3228 -6.3228 -5.0022 -5.0022 -4.4278 -4.4278 3.6496 3.6496 4.3578 4.3578 4.4913 4.4913 4.6754 4.6754 5.2673 5.2673 5.3187 5.3187 6.0567 6.0567 6.2391 6.2391 6.7743 6.7743 6.8836 6.8836 7.0261 7.0261 8.0328 8.0328 11.9404 11.9404 12.0075 12.0075 12.5638 12.5638 13.2604 13.2604 13.8031 13.8031 k = 0.5520 0.1062-0.4171 ( 3879 PWs) bands (ev): -52.5354 -52.5354 -52.5129 -52.5129 -26.9057 -26.9057 -26.8147 -26.8147 -19.4100 -19.4100 -19.1987 -19.1987 -19.0914 -19.0914 -19.0385 -19.0385 -6.4288 -6.4288 -6.3392 -6.3392 -5.0110 -5.0110 -4.4405 -4.4405 3.6755 3.6755 4.3720 4.3720 4.4851 4.4851 4.6691 4.6691 5.2263 5.2263 5.2813 5.2813 6.1267 6.1267 6.2900 6.2900 6.7947 6.7947 6.8835 6.8835 7.0398 7.0398 8.0469 8.0469 11.9220 11.9220 11.9922 11.9922 12.5133 12.5133 13.2328 13.2328 13.7374 13.7374 k = 0.5488 0.1055-0.3875 ( 3887 PWs) bands (ev): -52.5358 -52.5358 -52.5130 -52.5130 -26.9050 -26.9050 -26.8127 -26.8127 -19.4092 -19.4092 -19.1914 -19.1914 -19.0852 -19.0852 -19.0378 -19.0378 -6.4529 -6.4529 -6.3549 -6.3549 -5.0190 -5.0190 -4.4527 -4.4527 3.7033 3.7033 4.3784 4.3784 4.4857 4.4857 4.6655 4.6655 5.1862 5.1862 5.2387 5.2387 6.1978 6.1978 6.3424 6.3424 6.8127 6.8127 6.8855 6.8855 7.0535 7.0535 8.0589 8.0589 11.9039 11.9039 11.9785 11.9785 12.4633 12.4633 13.2049 13.2049 13.6737 13.6737 k = 0.5455 0.1049-0.3578 ( 3889 PWs) bands (ev): -52.5362 -52.5362 -52.5131 -52.5131 -26.9043 -26.9043 -26.8107 -26.8107 -19.4085 -19.4085 -19.1843 -19.1843 -19.0791 -19.0791 -19.0372 -19.0372 -6.4760 -6.4760 -6.3698 -6.3698 -5.0265 -5.0265 -4.4644 -4.4644 3.7332 3.7332 4.3764 4.3764 4.4931 4.4931 4.6650 4.6650 5.1473 5.1473 5.1922 5.1922 6.2668 6.2668 6.3966 6.3966 6.8272 6.8272 6.8914 6.8914 7.0673 7.0673 8.0688 8.0688 11.8863 11.8863 11.9663 11.9663 12.4145 12.4145 13.1768 13.1768 13.6128 13.6128 k = 0.5423 0.1043-0.3282 ( 3891 PWs) bands (ev): -52.5365 -52.5365 -52.5132 -52.5132 -26.9036 -26.9036 -26.8088 -26.8088 -19.4079 -19.4079 -19.1776 -19.1776 -19.0732 -19.0732 -19.0367 -19.0367 -6.4982 -6.4982 -6.3840 -6.3840 -5.0333 -5.0333 -4.4756 -4.4756 3.7651 3.7651 4.3687 4.3687 4.5038 4.5038 4.6685 4.6685 5.1097 5.1097 5.1433 5.1433 6.3293 6.3293 6.4542 6.4542 6.8378 6.8378 6.9023 6.9023 7.0808 7.0808 8.0762 8.0762 11.8695 11.8695 11.9553 11.9553 12.3674 12.3674 13.1486 13.1486 13.5548 13.5548 k = 0.5390 0.1037-0.2986 ( 3887 PWs) bands (ev): -52.5369 -52.5369 -52.5133 -52.5133 -26.9029 -26.9029 -26.8071 -26.8071 -19.4073 -19.4073 -19.1711 -19.1711 -19.0676 -19.0676 -19.0364 -19.0364 -6.5192 -6.5192 -6.3973 -6.3973 -5.0396 -5.0396 -4.4861 -4.4861 3.7991 3.7991 4.3580 4.3580 4.5143 4.5143 4.6765 4.6765 5.0715 5.0715 5.0947 5.0947 6.3807 6.3807 6.5171 6.5171 6.8465 6.8465 6.9173 6.9173 7.0941 7.0941 8.0811 8.0811 11.8534 11.8534 