Program PWSCF v.5.1.1 starts on 11Oct2015 at 3: 8:34 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./SrxSnAsx2.save/ file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 58 42 12 1379 853 133 Max 59 43 13 1383 872 137 Sum 2831 2063 601 66297 41457 6467 bravais-lattice index = 14 lattice parameter (alat) = 17.4498 a.u. unit-cell volume = 920.2329 (a.u.)^3 number of atoms/cell = 5 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 = 263.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 17.449798 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.896364 celldm(5)= 0.896364 celldm(6)= 0.896364 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.896364 0.443320 0.000000 ) a(3) = ( 0.896364 0.209546 0.390670 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -2.021935 -1.209910 ) b(2) = ( 0.000000 2.255709 -1.209910 ) b(3) = ( 0.000000 0.000000 2.559708 ) PseudoPot. # 1 for As read from file: /home/autes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 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 1209 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 PseudoPot. # 2 for Sn read from file: /home/autes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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 Sr read from file: /home/autes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 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 atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) Sn 14.00 118.71000 Sn( 1.00) Sr 10.00 87.62000 Sr( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 282 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0113636 -0.0229765 -0.0137490), wk = 0.0035461 k( 3) = ( 0.0227273 -0.0459531 -0.0274979), wk = 0.0035461 k( 4) = ( 0.0340909 -0.0689296 -0.0412469), wk = 0.0035461 k( 5) = ( 0.0454546 -0.0919062 -0.0549959), wk = 0.0035461 k( 6) = ( 0.0568182 -0.1148827 -0.0687449), wk = 0.0035461 k( 7) = ( 0.0681818 -0.1378592 -0.0824939), wk = 0.0035461 k( 8) = ( 0.0795455 -0.1608358 -0.0962428), wk = 0.0035461 k( 9) = ( 0.0909091 -0.1838123 -0.1099918), wk = 0.0035461 k( 10) = ( 0.1022727 -0.2067889 -0.1237408), wk = 0.0035461 k( 11) = ( 0.1136364 -0.2297654 -0.1374898), wk = 0.0035461 k( 12) = ( 0.1250000 -0.2527419 -0.1512387), wk = 0.0035461 k( 13) = ( 0.1363636 -0.2757185 -0.1649877), wk = 0.0035461 k( 14) = ( 0.1477273 -0.2986950 -0.1787367), wk = 0.0035461 k( 15) = ( 0.1590909 -0.3216715 -0.1924857), wk = 0.0035461 k( 16) = ( 0.1704546 -0.3446481 -0.2062346), wk = 0.0035461 k( 17) = ( 0.1818182 -0.3676246 -0.2199836), wk = 0.0035461 k( 18) = ( 0.1931818 -0.3906012 -0.2337326), wk = 0.0035461 k( 19) = ( 0.2045454 -0.4135777 -0.2474816), wk = 0.0035461 k( 20) = ( 0.2159091 -0.4365542 -0.2612305), wk = 0.0035461 k( 21) = ( 0.2272727 -0.4595308 -0.2749795), wk = 0.0035461 k( 22) = ( 0.2386364 -0.4825073 -0.2887285), wk = 0.0035461 k( 23) = ( 0.2500000 -0.5054839 -0.3024775), wk = 0.0035461 k( 24) = ( 0.2613636 -0.5284604 -0.3162264), wk = 0.0035461 k( 25) = ( 0.2727273 -0.5514369 -0.3299754), wk = 0.0035461 k( 26) = ( 0.2840909 -0.5744135 -0.3437244), wk = 0.0035461 k( 27) = ( 0.2954545 -0.5973900 -0.3574734), wk = 0.0035461 k( 28) = ( 0.3068182 -0.6203665 -0.3712223), wk = 0.0035461 k( 29) = ( 0.3181818 -0.6433431 -0.3849713), wk = 0.0035461 k( 30) = ( 0.3295455 -0.6663196 -0.3987203), wk = 0.0035461 k( 31) = ( 0.3409091 -0.6892962 -0.4124693), wk = 0.0035461 k( 32) = ( 0.3522727 -0.7122727 -0.4262183), wk = 0.0035461 k( 33) = ( 0.3636364 -0.7352492 -0.4399672), wk = 0.0035461 k( 34) = ( 0.3750000 -0.7582258 -0.4537162), wk = 0.0035461 k( 35) = ( 0.3863636 -0.7812023 -0.4674652), wk = 0.0035461 k( 36) = ( 0.3977273 -0.8041789 -0.4812141), wk = 0.0035461 k( 37) = ( 0.4090909 -0.8271554 -0.4949631), wk = 0.0035461 k( 38) = ( 0.4204545 -0.8501319 -0.5087121), wk = 0.0035461 k( 39) = ( 0.4318182 -0.8731085 -0.5224611), wk = 0.0035461 k( 40) = ( 0.4431818 -0.8960850 -0.5362101), wk = 0.0035461 k( 41) = ( 0.4545455 -0.9190615 -0.5499590), wk = 0.0035461 k( 42) = ( 0.4659091 -0.9420381 -0.5637080), wk = 0.0035461 k( 43) = ( 0.4772727 -0.9650146 -0.5774570), wk = 0.0035461 k( 44) = ( 0.4886364 -0.9879912 -0.5912060), wk = 0.0035461 k( 45) = ( 0.5000000 -1.0109677 -0.6049549), wk = 0.0035461 k( 46) = ( 0.5000000 -1.0109677 -0.6049549), wk = 0.0035461 k( 47) = ( 0.5000000 -0.9960101 -0.6299512), wk = 0.0035461 k( 48) = ( 0.5000000 -0.9810526 -0.6549475), wk = 0.0035461 k( 49) = ( 0.5000000 -0.9660950 -0.6799437), wk = 0.0035461 k( 50) = ( 0.5000000 -0.9511375 -0.7049400), wk = 0.0035461 k( 51) = ( 0.5000000 -0.9361799 -0.7299362), wk = 0.0035461 k( 52) = ( 0.5000000 -0.9212223 -0.7549325), wk = 0.0035461 k( 53) = ( 0.5000000 -0.9062648 -0.7799288), wk = 0.0035461 k( 54) = ( 0.5000000 -0.8913072 -0.8049250), wk = 0.0035461 k( 55) = ( 0.5000000 -0.8763497 -0.8299213), wk = 0.0035461 k( 56) = ( 0.5000000 -0.8613921 -0.8549175), wk = 0.0035461 k( 57) = ( 0.5000000 -0.8464345 -0.8799138), wk = 0.0035461 k( 58) = ( 0.5000000 -0.8314770 -0.9049101), wk = 0.0035461 k( 59) = ( 0.5000000 -0.8165194 -0.9299063), wk = 0.0035461 k( 60) = ( 0.5000000 -0.8015619 -0.9549026), wk = 0.0035461 k( 61) = ( 0.5000000 -0.7866043 -0.9798988), wk = 0.0035461 k( 62) = ( 0.5000000 -0.7716467 -1.0048951), wk = 0.0035461 k( 63) = ( 0.5000000 -0.7566892 -1.0298914), wk = 0.0035461 k( 64) = ( 0.5000000 -0.7417316 -1.0548876), wk = 0.0035461 k( 65) = ( 0.5000000 -0.7267740 -1.0798839), wk = 0.0035461 k( 66) = ( 0.5000000 -0.7118165 -1.1048801), wk = 0.0035461 k( 67) = ( 0.5000000 -0.6968589 -1.1298764), wk = 0.0035461 k( 68) = ( 0.5000000 -0.6819014 -1.1548727), wk = 0.0035461 k( 69) = ( 0.5000000 -0.6669438 -1.1798689), wk = 0.0035461 k( 70) = ( 0.5000000 -0.6519862 -1.2048652), wk = 0.0035461 k( 71) = ( 0.5000000 -0.6370287 -1.2298614), wk = 0.0035461 k( 72) = ( 0.5000000 -0.6220711 -1.2548577), wk = 0.0035461 k( 73) = ( 0.5000000 -0.6071136 -1.2798540), wk = 0.0035461 k( 74) = ( 0.8209635 -0.5320808 -1.1399658), wk = 0.0035461 k( 75) = ( 0.8142768 -0.5185606 -1.1147593), wk = 0.0035461 k( 76) = ( 0.8075901 -0.5050405 -1.0895529), wk = 0.0035461 k( 77) = ( 0.8009033 -0.4915203 -1.0643464), wk = 0.0035461 k( 78) = ( 0.7942166 -0.4780002 -1.0391400), wk = 0.0035461 k( 79) = ( 0.7875298 -0.4644800 -1.0139335), wk = 0.0035461 k( 80) = ( 0.7808431 -0.4509598 -0.9887270), wk = 0.0035461 k( 81) = ( 0.7741564 -0.4374397 -0.9635206), wk = 0.0035461 k( 82) = ( 0.7674696 -0.4239195 -0.9383141), wk = 0.0035461 k( 83) = ( 0.7607829 -0.4103994 -0.9131077), wk = 0.0035461 k( 84) = ( 0.7540961 -0.3968792 -0.8879012), wk = 0.0035461 k( 85) = ( 0.7474094 -0.3833590 -0.8626947), wk = 0.0035461 k( 86) = ( 0.7407227 -0.3698389 -0.8374883), wk = 0.0035461 k( 87) = ( 0.7340359 -0.3563187 -0.8122818), wk = 0.0035461 k( 88) = ( 0.7273492 -0.3427986 -0.7870754), wk = 0.0035461 k( 89) = ( 0.7206624 -0.3292784 -0.7618689), wk = 0.0035461 k( 90) = ( 0.7139757 -0.3157583 -0.7366625), wk = 0.0035461 k( 91) = ( 0.7072890 -0.3022381 -0.7114560), wk = 0.0035461 k( 92) = ( 0.7006022 -0.2887179 -0.6862496), wk = 0.0035461 k( 93) = ( 0.6939155 -0.2751978 -0.6610431), wk = 0.0035461 k( 94) = ( 0.6872287 -0.2616776 -0.6358367), wk = 0.0035461 k( 95) = ( 0.6805420 -0.2481575 -0.6106302), wk = 0.0035461 k( 96) = ( 0.6738553 -0.2346373 -0.5854237), wk = 0.0035461 k( 97) = ( 0.6671685 -0.2211172 -0.5602173), wk = 0.0035461 k( 98) = ( 0.6604818 -0.2075970 -0.5350108), wk = 0.0035461 k( 99) = ( 0.6537950 -0.1940769 -0.5098044), wk = 0.0035461 k( 100) = ( 0.6471083 -0.1805567 -0.4845979), wk = 0.0035461 k( 101) = ( 0.6404216 -0.1670365 -0.4593915), wk = 0.0035461 k( 102) = ( 0.6337348 -0.1535164 -0.4341850), wk = 0.0035461 k( 103) = ( 0.6270481 -0.1399962 -0.4089786), wk = 0.0035461 k( 104) = ( 0.6203613 -0.1264761 -0.3837721), wk = 0.0035461 k( 105) = ( 0.6136746 -0.1129559 -0.3585657), wk = 0.0035461 k( 106) = ( 0.6069878 -0.0994358 -0.3333592), wk = 0.0035461 k( 107) = ( 0.6003011 -0.0859156 -0.3081528), wk = 0.0035461 k( 108) = ( 0.5936144 -0.0723954 -0.2829463), wk = 0.0035461 k( 109) = ( 0.5869276 -0.0588753 -0.2577398), wk = 0.0035461 k( 110) = ( 0.5802409 -0.0453551 -0.2325334), wk = 0.0035461 k( 111) = ( 0.5735541 -0.0318350 -0.2073269), wk = 0.0035461 k( 112) = ( 0.5668674 -0.0183148 -0.1821204), wk = 0.0035461 k( 113) = ( 0.5601807 -0.0047946 -0.1569140), wk = 0.0035461 k( 114) = ( 0.5534939 0.0087255 -0.1317075), wk = 0.0035461 k( 115) = ( 0.5468072 0.0222457 -0.1065011), wk = 0.0035461 k( 116) = ( 0.5401204 0.0357658 -0.0812946), wk = 0.0035461 k( 117) = ( 0.5334337 0.0492860 -0.0560882), wk = 0.0035461 k( 118) = ( 0.5267470 0.0628061 -0.0308817), wk = 0.0035461 k( 119) = ( 0.5200602 0.0763263 -0.0056753), wk = 0.0035461 k( 120) = ( 0.5133735 0.0898465 0.0195312), wk = 0.0035461 k( 121) = ( 0.5066867 0.1033666 0.0447376), wk = 0.0035461 k( 122) = ( 0.5000000 0.1168868 0.0699441), wk = 0.0035461 k( 123) = ( 0.5000000 0.1168868 0.0699441), wk = 0.0035461 k( 124) = ( 0.4722222 0.1103931 0.0660583), wk = 0.0035461 k( 125) = ( 0.4444444 0.1038993 0.0621725), wk = 0.0035461 k( 126) = ( 0.4166667 0.0974056 0.0582867), wk = 0.0035461 k( 127) = ( 0.3888889 0.0909119 0.0544010), wk = 0.0035461 k( 128) = ( 0.3611111 0.0844182 0.0505152), wk = 0.0035461 k( 129) = ( 0.3333333 0.0779245 0.0466294), wk = 0.0035461 k( 130) = ( 0.3055556 0.0714308 0.0427436), wk = 0.0035461 k( 131) = ( 0.2777778 0.0649371 0.0388578), wk = 0.0035461 k( 132) = ( 0.2500000 0.0584434 0.0349720), wk = 0.0035461 k( 133) = ( 0.2222222 0.0519497 0.0310863), wk = 0.0035461 k( 134) = ( 0.1944444 0.0454560 0.0272005), wk = 0.0035461 k( 135) = ( 0.1666667 0.0389623 0.0233147), wk = 0.0035461 k( 136) = ( 0.1388889 0.0324685 0.0194289), wk = 0.0035461 k( 137) = ( 0.1111111 0.0259748 0.0155431), wk = 0.0035461 k( 138) = ( 0.0833333 0.0194811 0.0116573), wk = 0.0035461 k( 139) = ( 0.0555556 0.0129874 0.0077716), wk = 0.0035461 k( 140) = ( 0.0277778 0.0064937 0.0038858), wk = 0.0035461 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 143) = ( 0.0066572 -0.0134605 -0.0250952), wk = 0.0035461 k( 144) = ( 0.0133144 -0.0269209 -0.0501903), wk = 0.0035461 k( 145) = ( 0.0199717 -0.0403814 -0.0752855), wk = 0.0035461 k( 146) = ( 0.0266289 -0.0538419 -0.1003807), wk = 0.0035461 k( 147) = ( 0.0332861 -0.0673023 -0.1254759), wk = 0.0035461 k( 148) = ( 0.0399433 -0.0807628 -0.1505710), wk = 0.0035461 k( 149) = ( 0.0466005 -0.0942233 -0.1756662), wk = 0.0035461 k( 150) = ( 0.0532578 -0.1076838 -0.2007614), wk = 0.0035461 k( 151) = ( 0.0599150 -0.1211442 -0.2258566), wk = 0.0035461 k( 152) = ( 0.0665722 -0.1346047 -0.2509517), wk = 0.0035461 k( 153) = ( 0.0732294 -0.1480652 -0.2760469), wk = 0.0035461 k( 154) = ( 0.0798866 -0.1615256 -0.3011421), wk = 0.0035461 k( 155) = ( 0.0865439 -0.1749861 -0.3262373), wk = 0.0035461 k( 156) = ( 0.0932011 -0.1884466 -0.3513324), wk = 0.0035461 k( 157) = ( 0.0998583 -0.2019070 -0.3764276), wk = 0.0035461 k( 158) = ( 0.1065155 -0.2153675 -0.4015228), wk = 0.0035461 k( 159) = ( 0.1131727 -0.2288280 -0.4266180), wk = 0.0035461 k( 160) = ( 0.1198300 -0.2422884 -0.4517131), wk = 0.0035461 k( 161) = ( 0.1264872 -0.2557489 -0.4768083), wk = 0.0035461 k( 162) = ( 0.1331444 -0.2692094 -0.5019035), wk = 0.0035461 k( 163) = ( 0.1398016 -0.2826698 -0.5269987), wk = 0.0035461 k( 164) = ( 0.1464588 -0.2961303 -0.5520938), wk = 0.0035461 k( 165) = ( 0.1531161 -0.3095908 -0.5771890), wk = 0.0035461 k( 166) = ( 0.1597733 -0.3230513 -0.6022842), wk = 0.0035461 k( 167) = ( 0.1664305 -0.3365117 -0.6273794), wk = 0.0035461 k( 168) = ( 0.1730877 -0.3499722 -0.6524746), wk = 0.0035461 k( 169) = ( 0.1797449 -0.3634327 -0.6775698), wk = 0.0035461 k( 170) = ( 0.1864022 -0.3768931 -0.7026649), wk = 0.0035461 k( 171) = ( 0.1930594 -0.3903536 -0.7277601), wk = 0.0035461 k( 172) = ( 0.1997166 -0.4038141 -0.7528553), wk = 0.0035461 k( 173) = ( 0.2063738 -0.4172746 -0.7779505), wk = 0.0035461 k( 174) = ( 0.2130310 -0.4307350 -0.8030456), wk = 0.0035461 k( 175) = ( 0.2196883 -0.4441955 -0.8281408), wk = 0.0035461 k( 176) = ( 0.2263455 -0.4576560 -0.8532360), wk = 0.0035461 k( 177) = ( 0.2330027 -0.4711164 -0.8783312), wk = 0.0035461 k( 178) = ( 0.2396599 -0.4845769 -0.9034263), wk = 0.0035461 k( 179) = ( 0.2463172 -0.4980374 -0.9285215), wk = 0.0035461 k( 180) = ( 0.2529744 -0.5114978 -0.9536167), wk = 0.0035461 k( 181) = ( 0.2596316 -0.5249583 -0.9787119), wk = 0.0035461 k( 182) = ( 0.2662888 -0.5384188 -1.0038070), wk = 0.0035461 k( 183) = ( 0.2729460 -0.5518792 -1.0289022), wk = 0.0035461 k( 184) = ( 0.2796033 -0.5653397 -1.0539974), wk = 0.0035461 k( 185) = ( 0.2862605 -0.5788002 -1.0790926), wk = 0.0035461 k( 186) = ( 0.2929177 -0.5922606 -1.1041877), wk = 0.0035461 k( 187) = ( 0.2995749 -0.6057211 -1.1292829), wk = 0.0035461 k( 188) = ( 0.3062321 -0.6191816 -1.1543781), wk = 0.0035461 k( 189) = ( 0.3128894 -0.6326421 -1.1794733), wk = 0.0035461 k( 190) = ( 0.3195466 -0.6461025 -1.2045684), wk = 0.0035461 k( 191) = ( 0.3262038 -0.6595630 -1.2296636), wk = 0.0035461 k( 192) = ( 0.3328610 -0.6730235 -1.2547588), wk = 0.0035461 k( 193) = ( 0.3395182 -0.6864839 -1.2798540), wk = 0.0035461 k( 194) = ( 0.6604818 -0.5695972 -1.2099099), wk = 0.0035461 k( 195) = ( 0.6537950 -0.5409937 -1.2099099), wk = 0.0035461 k( 196) = ( 0.6471083 -0.5123902 -1.2099099), wk = 0.0035461 k( 197) = ( 0.6404216 -0.4837867 -1.2099099), wk = 0.0035461 k( 198) = ( 0.6337348 -0.4551832 -1.2099099), wk = 0.0035461 k( 199) = ( 0.6270481 -0.4265797 -1.2099099), wk = 0.0035461 k( 200) = ( 0.6203613 -0.3979762 -1.2099099), wk = 0.0035461 k( 201) = ( 0.6136746 -0.3693727 -1.2099099), wk = 0.0035461 k( 202) = ( 0.6069878 -0.3407692 -1.2099099), wk = 0.0035461 k( 203) = ( 0.6003011 -0.3121657 -1.2099099), wk = 0.0035461 k( 204) = ( 0.5936144 -0.2835622 -1.2099099), wk = 0.0035461 k( 205) = ( 0.5869276 -0.2549587 -1.2099099), wk = 0.0035461 k( 206) = ( 0.5802409 -0.2263552 -1.2099099), wk = 0.0035461 k( 207) = ( 0.5735541 -0.1977517 -1.2099099), wk = 0.0035461 k( 208) = ( 0.5668674 -0.1691482 -1.2099099), wk = 0.0035461 k( 209) = ( 0.5601807 -0.1405447 -1.2099099), wk = 0.0035461 k( 210) = ( 0.5534939 -0.1119412 -1.2099099), wk = 0.0035461 k( 211) = ( 0.5468072 -0.0833377 -1.2099099), wk = 0.0035461 k( 212) = ( 0.5401204 -0.0547342 -1.2099099), wk = 0.0035461 k( 213) = ( 0.5334337 -0.0261307 -1.2099099), wk = 0.0035461 k( 214) = ( 0.5267470 0.0024728 -1.2099099), wk = 0.0035461 k( 215) = ( 0.5200602 0.0310763 -1.2099099), wk = 0.0035461 k( 216) = ( 0.5133735 0.0596798 -1.2099099), wk = 0.0035461 k( 217) = ( 0.5066867 0.0882833 -1.2099099), wk = 0.0035461 k( 218) = ( 0.5000000 0.1168868 -1.2099099), wk = 0.0035461 k( 219) = ( 0.5000000 0.1168868 -1.2099099), wk = 0.0035461 k( 220) = ( 0.5229260 0.1222462 -1.1999179), wk = 0.0035461 k( 221) = ( 0.5458519 0.1276057 -1.1899258), wk = 0.0035461 k( 222) = ( 0.5687779 0.1329652 -1.1799338), wk = 0.0035461 k( 223) = ( 0.5917039 0.1383247 -1.1699418), wk = 0.0035461 k( 224) = ( 0.6146298 0.1436842 -1.1599498), wk = 0.0035461 k( 225) = ( 0.6375558 0.1490437 -1.1499578), wk = 0.0035461 k( 226) = ( 0.6604818 0.1544032 -1.1399658), wk = 0.0035461 k( 227) = ( 0.6604818 0.1544032 -1.1399658), wk = 0.0035461 k( 228) = ( 0.6566608 0.1535099 -1.1111584), wk = 0.0035461 k( 229) = ( 0.6528398 0.1526167 -1.0823510), wk = 0.0035461 k( 230) = ( 0.6490188 0.1517234 -1.0535436), wk = 0.0035461 k( 231) = ( 0.6451978 0.1508302 -1.0247362), wk = 0.0035461 k( 232) = ( 0.6413768 0.1499369 -0.9959289), wk = 0.0035461 k( 233) = ( 0.6375558 0.1490437 -0.9671215), wk = 0.0035461 k( 234) = ( 0.6337348 0.1481504 -0.9383141), wk = 0.0035461 k( 235) = ( 0.6299138 0.1472572 -0.9095067), wk = 0.0035461 k( 236) = ( 0.6260928 0.1463639 -0.8806994), wk = 0.0035461 k( 237) = ( 0.6222718 0.1454707 -0.8518920), wk = 0.0035461 k( 238) = ( 0.6184508 0.1445774 -0.8230846), wk = 0.0035461 k( 239) = ( 0.6146298 0.1436842 -0.7942772), wk = 0.0035461 k( 240) = ( 0.6108088 0.1427909 -0.7654699), wk = 0.0035461 k( 241) = ( 0.6069878 0.1418977 -0.7366625), wk = 0.0035461 k( 242) = ( 0.6031669 0.1410044 -0.7078551), wk = 0.0035461 k( 243) = ( 0.5993459 0.1401112 -0.6790477), wk = 0.0035461 k( 244) = ( 0.5955249 0.1392179 -0.6502404), wk = 0.0035461 k( 245) = ( 0.5917039 0.1383247 -0.6214330), wk = 0.0035461 k( 246) = ( 