11.9453 11.9453 12.3228 12.3228 13.1203 13.1203 13.5002 13.5002 k = 0.5358 0.1030-0.2690 ( 3884 PWs) bands (ev): -52.5372 -52.5372 -52.5133 -52.5133 -26.9022 -26.9022 -26.8054 -26.8054 -19.4068 -19.4068 -19.1649 -19.1649 -19.0623 -19.0623 -19.0361 -19.0361 -6.5389 -6.5389 -6.4098 -6.4098 -5.0453 -5.0453 -4.4960 -4.4960 3.8350 3.8350 4.3463 4.3463 4.5224 4.5224 4.6888 4.6888 5.0266 5.0266 5.0537 5.0537 6.4193 6.4193 6.5850 6.5850 6.8558 6.8558 6.9346 6.9346 7.1070 7.1070 8.0834 8.0834 11.8382 11.8382 11.9363 11.9363 12.2812 12.2812 13.0920 13.0920 13.4492 13.4492 k = 0.5325 0.1024-0.2394 ( 3885 PWs) bands (ev): -52.5374 -52.5374 -52.5134 -52.5134 -26.9017 -26.9017 -26.8039 -26.8039 -19.4064 -19.4064 -19.1591 -19.1591 -19.0573 -19.0573 -19.0359 -19.0359 -6.5573 -6.5573 -6.4213 -6.4213 -5.0505 -5.0505 -4.5052 -4.5052 3.8729 3.8729 4.3344 4.3344 4.5276 4.5276 4.7046 4.7046 4.9744 4.9744 5.0216 5.0216 6.4460 6.4460 6.6552 6.6552 6.8675 6.8675 6.9529 6.9529 7.1196 7.1196 8.0829 8.0829 11.8239 11.8239 11.9280 11.9280 12.2433 12.2433 13.0638 13.0638 13.4020 13.4020 k = 0.5293 0.1018-0.2097 ( 3885 PWs) bands (ev): -52.5377 -52.5377 -52.5135 -52.5135 -26.9011 -26.9011 -26.8026 -26.8026 -19.4061 -19.4061 -19.1537 -19.1537 -19.0529 -19.0529 -19.0358 -19.0358 -6.5742 -6.5742 -6.4320 -6.4320 -5.0551 -5.0551 -4.5136 -4.5136 3.9126 3.9126 4.3230 4.3230 4.5302 4.5302 4.7223 4.7223 4.9202 4.9202 4.9941 4.9941 6.4627 6.4627 6.7247 6.7247 6.8823 6.8823 6.9716 6.9716 7.1318 7.1318 8.0798 8.0798 11.8103 11.8103 11.9204 11.9204 12.2094 12.2094 13.0358 13.0358 13.3588 13.3588 k = 0.5260 0.1012-0.1801 ( 3886 PWs) bands (ev): -52.5380 -52.5380 -52.5135 -52.5135 -26.9006 -26.9006 -26.8014 -26.8014 -19.4057 -19.4057 -19.1487 -19.1487 -19.0489 -19.0489 -19.0357 -19.0357 -6.5895 -6.5895 -6.4416 -6.4416 -5.0592 -5.0592 -4.5212 -4.5212 3.9540 3.9540 4.3125 4.3125 4.5309 4.5309 4.7393 4.7393 4.8669 4.8669 4.9702 4.9702 6.4714 6.4714 6.7901 6.7901 6.9005 6.9005 6.9902 6.9902 7.1437 7.1437 8.0742 8.0742 11.7976 11.7976 11.9132 11.9132 12.1801 12.1801 13.0083 13.0083 13.3200 13.3200 k = 0.5228 0.1005-0.1505 ( 3884 PWs) bands (ev): -52.5382 -52.5382 -52.5136 -52.5136 -26.9000 -26.9000 -26.8003 -26.8003 -19.4054 -19.4054 -19.1442 -19.1442 -19.0454 -19.0454 -19.0356 -19.0356 -6.6033 -6.6033 -6.4502 -6.4502 -5.0628 -5.0628 -4.5281 -4.5281 3.9969 3.9969 4.3032 4.3032 4.5301 4.5301 4.7487 4.7487 4.8205 4.8205 4.9498 4.9498 6.4743 6.4743 6.8470 6.8470 6.9233 6.9233 7.0085 7.0085 7.1556 7.1556 8.0664 8.0664 11.7858 11.7858 11.9064 11.9064 12.1554 12.1554 12.9816 12.9816 13.2856 13.2856 k = 0.5195 0.0999-0.1209 ( 3882 PWs) bands (ev): -52.5384 -52.5384 -52.5136 -52.5136 -26.8996 -26.8996 -26.7994 -26.7994 -19.4052 -19.4052 -19.1402 -19.1402 -19.0425 -19.0425 -19.0353 -19.0353 -6.6153 -6.6153 -6.4577 -6.4577 -5.0658 -5.0658 -4.5340 -4.5340 4.0408 4.0408 4.2952 4.2952 4.5281 4.5281 4.7288 4.7288 4.8025 4.8025 4.9331 4.9331 6.4731 6.4731 6.8891 6.8891 6.9538 6.9538 7.0267 7.0267 7.1679 7.1679 8.0568 8.0568 11.7750 11.7750 11.9000 11.9000 12.1354 12.1354 12.9563 12.9563 13.2559 13.2559 k = 0.5163 0.0993-0.0912 ( 3884 PWs) bands (ev): -52.5385 -52.5385 -52.5136 -52.5136 -26.8993 -26.8993 -26.7986 -26.7986 -19.4050 -19.4050 -19.1367 -19.1367 -19.0406 -19.0406 -19.0346 -19.0346 -6.6256 -6.6256 -6.4641 -6.4641 -5.0684 -5.0684 -4.5391 -4.5391 4.0854 4.0854 4.2890 4.2890 4.5247 4.5247 4.6837 4.6837 4.8085 4.8085 4.9206 4.9206 6.4694 6.4694 6.9156 6.9156 6.9892 6.9892 7.0448 7.0448 7.1811 7.1811 8.0460 8.0460 11.7654 11.7654 11.8941 11.8941 12.1198 12.1198 12.9331 12.9331 13.2309 13.2309 k = 0.5130 0.0987-0.0616 ( 3882 PWs) bands (ev): -52.5386 -52.5386 -52.5137 -52.5137 -26.8990 -26.8990 -26.7979 -26.7979 -19.4049 -19.4049 -19.1338 -19.1338 -19.0395 -19.0395 -19.0335 -19.0335 -6.6340 -6.6340 -6.4694 -6.4694 -5.0706 -5.0706 -4.5433 -4.5433 4.1295 4.1295 4.2851 4.2851 4.5186 4.5186 4.6363 4.6363 4.8167 4.8167 4.9124 4.9124 6.4647 6.4647 6.9327 6.9327 7.0200 7.0200 7.0633 7.0633 7.1956 7.1956 8.0350 8.0350 11.7571 11.7571 11.8888 11.8888 12.1082 12.1082 12.9126 12.9126 13.2105 13.2105 k = 0.5098 0.0980-0.0320 ( 3877 PWs) bands (ev): -52.5387 -52.5387 -52.5137 -52.5137 -26.8988 -26.8988 -26.7973 -26.7973 -19.4047 -19.4047 -19.1315 -19.1315 -19.0391 -19.0391 -19.0323 -19.0323 -6.6407 -6.6407 -6.4735 -6.4735 -5.0722 -5.0722 -4.5466 -4.5466 4.1710 4.1710 4.2848 4.2848 4.5066 4.5066 4.5956 4.5956 4.8224 4.8224 4.9083 4.9083 6.4600 6.4600 6.9446 6.9446 7.0412 7.0412 7.0809 7.0809 7.2109 7.2109 8.0246 8.0246 11.7503 11.7503 11.8844 11.8844 12.1000 12.1000 12.8957 12.8957 13.1948 13.1948 k = 0.5065 0.0974-0.0024 ( 3897 PWs) bands (ev): -52.5388 -52.5388 -52.5137 -52.5137 -26.8987 -26.8987 -26.7972 -26.7972 -19.4047 -19.4047 -19.1299 -19.1299 -19.0390 -19.0390 -19.0314 -19.0314 -6.6455 -6.6455 -6.4765 -6.4765 -5.0734 -5.0734 -4.5490 -4.5490 4.2050 4.2050 4.2913 4.2913 4.4836 4.4836 4.5694 4.5694 4.8252 4.8252 4.9072 4.9072 6.4560 6.4560 6.9527 6.9527 7.0543 7.0543 7.0946 7.0946 7.2249 7.2249 8.0161 8.0161 11.7453 11.7453 11.8811 11.8811 12.0946 12.0946 12.8830 12.8830 13.1837 13.1837 k = 0.5033 0.0968 0.0273 ( 3897 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7969 -26.7969 -19.4047 -19.4047 -19.1289 -19.1289 -19.0390 -19.0390 -19.0307 -19.0307 -6.6483 -6.6483 -6.4783 -6.4783 -5.0741 -5.0741 -4.5504 -4.5504 4.2248 4.2248 4.3060 4.3060 4.4552 4.4552 4.5580 4.5580 4.8261 4.8261 4.9075 4.9075 6.4534 6.4534 6.9574 6.9574 7.0614 7.0614 7.1029 7.1029 7.2350 7.2350 8.0104 8.0104 