0.5878829 0.1374315 -0.5926256), wk = 0.0035461 k( 247) = ( 0.5840619 0.1365382 -0.5638182), wk = 0.0035461 k( 248) = ( 0.5802409 0.1356450 -0.5350108), wk = 0.0035461 k( 249) = ( 0.5764199 0.1347517 -0.5062035), wk = 0.0035461 k( 250) = ( 0.5725989 0.1338585 -0.4773961), wk = 0.0035461 k( 251) = ( 0.5687779 0.1329652 -0.4485887), wk = 0.0035461 k( 252) = ( 0.5649569 0.1320720 -0.4197813), wk = 0.0035461 k( 253) = ( 0.5611359 0.1311787 -0.3909739), wk = 0.0035461 k( 254) = ( 0.5573149 0.1302855 -0.3621666), wk = 0.0035461 k( 255) = ( 0.5534939 0.1293922 -0.3333592), wk = 0.0035461 k( 256) = ( 0.5496729 0.1284990 -0.3045518), wk = 0.0035461 k( 257) = ( 0.5458519 0.1276057 -0.2757444), wk = 0.0035461 k( 258) = ( 0.5420309 0.1267125 -0.2469371), wk = 0.0035461 k( 259) = ( 0.5382100 0.1258192 -0.2181297), wk = 0.0035461 k( 260) = ( 0.5343889 0.1249260 -0.1893223), wk = 0.0035461 k( 261) = ( 0.5305680 0.1240327 -0.1605149), wk = 0.0035461 k( 262) = ( 0.5267470 0.1231395 -0.1317075), wk = 0.0035461 k( 263) = ( 0.5229260 0.1222462 -0.1029002), wk = 0.0035461 k( 264) = ( 0.5191050 0.1213530 -0.0740928), wk = 0.0035461 k( 265) = ( 0.5152840 0.1204598 -0.0452854), wk = 0.0035461 k( 266) = ( 0.5114630 0.1195665 -0.0164780), wk = 0.0035461 k( 267) = ( 0.5076420 0.1186733 0.0123293), wk = 0.0035461 k( 268) = ( 0.5038210 0.1177800 0.0411367), wk = 0.0035461 k( 269) = ( 0.5000000 0.1168868 0.0699441), wk = 0.0035461 k( 270) = ( 0.5000000 -1.0109677 -0.6049549), wk = 0.0035461 k( 271) = ( 0.5267470 -1.0012271 -0.5991263), wk = 0.0035461 k( 272) = ( 0.5534939 -0.9914866 -0.5932976), wk = 0.0035461 k( 273) = ( 0.5802409 -0.9817460 -0.5874689), wk = 0.0035461 k( 274) = ( 0.6069878 -0.9720055 -0.5816402), wk = 0.0035461 k( 275) = ( 0.6337348 -0.9622649 -0.5758116), wk = 0.0035461 k( 276) = ( 0.6604818 -0.9525243 -0.5699829), wk = 0.0035461 k( 277) = ( 0.6872287 -0.9427838 -0.5641542), wk = 0.0035461 k( 278) = ( 0.7139757 -0.9330432 -0.5583255), wk = 0.0035461 k( 279) = ( 0.7407227 -0.9233026 -0.5524969), wk = 0.0035461 k( 280) = ( 0.7674696 -0.9135621 -0.5466682), wk = 0.0035461 k( 281) = ( 0.7942166 -0.9038215 -0.5408395), wk = 0.0035461 k( 282) = ( 0.8209635 -0.8940809 -0.5350108), wk = 0.0035461 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0113636 -0.0000000 0.0000000), wk = 0.0035461 k( 3) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0035461 k( 4) = ( 0.0340909 0.0000000 0.0000000), wk = 0.0035461 k( 5) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0035461 k( 6) = ( 0.0568182 -0.0000000 -0.0000000), wk = 0.0035461 k( 7) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0035461 k( 8) = ( 0.0795455 0.0000000 0.0000000), wk = 0.0035461 k( 9) = ( 0.0909091 -0.0000000 -0.0000000), wk = 0.0035461 k( 10) = ( 0.1022727 -0.0000000 -0.0000000), wk = 0.0035461 k( 11) = ( 0.1136364 -0.0000000 -0.0000000), wk = 0.0035461 k( 12) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0035461 k( 13) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0035461 k( 14) = ( 0.1477273 0.0000000 0.0000000), wk = 0.0035461 k( 15) = ( 0.1590909 0.0000000 0.0000000), wk = 0.0035461 k( 16) = ( 0.1704546 -0.0000000 -0.0000000), wk = 0.0035461 k( 17) = ( 0.1818182 -0.0000000 -0.0000000), wk = 0.0035461 k( 18) = ( 0.1931818 -0.0000000 0.0000000), wk = 0.0035461 k( 19) = ( 0.2045454 0.0000000 -0.0000000), wk = 0.0035461 k( 20) = ( 0.2159091 -0.0000000 -0.0000000), wk = 0.0035461 k( 21) = ( 0.2272727 -0.0000000 -0.0000000), wk = 0.0035461 k( 22) = ( 0.2386364 -0.0000000 0.0000000), wk = 0.0035461 k( 23) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0035461 k( 24) = ( 0.2613636 -0.0000000 -0.0000000), wk = 0.0035461 k( 25) = ( 0.2727273 -0.0000000 0.0000000), wk = 0.0035461 k( 26) = ( 0.2840909 -0.0000000 -0.0000000), wk = 0.0035461 k( 27) = ( 0.2954545 0.0000000 0.0000000), wk = 0.0035461 k( 28) = ( 0.3068182 -0.0000000 -0.0000000), wk = 0.0035461 k( 29) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0035461 k( 30) = ( 0.3295455 -0.0000000 -0.0000000), wk = 0.0035461 k( 31) = ( 0.3409091 -0.0000000 -0.0000000), wk = 0.0035461 k( 32) = ( 0.3522727 0.0000000 0.0000000), wk = 0.0035461 k( 33) = ( 0.3636364 -0.0000000 -0.0000000), wk = 0.0035461 k( 34) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0035461 k( 35) = ( 0.3863636 -0.0000000 0.0000000), wk = 0.0035461 k( 36) = ( 0.3977273 -0.0000000 -0.0000000), wk = 0.0035461 k( 37) = ( 0.4090909 -0.0000000 0.0000000), wk = 0.0035461 k( 38) = ( 0.4204545 0.0000000 0.0000000), wk = 0.0035461 k( 39) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0035461 k( 40) = ( 0.4431818 -0.0000000 -0.0000000), wk = 0.0035461 k( 41) = ( 0.4545455 -0.0000000 -0.0000000), wk = 0.0035461 k( 42) = ( 0.4659091 -0.0000000 -0.0000000), wk = 0.0035461 k( 43) = ( 0.4772727 -0.0000000 -0.0000000), wk = 0.0035461 k( 44) = ( 0.4886364 -0.0000000 -0.0000000), wk = 0.0035461 k( 45) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0035461 k( 46) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0035461 k( 47) = ( 0.5000000 0.0066310 -0.0066310), wk = 0.0035461 k( 48) = ( 0.5000000 0.0132620 -0.0132620), wk = 0.0035461 k( 49) = ( 0.5000000 0.0198929 -0.0198929), wk = 0.0035461 k( 50) = ( 0.5000000 0.0265239 -0.0265239), wk = 0.0035461 k( 51) = ( 0.5000000 0.0331549 -0.0331549), wk = 0.0035461 k( 52) = ( 0.5000000 0.0397859 -0.0397859), wk = 0.0035461 k( 53) = ( 0.5000000 0.0464169 -0.0464169), wk = 0.0035461 k( 54) = ( 0.5000000 0.0530478 -0.0530478), wk = 0.0035461 k( 55) = ( 0.5000000 0.0596788 -0.0596788), wk = 0.0035461 k( 56) = ( 0.5000000 0.0663098 -0.0663098), wk = 0.0035461 k( 57) = ( 0.5000000 0.0729408 -0.0729408), wk = 0.0035461 k( 58) = ( 0.5000000 0.0795718 -0.0795718), wk = 0.0035461 k( 59) = ( 0.5000000 0.0862027 -0.0862027), wk = 0.0035461 k( 60) = ( 0.5000000 0.0928337 -0.0928337), wk = 0.0035461 k( 61) = ( 0.5000000 0.0994647 -0.0994647), wk = 0.0035461 k( 62) = ( 0.5000000 0.1060957 -0.1060957), wk = 0.0035461 k( 63) = ( 0.5000000 0.1127267 -0.1127267), wk = 0.0035461 k( 64) = ( 0.5000000 0.1193576 -0.1193576), wk = 0.0035461 k( 65) = ( 0.5000000 0.1259886 -0.1259886), wk = 0.0035461 k( 66) = ( 0.5000000 0.1326196 -0.1326196), wk = 0.0035461 k( 67) = ( 0.5000000 0.1392506 -0.1392506), wk = 0.0035461 k( 68) = ( 0.5000000 0.1458816 -0.1458816), wk = 0.0035461 k( 69) = ( 0.5000000 0.1525125 -0.1525125), wk = 0.0035461 k( 70) = ( 0.5000000 0.1591435 -0.1591435), wk = 0.0035461 k( 71) = ( 0.5000000 0.1657745 -0.1657745), wk = 0.0035461 k( 72) = ( 0.5000000 0.1724055 -0.1724055), wk = 0.0035461 k( 73) = ( 0.5000000 0.1790365 -0.1790365), wk = 0.0035461 k( 74) = ( 0.8209635 0.5000000 0.1790365), wk = 0.0035461 k( 75) = ( 0.8142768 0.5000000 0.1857232), wk = 0.0035461 k( 76) = ( 0.8075901 0.5000000 0.1924099), wk = 0.0035461 k( 77) = ( 0.8009033 0.5000000 0.1990967), wk = 0.0035461 k( 78) = ( 0.7942166 0.5000000 0.2057834), wk = 0.0035461 k( 79) = ( 0.7875298 0.5000000 0.2124702), wk = 0.0035461 k( 80) = ( 0.7808431 0.5000000 0.2191569), wk = 0.0035461 k( 81) = ( 0.7741564 0.5000000 0.2258436), wk = 0.0035461 k( 82) = ( 0.7674696 0.5000000 0.2325304), wk = 0.0035461 k( 83) = ( 0.7607829 0.5000000 0.2392171), wk = 0.0035461 k( 84) = ( 0.7540961 0.5000000 0.2459039), wk = 0.0035461 k( 85) = ( 0.7474094 0.5000000 0.2525906), wk = 0.0035461 k( 86) = ( 0.7407227 0.5000000 0.2592774), wk = 0.0035461 k( 87) = ( 0.7340359 0.5000000 0.2659641), wk = 0.0035461 k( 88) = ( 0.7273492 0.5000000 0.2726508), wk = 0.0035461 k( 89) = ( 0.7206624 0.5000000 0.2793376), wk = 0.0035461 k( 90) = ( 0.7139757 0.5000000 0.2860243), wk = 0.0035461 k( 91) = ( 0.7072890 0.5000000 0.2927110), wk = 0.0035461 k( 92) = ( 0.7006022 0.5000000 0.2993978), wk = 0.0035461 k( 93) = ( 0.6939155 0.5000000 0.3060845), wk = 0.0035461 k( 94) = ( 0.6872287 0.5000000 0.3127713), wk = 0.0035461 k( 95) = ( 0.6805420 0.5000000 0.3194580), wk = 0.0035461 k( 96) = ( 0.6738553 0.5000000 0.3261447), wk = 0.0035461 k( 97) = ( 0.6671685 0.5000000 0.3328315), wk = 0.0035461 k( 98) = ( 0.6604818 0.5000000 0.3395182), wk = 0.0035461 k( 99) = ( 0.6537950 0.5000000 0.3462050), wk = 0.0035461 k( 100) = ( 0.6471083 0.5000000 0.3528917), wk = 0.0035461 k( 101) = ( 0.6404216 0.5000000 0.3595784), wk = 0.0035461 k( 102) = ( 0.6337348 0.5000000 0.3662652), wk = 0.0035461 k( 103) = ( 0.6270481 0.5000000 0.3729519), wk = 0.0035461 k( 104) = ( 0.6203613 0.5000000 0.3796387), wk = 0.0035461 k( 105) = ( 0.6136746 0.5000000 0.3863254), wk = 0.0035461 k( 106) = ( 0.6069878 0.5000000 0.3930121), wk = 0.0035461 k( 107) = ( 0.6003011 0.5000000 0.3996989), wk = 0.0035461 k( 108) = ( 0.5936144 0.5000000 0.4063856), wk = 0.0035461 k( 109) = ( 0.5869276 0.5000000 0.4130724), wk = 0.0035461 k( 110) = ( 0.5802409 0.5000000 0.4197591), wk = 0.0035461 k( 111) = ( 0.5735541 0.5000000 0.4264459), wk = 0.0035461 k( 112) = ( 0.5668674 0.5000000 0.4331326), wk = 0.0035461 k( 113) = ( 0.5601807 0.5000000 0.4398193), wk = 0.0035461 k( 114) = ( 0.5534939 0.5000000 0.4465061), wk = 0.0035461 k( 115) = ( 0.5468072 0.5000000 0.4531928), wk = 0.0035461 k( 116) = ( 0.5401204 0.5000000 0.4598796), wk = 0.0035461 k( 117) = ( 0.5334337 0.5000000 0.4665663), wk = 0.0035461 k( 118) = ( 0.5267470 0.5000000 0.4732530), wk = 0.0035461 k( 119) = ( 0.5200602 0.5000000 0.4799398), wk = 0.0035461 k( 120) = ( 0.5133735 0.5000000 0.4866265), wk = 0.0035461 k( 121) = ( 0.5066867 0.5000000 0.4933133), wk = 0.0035461 k( 122) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035461 k( 123) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035461 k( 124) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0035461 k( 125) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0035461 k( 126) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0035461 k( 127) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0035461 k( 128) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0035461 k( 129) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035461 k( 130) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0035461 k( 131) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0035461 k( 132) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 k( 133) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0035461 k( 134) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0035461 k( 135) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0035461 k( 136) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0035461 k( 137) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0035461 k( 138) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0035461 k( 139) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0035461 k( 140) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0035461 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 143) = ( 0.0066572 -0.0000000 -0.0066572), wk = 0.0035461 k( 144) = ( 0.0133144 -0.0000000 -0.0133144), wk = 0.0035461 k( 145) = ( 0.0199717 -0.0000000 -0.0199717), wk = 0.0035461 k( 146) = ( 0.0266289 -0.0000000 -0.0266289), wk = 0.0035461 k( 147) = ( 0.0332861 -0.0000000 -0.0332861), wk = 0.0035461 k( 148) = ( 0.0399433 -0.0000000 -0.0399433), wk = 0.0035461 k( 149) = ( 0.0466005 0.0000000 -0.0466005), wk = 0.0035461 k( 150) = ( 0.0532578 -0.0000000 -0.0532578), wk = 0.0035461 k( 151) = ( 0.0599150 -0.0000000 -0.0599150), wk = 0.0035461 k( 152) = ( 0.0665722 -0.0000000 -0.0665722), wk = 0.0035461 k( 153) = ( 0.0732294 -0.0000000 -0.0732294), wk = 0.0035461 k( 154) = ( 0.0798866 -0.0000000 -0.0798866), wk = 0.0035461 k( 155) = ( 0.0865439 0.0000000 -0.0865439), wk = 0.0035461 k( 156) = ( 0.0932011 0.0000000 -0.0932011), wk = 0.0035461 k( 157) = ( 0.0998583 -0.0000000 -0.0998583), wk = 0.0035461 k( 158) = ( 0.1065155 -0.0000000 -0.1065155), wk = 0.0035461 k( 159) = ( 0.1131727 -0.0000000 -0.1131727), wk = 0.0035461 k( 160) = ( 0.1198300 -0.0000000 -0.1198300), wk = 0.0035461 k( 161) = ( 0.1264872 -0.0000000 -0.1264872), wk = 0.0035461 k( 162) = ( 0.1331444 -0.0000000 -0.1331444), wk = 0.0035461 k( 163) = ( 0.1398016 -0.0000000 -0.1398016), wk = 0.0035461 k( 164) = ( 0.1464588 -0.0000000 -0.1464588), wk = 0.0035461 k( 165) = ( 0.1531161 -0.0000000 -0.1531161), wk = 0.0035461 k( 166) = ( 0.1597733 0.0000000 -0.1597733), wk = 0.0035461 k( 167) = ( 0.1664305 0.0000000 -0.1664305), wk = 0.0035461 k( 168) = ( 0.1730877 -0.0000000 -0.1730877), wk = 0.0035461 k( 169) = ( 0.1797449 -0.0000000 -0.1797449), wk = 0.0035461 k( 170) = ( 0.1864022 -0.0000000 -0.1864022), wk = 0.0035461 k( 171) = ( 0.1930594 -0.0000000 -0.1930594), wk = 0.0035461 k( 172) = ( 0.1997166 -0.0000000 -0.1997166), wk = 0.0035461 k( 173) = ( 0.2063738 -0.0000000 -0.2063738), wk = 0.0035461 k( 174) = ( 0.2130310 -0.0000000 -0.2130310), wk = 0.0035461 k( 175) = ( 0.2196883 -0.0000000 -0.2196883), wk = 0.0035461 k( 176) = ( 0.2263455 0.0000000 -0.2263455), wk = 0.0035461 k( 177) = ( 0.2330027 0.0000000 -0.2330027), wk = 0.0035461 k( 178) = ( 0.2396599 0.0000000 -0.2396599), wk = 0.0035461 k( 179) = ( 0.2463172 0.0000000 -0.2463172), wk = 0.0035461 k( 180) = ( 0.2529744 -0.0000000 -0.2529744), wk = 0.0035461 k( 181) = ( 0.2596316 -0.0000000 -0.2596316), wk = 0.0035461 k( 182) = ( 0.2662888 -0.0000000 -0.2662888), wk = 0.0035461 k( 183) = ( 0.2729460 -0.0000000 -0.2729460), wk = 0.0035461 k( 184) = ( 0.2796033 -0.0000000 -0.2796033), wk = 0.0035461 k( 185) = ( 0.2862605 -0.0000000 -0.2862605), wk = 0.0035461 k( 186) = ( 0.2929177 -0.0000000 -0.2929177), wk = 0.0035461 k( 187) = ( 0.2995749 -0.0000000 -0.2995749), wk = 0.0035461 k( 188) = ( 0.3062321 -0.0000000 -0.3062321), wk = 0.0035461 k( 189) = ( 0.3128894 -0.0000000 -0.3128894), wk = 0.0035461 k( 190) = ( 0.3195466 -0.0000000 -0.3195466), wk = 0.0035461 k( 191) = ( 0.3262038 0.0000000 -0.3262038), wk = 0.0035461 k( 192) = ( 0.3328610 0.0000000 -0.3328610), wk = 0.0035461 k( 193) = ( 0.3395182 0.0000000 -0.3395182), wk = 0.0035461 k( 194) = ( 0.6604818 0.3395182 0.0000000), wk = 0.0035461 k( 195) = ( 0.6537950 0.3462050 -0.0000000), wk = 0.0035461 k( 196) = ( 0.6471083 0.3528917 -0.0000000), wk = 0.0035461 k( 197) = ( 0.6404216 0.3595784 0.0000000), wk = 0.0035461 k( 198) = ( 0.6337348 0.3662652 -0.0000000), wk = 0.0035461 k( 199) = ( 0.6270481 0.3729519 -0.0000000), wk = 0.0035461 k( 200) = ( 0.6203613 0.3796387 0.0000000), wk = 0.0035461 k( 201) = ( 0.6136746 0.3863254 0.0000000), wk = 0.0035461 k( 202) = ( 0.6069878 0.3930121 -0.0000000), wk = 0.0035461 k( 203) = ( 0.6003011 0.3996989 -0.0000000), wk = 0.0035461 k( 204) = ( 0.5936144 0.4063856 -0.0000000), wk = 0.0035461 k( 205) = ( 0.5869276 0.4130724 0.0000000), wk = 0.0035461 k( 206) = ( 0.5802409 0.4197591 -0.0000000), wk = 0.0035461 k( 207) = ( 0.5735541 0.4264459 0.0000000), wk = 0.0035461 k( 208) = ( 0.5668674 0.4331326 0.0000000), wk = 0.0035461 k( 209) = ( 0.5601807 0.4398193 -0.0000000), wk = 0.0035461 k( 210) = ( 0.5534939 0.4465061 0.0000000), wk = 0.0035461 k( 211) = ( 0.5468072 0.4531928 0.0000000), wk = 0.0035461 k( 212) = ( 0.5401204 0.4598796 0.0000000), wk = 0.0035461 k( 213) = ( 0.5334337 0.4665663 0.0000000), wk = 0.0035461 k( 214) = ( 0.5267470 0.4732530 -0.0000000), wk = 0.0035461 k( 215) = ( 0.5200602 0.4799398 -0.0000000), wk = 0.0035461 k( 216) = ( 0.5133735 0.4866265 0.0000000), wk = 0.0035461 k( 217) = ( 0.5066867 0.4933133 0.0000000), wk = 0.0035461 k( 218) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035461 k( 219) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0035461 k( 220) = ( 0.5229260 0.5229260 0.0255766), wk = 0.0035461 k( 221) = ( 0.5458519 0.5458519 0.0511533), wk = 0.0035461 k( 222) = ( 0.5687779 0.5687779 0.0767299), wk = 0.0035461 k( 223) = ( 0.5917039 0.5917039 0.1023065), wk = 0.0035461 k( 224) = ( 0.6146298 0.6146298 0.1278832), wk = 0.0035461 k( 225) = ( 0.6375558 0.6375558 0.1534598), wk = 0.0035461 k( 226) = ( 0.6604818 0.6604818 0.1790365), wk = 0.0035461 k( 227) = ( 0.6604818 0.6604818 0.1790365), wk = 0.0035461 k( 228) = ( 0.6566608 0.6566608 0.1866784), wk = 0.0035461 k( 229) = ( 0.6528398 0.6528398 0.1943204), wk = 0.0035461 k( 230) = ( 0.6490188 0.6490188 0.2019624), wk = 0.0035461 k( 231) = ( 0.6451978 0.6451978 0.2096044), wk = 0.0035461 k( 232) = ( 0.6413768 0.6413768 0.2172464), wk = 0.0035461 k( 233) = ( 0.6375558 0.6375558 0.2248884), wk = 0.0035461 k( 234) = ( 0.6337348 