11.7423 11.7423 11.8791 11.8791 12.0916 12.0916 12.8752 12.8752 13.1770 13.1770 k = 0.5000 0.0962 0.0569 ( 3896 PWs) bands (ev): -52.5389 -52.5389 -52.5137 -52.5137 -26.8986 -26.8986 -26.7968 -26.7968 -19.4047 -19.4047 -19.1286 -19.1286 -19.0390 -19.0390 -19.0305 -19.0305 -6.6493 -6.6493 -6.4789 -6.4789 -5.0743 -5.0743 -4.5509 -4.5509 4.2304 4.2304 4.3159 4.3159 4.4408 4.4408 4.5550 4.5550 4.8263 4.8263 4.9077 4.9077 6.4526 6.4526 6.9590 6.9590 7.0637 7.0637 7.1055 7.1055 7.2386 7.2386 8.0084 8.0084 11.7412 11.7412 11.8784 11.8784 12.0906 12.0906 12.8725 12.8725 13.1748 13.1748 k = 0.5000-1.2519-0.7406 ( 3860 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2055 -19.2055 -19.0893 -19.0893 -5.8716 -5.8716 -5.8351 -5.8351 -4.4908 -4.4908 -4.1286 -4.1286 2.8791 2.8791 4.1554 4.1554 4.7043 4.7043 4.7687 4.7687 5.2889 5.2889 5.3921 5.3921 5.6244 5.6244 6.0519 6.0519 6.3073 6.3073 7.0110 7.0110 7.4269 7.4269 7.6809 7.6809 11.7659 11.7659 12.4688 12.4688 13.0161 13.0161 13.4109 13.4109 13.8164 13.8164 k = 0.5271-1.2439-0.7359 ( 3856 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2055 -19.2055 -19.0893 -19.0893 -5.8720 -5.8720 -5.8347 -5.8347 -4.4908 -4.4908 -4.1286 -4.1286 2.8793 2.8793 4.1560 4.1560 4.7026 4.7026 4.7655 4.7655 5.2883 5.2883 5.3982 5.3982 5.6251 5.6251 6.0526 6.0526 6.3068 6.3068 7.0093 7.0093 7.4268 7.4268 7.6799 7.6799 11.7655 11.7655 12.4686 12.4686 13.0156 13.0156 13.4123 13.4123 13.8170 13.8170 k = 0.5542-1.2359-0.7311 ( 3860 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2055 -19.2055 -19.0893 -19.0893 -5.8730 -5.8730 -5.8336 -5.8336 -4.4910 -4.4910 -4.1286 -4.1286 2.8799 2.8799 4.1576 4.1576 4.6972 4.6972 4.7569 4.7569 5.2868 5.2868 5.4156 5.4156 5.6272 5.6272 6.0545 6.0545 6.3052 6.3052 7.0041 7.0041 7.4266 7.4266 7.6770 7.6770 11.7645 11.7645 12.4681 12.4681 13.0141 13.0141 13.4165 13.4165 13.8188 13.8188 k = 0.5813-1.2278-0.7264 ( 3862 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8889 -26.8889 -19.4654 -19.4654 -19.4311 -19.4311 -19.2056 -19.2056 -19.0893 -19.0893 -5.8747 -5.8747 -5.8320 -5.8320 -4.4912 -4.4912 -4.1286 -4.1286 2.8809 2.8809 4.1602 4.1602 4.6873 4.6873 4.7448 4.7448 5.2853 5.2853 5.4422 5.4422 5.6306 5.6306 6.0578 6.0578 6.3027 6.3027 6.9955 6.9955 7.4263 7.4263 7.6722 7.6722 11.7629 11.7629 12.4673 12.4673 13.0118 13.0118 13.4232 13.4232 13.8219 13.8219 k = 0.6083-1.2198-0.7216 ( 3850 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8888 -26.8888 -19.4654 -19.4654 -19.4310 -19.4310 -19.2055 -19.2055 -19.0892 -19.0892 -5.8767 -5.8767 -5.8299 -5.8299 -4.4915 -4.4915 -4.1285 -4.1285 2.8823 2.8823 4.1638 4.1638 4.6718 4.6718 4.7320 4.7320 5.2840 5.2840 5.4759 5.4759 5.6353 5.6353 6.0623 6.0623 6.2992 6.2992 6.9837 6.9837 7.4259 7.4259 7.6656 7.6656 11.7607 11.7607 12.4662 12.4662 13.0088 13.0088 13.4323 13.4323 13.8262 13.8262 k = 0.6354-1.2118-0.7169 ( 3850 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8888 -26.8888 -19.4654 -19.4654 -19.4310 -19.4310 -19.2055 -19.2055 -19.0892 -19.0892 -5.8789 -5.8789 -5.8276 -5.8276 -4.4918 -4.4918 -4.1285 -4.1285 2.8841 2.8841 4.1685 4.1685 4.6509 4.6509 4.7201 4.7201 5.2832 5.2832 5.5146 5.5146 5.6413 5.6413 6.0680 6.0680 6.2948 6.2948 6.9688 6.9688 7.4253 7.4253 7.6575 7.6575 11.7581 11.7581 12.4648 12.4648 13.0053 13.0053 13.4433 13.4433 13.8317 13.8317 k = 0.6625-1.2038-0.7122 ( 3850 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8888 -26.8888 -19.4654 -19.4654 -19.4309 -19.4309 -19.2055 -19.2055 -19.0892 -19.0892 -5.8812 -5.8812 -5.8252 -5.8252 -4.4922 -4.4922 -4.1285 -4.1285 2.8860 2.8860 4.1740 4.1740 4.6259 4.6259 4.7094 4.7094 5.2826 5.2826 5.5566 5.5566 5.6488 5.6488 6.0747 6.0747 6.2895 6.2895 6.9512 6.9512 7.4245 7.4245 7.6480 7.6480 11.7550 11.7550 12.4631 12.4631 13.0015 13.0015 13.4558 13.4558 13.8384 13.8384 k = 0.6896-1.1958-0.7074 ( 3848 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8887 -26.8887 -19.4654 -19.4654 -19.4309 -19.4309 -19.2055 -19.2055 -19.0892 -19.0892 -5.8835 -5.8835 -5.8228 -5.8228 -4.4927 -4.4927 -4.1285 -4.1285 2.8882 2.8882 4.1806 4.1806 4.5987 4.5987 4.6992 4.6992 5.2823 5.2823 5.5994 5.5994 5.6587 5.6587 6.0824 6.0824 6.2835 6.2835 6.9311 6.9311 7.4235 7.4235 7.6375 7.6375 11.7517 11.7517 12.4613 12.4613 12.9976 12.9976 13.4695 13.4695 13.8460 13.8460 k = 0.7167-1.1878-0.7027 ( 3846 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8887 -26.8887 -19.4654 -19.4654 -19.4308 -19.4308 -19.2054 -19.2054 -19.0892 -19.0892 -5.8858 -5.8858 -5.8206 -5.8206 -4.4932 -4.4932 -4.1285 -4.1285 2.8905 2.8905 4.1879 4.1879 4.5707 4.5707 4.6894 4.6894 5.2821 5.2821 5.6368 5.6368 5.6759 5.6759 6.0910 6.0910 6.2767 6.2767 6.9090 6.9090 7.4224 7.4224 7.6262 7.6262 11.7483 11.7483 12.4593 12.4593 12.9938 12.9938 13.4837 13.4837 13.8543 13.8543 k = 0.7438-1.1798-0.6979 ( 3846 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9204 -26.9204 -26.8886 -26.8886 -19.4654 -19.4654 -19.4307 -19.4307 -19.2055 -19.2055 -19.0891 -19.0891 -5.8879 -5.8879 -5.8185 -5.8185 -4.4937 -4.4937 -4.1285 -4.1285 2.8929 2.8929 4.1961 4.1961 4.5430 4.5430 4.6798 4.6798 5.2820 5.2820 5.6579 5.6579 5.7098 5.7098 6.1003 6.1003 6.2694 6.2694 6.8853 6.8853 7.4211 7.4211 7.6144 7.6144 11.7448 11.7448 12.4573 12.4573 12.9901 12.9901 13.4981 13.4981 13.8632 13.8632 k = 0.7708-1.1717-0.6932 ( 3850 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8886 -26.8886 -19.4654 -19.4654 -19.4306 -19.4306 -19.2055 -19.2055 -19.0891 -19.0891 -5.8898 -5.8898 -5.8166 -5.8166 -4.4943 -4.4943 -4.1285 -4.1285 2.8952 