0.6337348 0.2325304), wk = 0.0035461 k( 235) = ( 0.6299138 0.6299138 0.2401724), wk = 0.0035461 k( 236) = ( 0.6260928 0.6260928 0.2478144), wk = 0.0035461 k( 237) = ( 0.6222718 0.6222718 0.2554563), wk = 0.0035461 k( 238) = ( 0.6184508 0.6184508 0.2630983), wk = 0.0035461 k( 239) = ( 0.6146298 0.6146298 0.2707403), wk = 0.0035461 k( 240) = ( 0.6108088 0.6108088 0.2783823), wk = 0.0035461 k( 241) = ( 0.6069878 0.6069878 0.2860243), wk = 0.0035461 k( 242) = ( 0.6031669 0.6031669 0.2936663), wk = 0.0035461 k( 243) = ( 0.5993459 0.5993459 0.3013083), wk = 0.0035461 k( 244) = ( 0.5955249 0.5955249 0.3089503), wk = 0.0035461 k( 245) = ( 0.5917039 0.5917039 0.3165923), wk = 0.0035461 k( 246) = ( 0.5878829 0.5878829 0.3242342), wk = 0.0035461 k( 247) = ( 0.5840619 0.5840619 0.3318762), wk = 0.0035461 k( 248) = ( 0.5802409 0.5802409 0.3395182), wk = 0.0035461 k( 249) = ( 0.5764199 0.5764199 0.3471602), wk = 0.0035461 k( 250) = ( 0.5725989 0.5725989 0.3548022), wk = 0.0035461 k( 251) = ( 0.5687779 0.5687779 0.3624442), wk = 0.0035461 k( 252) = ( 0.5649569 0.5649569 0.3700862), wk = 0.0035461 k( 253) = ( 0.5611359 0.5611359 0.3777282), wk = 0.0035461 k( 254) = ( 0.5573149 0.5573149 0.3853702), wk = 0.0035461 k( 255) = ( 0.5534939 0.5534939 0.3930121), wk = 0.0035461 k( 256) = ( 0.5496729 0.5496729 0.4006541), wk = 0.0035461 k( 257) = ( 0.5458519 0.5458519 0.4082961), wk = 0.0035461 k( 258) = ( 0.5420309 0.5420309 0.4159381), wk = 0.0035461 k( 259) = ( 0.5382100 0.5382100 0.4235801), wk = 0.0035461 k( 260) = ( 0.5343889 0.5343889 0.4312221), wk = 0.0035461 k( 261) = ( 0.5305680 0.5305680 0.4388641), wk = 0.0035461 k( 262) = ( 0.5267470 0.5267470 0.4465061), wk = 0.0035461 k( 263) = ( 0.5229260 0.5229260 0.4541481), wk = 0.0035461 k( 264) = ( 0.5191050 0.5191050 0.4617901), wk = 0.0035461 k( 265) = ( 0.5152840 0.5152840 0.4694320), wk = 0.0035461 k( 266) = ( 0.5114630 0.5114630 0.4770740), wk = 0.0035461 k( 267) = ( 0.5076420 0.5076420 0.4847160), wk = 0.0035461 k( 268) = ( 0.5038210 0.5038210 0.4923580), wk = 0.0035461 k( 269) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035461 k( 270) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0035461 k( 271) = ( 0.5267470 0.0282932 0.0282932), wk = 0.0035461 k( 272) = ( 0.5534939 0.0565864 0.0565864), wk = 0.0035461 k( 273) = ( 0.5802409 0.0848796 0.0848796), wk = 0.0035461 k( 274) = ( 0.6069878 0.1131727 0.1131727), wk = 0.0035461 k( 275) = ( 0.6337348 0.1414659 0.1414659), wk = 0.0035461 k( 276) = ( 0.6604818 0.1697591 0.1697591), wk = 0.0035461 k( 277) = ( 0.6872287 0.1980523 0.1980523), wk = 0.0035461 k( 278) = ( 0.7139757 0.2263455 0.2263455), wk = 0.0035461 k( 279) = ( 0.7407227 0.2546387 0.2546387), wk = 0.0035461 k( 280) = ( 0.7674696 0.2829319 0.2829319), wk = 0.0035461 k( 281) = ( 0.7942166 0.3112250 0.3112250), wk = 0.0035461 k( 282) = ( 0.8209635 0.3395182 0.3395182), wk = 0.0035461 Dense grid: 66297 G-vectors FFT dimensions: ( 96, 96, 96) Smooth grid: 41457 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 226, 58) NL pseudopotentials 0.22 Mb ( 113, 130) Each V/rho on FFT grid 0.28 Mb ( 18432) Each G-vector array 0.01 Mb ( 1383) G-vector shells 0.01 Mb ( 1203) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.80 Mb ( 226, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.23 Mb ( 130, 2, 58) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./SrxSnAsx2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 47.2 secs Computing kpt #: 2 total cpu time spent up to now is 51.3 secs Computing kpt #: 3 total cpu time spent up to now is 55.9 secs Computing kpt #: 4 total cpu time spent up to now is 60.8 secs Computing kpt #: 5 total cpu time spent up to now is 64.7 secs Computing kpt #: 6 total cpu time spent up to now is 69.7 secs Computing kpt #: 7 total cpu time spent up to now is 74.8 secs Computing kpt #: 8 total cpu time spent up to now is 79.2 secs Computing kpt #: 9 total cpu time spent up to now is 83.9 secs Computing kpt #: 10 total cpu time spent up to now is 88.6 secs Computing kpt #: 11 total cpu time spent up to now is 93.3 secs Computing kpt #: 12 total cpu time spent up to now is 98.1 secs Computing kpt #: 13 total cpu time spent up to now is 102.7 secs Computing kpt #: 14 total cpu time spent up to now is 107.4 secs Computing kpt #: 15 total cpu time spent up to now is 112.1 secs Computing kpt #: 16 total cpu time spent up to now is 116.8 secs Computing kpt #: 17 total cpu time spent up to now is 121.4 secs Computing kpt #: 18 total cpu time spent up to now is 126.0 secs Computing kpt #: 19 total cpu time spent up to now is 130.6 secs Computing kpt #: 20 total cpu time spent up to now is 135.2 secs Computing kpt #: 21 total cpu time spent up to now is 139.8 secs Computing kpt #: 22 total cpu time spent up to now is 143.6 secs Computing kpt #: 23 total cpu time spent up to now is 147.3 secs Computing kpt #: 24 total cpu time spent up to now is 151.0 secs Computing kpt #: 25 total cpu time spent up to now is 154.7 secs Computing kpt #: 26 total cpu time spent up to now is 158.3 secs Computing kpt #: 27 total cpu time spent up to now is 162.0 secs Computing kpt #: 28 total cpu time spent up to now is 165.6 secs Computing kpt #: 29 total cpu time spent up to now is 169.2 secs Computing kpt #: 30 total cpu time spent up to now is 172.8 secs Computing kpt #: 31 total cpu time spent up to now is 176.4 secs Computing kpt #: 32 total cpu time spent up to now is 179.6 secs Computing kpt #: 33 total cpu time spent up to now is 183.2 secs Computing kpt #: 34 total cpu time spent up to now is 186.4 secs Computing kpt #: 35 total cpu time spent up to now is 189.6 secs Computing kpt #: 36 total cpu time spent up to now is 192.8 secs Computing kpt #: 37 total cpu time spent up to now is 196.0 secs Computing kpt #: 38 total cpu time spent up to now is 199.2 secs Computing kpt #: 39 total cpu time spent up to now is 202.3 secs Computing kpt #: 40 total cpu time spent up to now is 205.6 secs Computing kpt #: 41 total cpu time spent up to now is 208.9 secs Computing kpt #: 42 total cpu time spent up to now is 212.7 secs Computing kpt #: 43 total cpu time spent up to now is 216.8 secs Computing kpt #: 44 total cpu time spent up to now is 220.9 secs Computing kpt #: 45 total cpu time spent up to now is 224.0 secs Computing kpt #: 46 total cpu time spent up to now is 227.1 secs Computing kpt #: 47 total cpu time spent up to now is 230.1 secs Computing kpt #: 48 total cpu time spent up to now is 233.2 secs Computing kpt #: 49 total cpu time spent up to now is 236.3 secs Computing kpt #: 50 total cpu time spent up to now is 239.5 secs Computing kpt #: 51 total cpu time spent up to now is 242.6 secs Computing kpt #: 52 total cpu time spent up to now is 245.8 secs Computing kpt #: 53 total cpu time spent up to now is 248.9 secs Computing kpt #: 54 total cpu time spent up to now is 252.1 secs Computing kpt #: 55 total cpu time spent up to now is 255.3 secs Computing kpt #: 56 total cpu time spent up to now is 258.5 secs Computing kpt #: 57 total cpu time spent up to now is 261.7 secs Computing kpt #: 58 total cpu time spent up to now is 265.3 secs Computing kpt #: 59 total cpu time spent up to now is 269.1 secs Computing kpt #: 60 total cpu time spent up to now is 272.9 secs Computing kpt #: 61 total cpu time spent up to now is 276.6 secs Computing kpt #: 62 total cpu time spent up to now is 280.3 secs Computing kpt #: 63 total cpu time spent up to now is 284.0 secs Computing kpt #: 64 total cpu time spent up to now is 287.8 secs Computing kpt #: 65 total cpu time spent up to now is 291.5 secs Computing kpt #: 66 total cpu time spent up to now is 295.4 secs Computing kpt #: 67 total cpu time spent up to now is 300.0 secs Computing kpt #: 68 total cpu time spent up to now is 304.5 secs Computing kpt #: 69 total cpu time spent up to now is 308.5 secs Computing kpt #: 70 total cpu time spent up to now is 312.4 secs Computing kpt #: 71 total cpu time spent up to now is 316.1 secs Computing kpt #: 72 total cpu time spent up to now is 319.7 secs Computing kpt #: 73 total cpu time spent up to now is 323.2 secs Computing kpt #: 74 total cpu time spent up to now is 326.8 secs Computing kpt #: 75 total cpu time spent up to now is 330.4 secs Computing kpt #: 76 total cpu time spent up to now is 333.9 secs Computing kpt #: 77 total cpu time spent up to now is 337.5 secs Computing kpt #: 78 total cpu time spent up to now is 341.1 secs Computing kpt #: 79 total cpu time spent up to now is 344.6 secs Computing kpt #: 80 total cpu time spent up to now is 348.2 secs Computing kpt #: 81 total cpu time spent up to now is 351.8 secs Computing kpt #: 82 total cpu time spent up to now is 355.5 secs Computing kpt #: 83 total cpu time spent up to now is 359.1 secs Computing kpt #: 84 total cpu time spent up to now is 362.8 secs Computing kpt #: 85 total cpu time spent up to now is 366.4 secs Computing kpt #: 86 total cpu time spent up to now is 370.0 secs Computing kpt #: 87 total cpu time spent up to now is 373.7 secs Computing kpt #: 88 total cpu time spent up to now is 377.3 secs Computing kpt #: 89 total cpu time spent up to now is 381.0 secs Computing kpt #: 90 total cpu time spent up to now is 384.6 secs Computing kpt #: 91 total cpu time spent up to now is 388.3 secs Computing kpt #: 92 total cpu time spent up to now is 392.1 secs Computing kpt #: 93 total cpu time spent up to now is 395.8 secs Computing kpt #: 94 total cpu time spent up to now is 399.8 secs Computing kpt #: 95 total cpu time spent up to now is 403.6 secs Computing kpt #: 96 total cpu time spent up to now is 407.6 secs Computing kpt #: 97 total cpu time spent up to now is 411.5 secs Computing kpt #: 98 total cpu time spent up to now is 415.3 secs Computing kpt #: 99 total cpu time spent up to now is 419.1 secs Computing kpt #: 100 total cpu time spent up to now is 422.9 secs Computing kpt #: 101 total cpu time spent up to now is 426.7 secs Computing kpt #: 102 total cpu time spent up to now is 430.6 secs Computing kpt #: 103 total cpu time spent up to now is 434.6 secs Computing kpt #: 104 total cpu time spent up to now is 438.4 secs Computing kpt #: 105 total cpu time spent up to now is 442.2 secs Computing kpt #: 106 total cpu time spent up to now is 446.1 secs Computing kpt #: 107 total cpu time spent up to now is 450.7 secs Computing kpt #: 108 total cpu time spent up to now is 455.5 secs Computing kpt #: 109 total cpu time spent up to now is 460.1 secs Computing kpt #: 110 total cpu time spent up to now is 464.9 secs Computing kpt #: 111 total cpu time spent up to now is 469.7 secs Computing kpt #: 112 total cpu time spent up to now is 474.5 secs Computing kpt #: 113 total cpu time spent up to now is 479.4 secs Computing kpt #: 114 total cpu time spent up to now is 484.1 secs Computing kpt #: 115 total cpu time spent up to now is 488.7 secs Computing kpt #: 116 total cpu time spent up to now is 493.2 secs Computing kpt #: 117 total cpu time spent up to now is 497.3 secs Computing kpt #: 118 total cpu time spent up to now is 501.0 secs Computing kpt #: 119 total cpu time spent up to now is 504.6 secs Computing kpt #: 120 total cpu time spent up to now is 508.3 secs Computing kpt #: 121 total cpu time spent up to now is 512.8 secs Computing kpt #: 122 total cpu time spent up to now is 518.5 secs Computing kpt #: 123 total cpu time spent up to now is 522.2 secs Computing kpt #: 124 total cpu time spent up to now is 525.8 secs Computing kpt #: 125 total cpu time spent up to now is 529.6 secs Computing kpt #: 126 total cpu time spent up to now is 533.5 secs Computing kpt #: 127 total cpu time spent up to now is 537.2 secs Computing kpt #: 128 total cpu time spent up to now is 541.0 secs Computing kpt #: 129 total cpu time spent up to now is 544.5 secs Computing kpt #: 130 total cpu time spent up to now is 548.2 secs Computing kpt #: 131 total cpu time spent up to now is 552.0 secs Computing kpt #: 132 total cpu time spent up to now is 555.8 secs Computing kpt #: 133 total cpu time spent up to now is 559.8 secs Computing kpt #: 134 total cpu time spent up to now is 563.9 secs Computing kpt #: 135 total cpu time spent up to now is 567.8 secs Computing kpt #: 136 total cpu time spent up to now is 571.4 secs Computing kpt #: 137 total cpu time spent up to now is 575.4 secs Computing kpt #: 138 total cpu time spent up to now is 579.1 secs Computing kpt #: 139 total cpu time spent up to now is 583.9 secs Computing kpt #: 140 total cpu time spent up to now is 588.1 secs Computing kpt #: 141 total cpu time spent up to now is 592.0 secs Computing kpt #: 142 total cpu time spent up to now is 595.9 secs Computing kpt #: 143 total cpu time spent up to now is 599.9 secs Computing kpt #: 144 total cpu time spent up to now is 604.7 secs Computing kpt #: 145 total cpu time spent up to now is 609.6 secs Computing kpt #: 146 total cpu time spent up to now is 614.5 secs Computing kpt #: 147 total cpu time spent up to now is 619.5 secs Computing kpt #: 148 total cpu time spent up to now is 624.1 secs Computing kpt #: 149 total cpu time spent up to now is 628.7 secs Computing kpt #: 150 total cpu time spent up to now is 633.5 secs Computing kpt #: 151 total cpu time spent up to now is 637.6 secs Computing kpt #: 152 total cpu time spent up to now is 641.7 secs Computing kpt #: 153 total cpu time spent up to now is 646.0 secs Computing kpt #: 154 total cpu time spent up to now is 650.2 secs Computing kpt #: 155 total cpu time spent up to now is 654.0 secs Computing kpt #: 156 total cpu time spent up to now is 657.8 secs Computing kpt #: 157 total cpu time spent up to now is 661.6 secs Computing kpt #: 158 total cpu time spent up to now is 665.4 secs Computing kpt #: 159 total cpu time spent up to now is 669.1 secs Computing kpt #: 160 total cpu time spent up to now is 672.8 secs Computing kpt #: 161 total cpu time spent up to now is 676.4 secs Computing kpt #: 162 total cpu time spent up to now is 680.1 secs Computing kpt #: 163 total cpu time spent up to now is 683.8 secs Computing kpt #: 164 total cpu time spent up to now is 687.5 secs Computing kpt #: 165 total cpu time spent up to now is 691.2 secs Computing kpt #: 166 total cpu time spent up to now is 694.8 secs Computing kpt #: 167 total cpu time spent up to now is 698.7 secs Computing kpt #: 168 total cpu time spent up to now is 702.3 secs Computing kpt #: 169 total cpu time spent up to now is 705.9 secs Computing kpt #: 170 total cpu time spent up to now is 709.5 secs Computing kpt #: 171 total cpu time spent up to now is 713.2 secs Computing kpt #: 172 total cpu time spent up to now is 716.7 secs Computing kpt #: 173 total cpu time spent up to now is 720.3 secs Computing kpt #: 174 total cpu time spent up to now is 723.9 secs Computing kpt #: 175 total cpu time spent up to now is 727.5 secs Computing kpt #: 176 total cpu time spent up to now is 731.1 secs Computing kpt #: 177 total cpu time spent up to now is 734.7 secs Computing kpt #: 178 total cpu time spent up to now is 738.2 secs Computing kpt #: 179 total cpu time spent up to now is 741.8 secs Computing kpt #: 180 total cpu time spent up to now is 745.5 secs Computing kpt #: 181 total cpu time spent up to now is 749.2 secs Computing kpt #: 182 total cpu time spent up to now is 752.9 secs Computing kpt #: 183 total cpu time spent up to now is 756.6 secs Computing kpt #: 184 total cpu time spent up to now is 760.4 secs Computing kpt #: 185 total cpu time spent up to now is 764.2 secs Computing kpt #: 186 total cpu time spent up to now is 768.1 secs Computing kpt #: 187 total cpu time spent up to now is 772.0 secs Computing kpt #: 188 total cpu time spent up to now is 775.8 secs Computing kpt #: 189 total cpu time spent up to now is 779.7 secs Computing kpt #: 190 total cpu time spent up to now is 783.5 secs Computing kpt #: 191 total cpu time spent up to now is 787.2 secs Computing kpt #: 192 total cpu time spent up to now is 790.9 secs Computing kpt #: 193 total cpu time spent up to now is 794.5 secs Computing kpt #: 194 total cpu time spent up to now is 798.1 secs Computing kpt #: 195 total cpu time spent up to now is 801.7 secs Computing kpt #: 196 total cpu time spent up to now is 805.3 secs Computing kpt #: 197 total cpu time spent up to