2.8952 4.2050 4.2050 4.5162 4.5162 4.6704 4.6704 5.2819 5.2819 5.6695 5.6695 5.7524 5.7524 6.1100 6.1100 6.2617 6.2617 6.8606 6.8606 7.4196 7.4196 7.6026 7.6026 11.7415 11.7415 12.4552 12.4552 12.9866 12.9866 13.5122 13.5122 13.8722 13.8722 k = 0.7979-1.1637-0.6885 ( 3844 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8885 -26.8885 -19.4654 -19.4654 -19.4305 -19.4305 -19.2055 -19.2055 -19.0890 -19.0890 -5.8915 -5.8915 -5.8149 -5.8149 -4.4948 -4.4948 -4.1285 -4.1285 2.8973 2.8973 4.2145 4.2145 4.4910 4.4910 4.6614 4.6614 5.2818 5.2818 5.6784 5.6784 5.7956 5.7956 6.1200 6.1200 6.2539 6.2539 6.8358 6.8358 7.4179 7.4179 7.5910 7.5910 11.7383 11.7383 12.4531 12.4531 12.9833 12.9833 13.5255 13.5255 13.8811 13.8811 k = 0.8250-1.1557-0.6837 ( 3846 PWs) bands (ev): -52.5208 -52.5208 -52.5124 -52.5124 -26.9205 -26.9205 -26.8885 -26.8885 -19.4654 -19.4654 -19.4304 -19.4304 -19.2055 -19.2055 -19.0890 -19.0890 -5.8929 -5.8929 -5.8136 -5.8136 -4.4954 -4.4954 -4.1285 -4.1285 2.8993 2.8993 4.2245 4.2245 4.4678 4.4678 4.6530 4.6530 5.2818 5.2818 5.6859 5.6859 5.8365 5.8365 6.1297 6.1297 6.2464 6.2464 6.8116 6.8116 7.4160 7.4160 7.5801 7.5801 11.7354 11.7354 12.4511 12.4511 12.9801 12.9801 13.5376 13.5376 13.8896 13.8896 Writing output data file HfNCl.save init_run : 0.52s CPU 0.78s WALL ( 1 calls) electrons : 452.53s CPU 456.64s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.09s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 452.53s CPU 456.63s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.09s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.08s WALL ( 325 calls) cegterg : 408.43s CPU 411.28s WALL ( 385 calls) Called by sum_band: Called by *egterg: h_psi : 358.49s CPU 360.75s WALL ( 7024 calls) s_psi : 6.04s CPU 6.06s WALL ( 7024 calls) g_psi : 0.23s CPU 0.23s WALL ( 6314 calls) cdiaghg : 66.77s CPU 67.70s WALL ( 6639 calls) cegterg:over : 6.90s CPU 7.01s WALL ( 6314 calls) cegterg:upda : 6.09s CPU 6.03s WALL ( 6314 calls) cegterg:last : 2.75s CPU 2.81s WALL ( 1038 calls) cdiaghg:chol : 3.91s CPU 3.91s WALL ( 6639 calls) cdiaghg:inve : 2.73s CPU 2.77s WALL ( 6639 calls) cdiaghg:para : 4.46s CPU 4.59s WALL ( 13278 calls) Called by h_psi: h_psi:vloc : 344.26s CPU 346.28s WALL ( 7024 calls) h_psi:vnl : 14.01s CPU 14.25s WALL ( 7024 calls) add_vuspsi : 7.33s CPU 7.38s WALL ( 7024 calls) General routines calbec : 6.68s CPU 6.85s WALL ( 7024 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 318.15s CPU 320.15s WALL ( 840564 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.20s CPU 0.21s WALL ( 650 calls) Parallel routines fft_scatter : 58.47s CPU 58.66s WALL ( 840587 calls) PWSCF : 7m50.22s CPU 8m19.56s WALL This run was terminated on: 17:28:40 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=