now is 808.9 secs Computing kpt #: 198 total cpu time spent up to now is 813.1 secs Computing kpt #: 199 total cpu time spent up to now is 818.7 secs Computing kpt #: 200 total cpu time spent up to now is 822.5 secs Computing kpt #: 201 total cpu time spent up to now is 826.1 secs Computing kpt #: 202 total cpu time spent up to now is 829.7 secs Computing kpt #: 203 total cpu time spent up to now is 833.3 secs Computing kpt #: 204 total cpu time spent up to now is 836.9 secs Computing kpt #: 205 total cpu time spent up to now is 840.5 secs Computing kpt #: 206 total cpu time spent up to now is 844.1 secs Computing kpt #: 207 total cpu time spent up to now is 847.7 secs Computing kpt #: 208 total cpu time spent up to now is 851.3 secs Computing kpt #: 209 total cpu time spent up to now is 854.8 secs Computing kpt #: 210 total cpu time spent up to now is 858.1 secs Computing kpt #: 211 total cpu time spent up to now is 861.3 secs Computing kpt #: 212 total cpu time spent up to now is 864.9 secs Computing kpt #: 213 total cpu time spent up to now is 868.5 secs Computing kpt #: 214 total cpu time spent up to now is 872.2 secs Computing kpt #: 215 total cpu time spent up to now is 875.9 secs Computing kpt #: 216 total cpu time spent up to now is 879.5 secs Computing kpt #: 217 total cpu time spent up to now is 883.1 secs Computing kpt #: 218 total cpu time spent up to now is 886.6 secs Computing kpt #: 219 total cpu time spent up to now is 890.3 secs Computing kpt #: 220 total cpu time spent up to now is 894.7 secs Computing kpt #: 221 total cpu time spent up to now is 898.3 secs Computing kpt #: 222 total cpu time spent up to now is 901.9 secs Computing kpt #: 223 total cpu time spent up to now is 905.5 secs Computing kpt #: 224 total cpu time spent up to now is 909.3 secs Computing kpt #: 225 total cpu time spent up to now is 913.7 secs Computing kpt #: 226 total cpu time spent up to now is 917.3 secs Computing kpt #: 227 total cpu time spent up to now is 920.9 secs Computing kpt #: 228 total cpu time spent up to now is 924.5 secs Computing kpt #: 229 total cpu time spent up to now is 928.1 secs Computing kpt #: 230 total cpu time spent up to now is 931.6 secs Computing kpt #: 231 total cpu time spent up to now is 935.2 secs Computing kpt #: 232 total cpu time spent up to now is 938.8 secs Computing kpt #: 233 total cpu time spent up to now is 942.4 secs Computing kpt #: 234 total cpu time spent up to now is 946.1 secs Computing kpt #: 235 total cpu time spent up to now is 949.7 secs Computing kpt #: 236 total cpu time spent up to now is 953.3 secs Computing kpt #: 237 total cpu time spent up to now is 956.9 secs Computing kpt #: 238 total cpu time spent up to now is 960.6 secs Computing kpt #: 239 total cpu time spent up to now is 964.2 secs Computing kpt #: 240 total cpu time spent up to now is 968.0 secs Computing kpt #: 241 total cpu time spent up to now is 971.6 secs Computing kpt #: 242 total cpu time spent up to now is 975.3 secs Computing kpt #: 243 total cpu time spent up to now is 979.0 secs Computing kpt #: 244 total cpu time spent up to now is 982.7 secs Computing kpt #: 245 total cpu time spent up to now is 986.4 secs Computing kpt #: 246 total cpu time spent up to now is 990.1 secs Computing kpt #: 247 total cpu time spent up to now is 993.8 secs Computing kpt #: 248 total cpu time spent up to now is 997.7 secs Computing kpt #: 249 total cpu time spent up to now is 1001.5 secs Computing kpt #: 250 total cpu time spent up to now is 1005.2 secs Computing kpt #: 251 total cpu time spent up to now is 1008.9 secs Computing kpt #: 252 total cpu time spent up to now is 1012.6 secs Computing kpt #: 253 total cpu time spent up to now is 1016.4 secs Computing kpt #: 254 total cpu time spent up to now is 1020.3 secs Computing kpt #: 255 total cpu time spent up to now is 1024.3 secs Computing kpt #: 256 total cpu time spent up to now is 1029.0 secs Computing kpt #: 257 total cpu time spent up to now is 1033.6 secs Computing kpt #: 258 total cpu time spent up to now is 1038.5 secs Computing kpt #: 259 total cpu time spent up to now is 1043.4 secs Computing kpt #: 260 total cpu time spent up to now is 1048.0 secs Computing kpt #: 261 total cpu time spent up to now is 1052.7 secs Computing kpt #: 262 total cpu time spent up to now is 1056.8 secs Computing kpt #: 263 total cpu time spent up to now is 1061.1 secs Computing kpt #: 264 total cpu time spent up to now is 1065.1 secs Computing kpt #: 265 total cpu time spent up to now is 1068.8 secs Computing kpt #: 266 total cpu time spent up to now is 1072.4 secs Computing kpt #: 267 total cpu time spent up to now is 1076.0 secs Computing kpt #: 268 total cpu time spent up to now is 1079.7 secs Computing kpt #: 269 total cpu time spent up to now is 1083.2 secs Computing kpt #: 270 total cpu time spent up to now is 1086.4 secs Computing kpt #: 271 total cpu time spent up to now is 1089.4 secs Computing kpt #: 272 total cpu time spent up to now is 1092.5 secs Computing kpt #: 273 total cpu time spent up to now is 1095.7 secs Computing kpt #: 274 total cpu time spent up to now is 1098.9 secs Computing kpt #: 275 total cpu time spent up to now is 1102.1 secs Computing kpt #: 276 total cpu time spent up to now is 1105.3 secs Computing kpt #: 277 total cpu time spent up to now is 1108.5 secs Computing kpt #: 278 total cpu time spent up to now is 1112.1 secs Computing kpt #: 279 total cpu time spent up to now is 1116.0 secs Computing kpt #: 280 total cpu time spent up to now is 1119.7 secs Computing kpt #: 281 total cpu time spent up to now is 1123.3 secs Computing kpt #: 282 total cpu time spent up to now is 1126.9 secs ethr = 2.08E-11, avg # of iterations = 27.7 total cpu time spent up to now is 1127.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5167 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4117 -3.4117 -2.7493 -2.7493 1.1425 1.1425 4.3963 4.3963 6.4888 6.4888 7.1158 7.1158 7.3199 7.3199 7.4871 7.4871 7.7377 7.7377 9.0664 9.0664 9.2299 9.2299 9.9695 9.9695 10.2494 10.2494 11.6341 11.6341 11.7124 11.7124 k = 0.0114-0.0230-0.0137 ( 5159 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3894 -13.3894 -13.3886 -13.3886 -13.3631 -13.3631 -12.3843 -12.3842 -12.3776 -12.3776 -12.3752 -12.3751 -12.3293 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6016 -8.5254 -8.5254 -8.3870 -8.3870 -3.4105 -3.4104 -2.7486 -2.7485 1.1433 1.1433 4.3930 4.3930 6.4878 6.4885 7.1126 7.1151 7.3177 7.3177 7.4773 7.4791 7.7263 7.7263 9.0727 9.0874 9.2199 9.2380 9.9736 9.9769 10.2529 10.2529 11.6276 11.6293 11.7094 11.7136 k = 0.0227-0.0460-0.0275 ( 5167 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3897 -13.3897 -13.3882 -13.3882 -13.3631 -13.3631 -12.3843 -12.3841 -12.3776 -12.3776 -12.3751 -12.3749 -12.3293 -12.3292 -12.3167 -12.3166 -12.3124 -12.3124 -9.6019 -9.6018 -8.5255 -8.5254 -8.3877 -8.3877 -3.4066 -3.4065 -2.7462 -2.7460 1.1459 1.1459 4.3830 4.3831 6.4853 6.4866 7.1051 7.1107 7.3110 7.3113 7.4495 7.4534 7.6952 7.6954 9.0965 9.1339 9.2071 9.2511 9.9892 9.9957 10.2635 10.2636 11.6100 11.6120 11.7057 11.7121 k = 0.0341-0.0689-0.0412 ( 5168 PWs) bands (ev): -26.7824 -26.7824 -13.4041 -13.4041 -13.3901 -13.3901 -13.3879 -13.3879 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3750 -12.3747 -12.3294 -12.3293 -12.3169 -12.3167 -12.3123 -12.3123 -9.6022 -9.6021 -8.5256 -8.5255 -8.3887 -8.3887 -3.4002 -3.4001 -2.7422 -2.7420 1.1501 1.1502 4.3664 4.3665 6.4804 6.4825 7.0927 7.1022 7.2994 7.3010 7.4045 7.4105 7.6517 7.6521 9.1153 9.1679 9.2229 9.2849 10.0159 10.0255 10.2814 10.2819 11.5809 11.5817 11.7012 11.7075 k = 0.0455-0.0919-0.0550 ( 5167 PWs) bands (ev): -26.7823 -26.7823 -13.4040 -13.4040 -13.3904 -13.3904 -13.3875 -13.3875 -13.3632 -13.3631 -12.3844 -12.3840 -12.3777 -12.3777 -12.3747 -12.3744 -12.3295 -12.3293 -12.3171 -12.3169 -12.3122 -12.3122 -9.6026 -9.6025 -8.5257 -8.5255 -8.3902 -8.3902 -3.3913 -3.3911 -2.7366 -2.7363 1.1560 1.1561 4.3433 4.3435 6.4717 6.4747 7.0742 7.0893 7.2806 7.2864 7.3479 7.3545 7.6027 7.6033 9.1115 9.1450 9.3037 9.3490 10.0533 10.0656 10.3072 10.3083 11.5387 11.5395 11.6954 11.7001 k = 0.0568-0.1149-0.0687 ( 5163 PWs) bands (ev): -26.7821 -26.7821 -13.4040 -13.4040 -13.3907 -13.3907 -13.3871 -13.3871 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3744 -12.3740 -12.3296 -12.3294 -12.3173 -12.3171 -12.3121 -12.3121 -9.6032 -9.6030 -8.5259 -8.5257 -8.3920 -8.3920 -3.3798 -3.3796 -2.7294 -2.7291 1.1635 1.1636 4.3139 4.3141 6.4572 6.4613 7.0476 7.0707 7.2422 7.2628 7.2980 7.2994 7.5518 7.5525 9.0879 9.1087 9.3987 9.4330 10.1006 10.1151 10.3411 10.3431 11.4838 11.4859 11.6875 11.6899 k = 0.0682-0.1379-0.0825 ( 5159 PWs) bands (ev): -26.7819 -26.7819 -13.4039 -13.4039 -13.3910 -13.3910 -13.3867 -13.3867 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3741 -12.3736 -12.3298 -12.3295 -12.3176 -12.3173 -12.3120 -12.3119 -9.6039 -9.6037 -8.5261 -8.5258 -8.3943 -8.3943 -3.3658 -3.3656 -2.7206 -2.7203 1.1726 1.1727 4.2782 4.2785 6.4337 6.4388 7.0111 7.0437 7.1824 7.2157 7.2661 7.2719 7.4999 7.5006 9.0505 9.0638 9.4973 9.5250 10.1569 10.1730 10.3832 10.3863 11.4189 11.4217 11.6768 11.6768 k = 0.0795-0.1608-0.0962 ( 5168 PWs) bands (ev): -26.7817 -26.7817 -13.4038 -13.4038 -13.3913 -13.3913 -13.3863 -13.3863 -13.3633 -13.3632 -12.3846 -12.3840 -12.3779 -12.3778 -12.3737 -12.3732 -12.3299 -12.3296 -12.3179 -12.3176 -12.3118 -12.3118 -9.6047 -9.6044 -8.5264 -8.5260 -8.3969 -8.3968 -3.3493 -3.3490 -2.7103 -2.7099 1.1831 1.1831 4.2365 4.2369 6.3973 6.4033 6.9658 7.0049 7.1280 7.1659 7.2460 7.2509 7.4469 7.4477 9.0025 9.0111 9.5941 9.6171 10.2210 10.2378 10.4333 10.4374 11.3459 11.3491 11.6607 11.6628 k = 0.0909-0.1838-0.1100 ( 5160 PWs) bands (ev): -26.7814 -26.7814 -13.4037 -13.4037 -13.3916 -13.3916 -13.3859 -13.3859 -13.3634 -13.3633 -12.3846 -12.3839 -12.3779 -12.3779 -12.3732 -12.3727 -12.3301 -12.3297 -12.3182 -12.3179 -12.3117 -12.3116 -9.6056 -9.6053 -8.5267 -8.5263 -8.3998 -8.3997 -3.3303 -3.3300 -2.6985 -2.6980 1.1949 1.1950 4.1890 4.1894 6.3444 6.3508 6.9176 6.9572 7.0890 7.1255 7.2274 7.2307 7.3931 7.3941 8.9455 8.9510 9.6854 9.7046 10.2911 10.3077 10.4906 10.4956 11.2672 11.2705 11.6420 11.6457 k = 0.1023-0.2068-0.1237 ( 5160 PWs) bands (ev): -26.7812 -26.7812 -13.4036 -13.4036 -13.3919 -13.3918 -13.3855 -13.3855 -13.3634 -13.3634 -12.3846 -12.3839 -12.3780 -12.3779 -12.3728 -12.3722 -12.3303 -12.3299 -12.3186 -12.3182 -12.3115 -12.3114 -9.6066 -9.6063 -8.5270 -8.5266 -8.4030 -8.4030 -3.3088 -3.3085 -2.6851 -2.6845 1.2079 1.2080 4.1359 4.1364 6.2732 6.2794 6.8737 6.9101 7.0614 7.0930 7.2090 7.2100 7.3394 7.3410 8.8808 8.8842 9.7686 9.7843 10.3643 10.3796 10.5541 10.5596 11.1851 11.1884 11.6220 11.6268 k = 0.1136-0.2298-0.1375 ( 5163 PWs) bands (ev): -26.7809 -26.7809 -13.4034 -13.4034 -13.3921 -13.3921 -13.3851 -13.3851 -13.3635 -13.3634 -12.3846 -12.3838 -12.3780 -12.3779 -12.3723 -12.3716 -12.3305 -12.3301 -12.3189 -12.3186 -12.3114 -12.3112 -9.6078 -9.6075 -8.5275 -8.5270 -8.4065 -8.4064 -3.2850 -3.2846 -2.6702 -2.6696 1.2219 1.2221 4.0775 4.0781 6.1848 6.1905 6.8371 6.8691 7.0405 7.0658 7.1865 7.1895 7.2880 7.2911 8.8094 8.8112 9.8418 9.8544 10.4366 10.4497 10.6219 10.6274 11.1020 11.1053 11.6033 11.6086 k = 0.1250-0.2527-0.1512 ( 5161 PWs) bands (ev): -26.7805 -26.7805 -13.4033 -13.4033 -13.3924 -13.3923 -13.3847 -13.3847 -13.3636 -13.3635 -12.3846 -12.3838 -12.3780 -12.3779 -12.3717 -12.3711 -12.3307 -12.3303 -12.3193 -12.3189 -12.3112 -12.3110 -9.6090 -9.6087 -8.5280 -8.5274 -8.4102 -8.4101 -3.2587 -3.2584 -2.6539 -2.6532 1.2369 1.2370 4.0142 4.0149 6.0831 6.0879 6.8064 6.8336 7.0240 7.0418 7.1564 7.1657 7.2441 7.2498 8.7320 8.7329 9.9042 9.9140 10.5029 10.5131 10.6918 10.6967 11.0204 11.0236 11.5888 11.5944 k = 0.1364-0.2757-0.1650 ( 5166 PWs) bands (ev): -26.7802 -26.7802 -13.4031 -13.4031 -13.3926 -13.3926 -13.3843 -13.3843 -13.3637 -13.3636 -12.3846 -12.3837 -12.3780 -12.3779 -12.3711 -12.3705 -12.3310 -12.3305 -12.3197 -12.3193 -12.3110 -12.3108 -9.6104 -9.6100 -8.5286 -8.5280 -8.4140 -8.4140 -3.2302 -3.2298 -2.6361 -2.6354 1.2525 1.2527 3.9462 3.9470 5.9721 5.9761 6.7784 6.8009 7.0100 7.0183 7.1167 7.1331 7.2152 7.2225 8.6496 8.6498 9.9551 9.9626 10.5568 10.5639 10.7610 10.7648 10.9433 10.9464 11.5809 11.5866 k = 0.1477-0.2987-0.1787 ( 5168 PWs) bands (ev): -26.7798 -26.7798 -13.4030 -13.4030 -13.3929 -13.3928 -13.3839 -13.3839 -13.3638 -13.3637 -12.3845 -12.3836 -12.3780 -12.3779 -12.3706 -12.3699 -12.3313 -12.3308 -12.3201 -12.3197 -12.3108 -12.3106 -9.6119 -9.6115 -8.5292 -8.5286 -8.4181 -8.4180 -3.1993 -3.1989 -2.6169 -2.6162 1.2686 1.2688 3.8740 3.8749 5.8556 5.8590 6.7508 6.7689 6.9908 6.9936 7.0730 7.0957 7.2021 7.2083 8.5624 8.5628 9.9941 9.9996 10.5916 10.5958 10.8267 10.8291 10.8748 10.8776 11.5807 11.5865 k = 0.1591-0.3217-0.1925 ( 5168 PWs) bands (ev): -26.7794 -26.7794 -13.4028 -13.4028 -13.3931 -13.3930 -13.3835 -13.3835 -13.3639 -13.3638 -12.3844 -12.3835 -12.3780 -12.3779 -12.3700 -12.3692 -12.3317 -12.3311 -12.3205 -12.3201 -12.3106 -12.3104 -9.6135 -9.6130 -8.5301 -8.5294 -8.4222 -8.4221 -3.1662 -3.1658 -2.5965 -2.5957 1.2850 1.2851 3.7979 3.7988 5.7365 5.7394 6.7220 6.7361 6.9542 6.9650 7.0378 7.0631 7.2002 7.2045 8.4714 8.4721 10.0205 10.0246 10.6013 10.6035 10.8173 10.8201 10.8877 10.8894 11.5873 11.5930 k = 0.1705-0.3446-0.2062 ( 5168 PWs) bands (ev): -26.7790 -26.7790 -13.4027 -13.4026 -13.3933 -13.3932 -13.3831 -13.3831 -13.3640 -13.3639 -12.3843 -12.3834 -12.3780 -12.3779 -12.3693 -12.3686 -12.3320 -12.3315 -12.3208 -12.3204 -12.3105 -12.3102 -9.6151 -9.6147 -8.5310 -8.5303 -8.4264 -8.4262 -3.1309 -3.1304 -2.5747 -2.5738 1.3012 1.3014 3.7183 3.7193 5.6170 5.6195 6.6915 6.7023 6.9079 6.9198 7.0163 7.0378 7.2071 7.2095 8.3774 8.3782 10.0338 10.0367 10.5861 10.5873 10.7751 10.7772 10.9390 10.9400 11.5992 11.6047 k = 0.1818-0.3676-0.2200 ( 5166 PWs) bands (ev): -26.7786 -26.7786 -13.4025 -13.4024 -13.3935 -13.3934 -13.3827 -13.3827 -13.3641 -13.3640 -12.3842 -12.3833 -12.3779 -12.3778 -12.3687 -12.3680 -12.3324 -12.3319 -12.3212 -12.3208 -12.3103 -12.3100 -9.6169 -9.6164 -8.5321 -8.5313 -8.4305 -8.4304 -3.0935 -3.0930 -2.5516 -2.5508 1.3171 1.3172 3.6357 3.6368 5.4987 5.5010 6.6593 6.6673 6.8559 6.8664 7.0005 7.0168 7.2213 7.2222 8.2807 8.2817 10.0333 10.0355 10.5553 10.5562 10.7416 10.7429 10.9787 10.9792 11.6166 11.6218 k = 0.1932-0.3906-0.2337 ( 5167 PWs) bands (ev): -26.7781 -26.7781 -13.4023 -13.4023 -13.3936 -13.3935 -13.3823 -13.3823 -13.3642 -13.3641 -12.3841 -12.3832 -12.3779 -12.3778 -12.3681 -12.3673 -12.3329 -12.3324 -12.3215 -12.3211 -12.3101 -12.3099 -9.6187 -9.6183 -8.5333 -8.5325 -8.4347 -8.4345 -3.0540 -3.0535 -2.5274 -2.5266 1.3322 1.3324 3.5506 3.5517 5.3829 5.3849 6.6256 6.6313 6.8015 6.8108 6.9851 6.9972 7.2414 7.2415 8.1819 8.1830 10.0192 10.0208 10.5206 10.5213 10.7100 10.7108 11.0040 11.0042 11.6412 11.6462 k = 0.2045-0.4136-0.2475 ( 5165 PWs) bands (ev): -26.7776 -26.7776 -13.4021 -13.4021 -13.3938 -13.3937 -13.3819 -13.3819 -13.3643 -13.3643 -12.3840 -12.3830 -12.3778 -12.3777 -12.3674 -12.3667 -12.3334 -12.3328 -12.3218 -12.3214 -12.3100 -12.3097 -9.6206 -9.6202 -8.5348 -8.5339 -8.4387 -8.4385 -3.0126 -3.0121 -2.5021 -2.5012 1.3462 1.3463 3.4633 3.4645 5.2706 5.2724 6.5905 6.5944 6.7468 6.7554 6.9687 6.9778 7.2656 7.2662 8.0817 8.0828 9.9924 9.9937 10.4887 10.4893 10.6774 10.6780 11.0141 11.0143 11.6739 11.6788 k = 0.2159-0.4366-0.2612 ( 5171 PWs) bands (ev): -26.7772 -26.7772 -13.4019 -13.4019 -13.3939 -13.3938 -13.3816 -13.3815 -13.3645 -13.3644 -12.3838 -12.3829 -12.3777 -12.3776 -12.3668 -12.3660 -12.3339 -12.3334 -12.3220 -12.3217 -12.3098 -12.3095 -9.6226 -9.6221 -8.5364 -8.5355 -8.4426 -8.4423 -2.9693 -2.9688 -2.4758 -2.4749 1.3586 1.3587 3.3746 3.3758 5.1626 5.1643 6.5543 6.5565 6.6931 6.7013 6.9512 6.9582 7.2930 7.2938 7.9806 7.9818 9.9552 9.9563 10.4618 10.4621 10.6436 10.6442 11.0106 11.0108 11.7130 11.7179 k = 0.2273-0.4595-0.2750 ( 5165 PWs) bands (ev): -26.7767 -26.7767 -13.4017 -13.4017 -13.3941 -13.3940 -13.3812 -13.3812 -13.3646 -13.3645 -12.3837 -12.3827 -12.3776 -12.3776 -12.3662 -12.3654 -12.3345 -12.3340 -12.3222 -12.3219 -12.3097 -12.3094 -9.6247 -9.6242 -8.5382 -8.5373 -8.4462 -8.4460 -2.9242 -2.9237 -2.4485 -2.4475 1.3690 1.3691 3.2848 3.2860 5.0597 5.0613 6.5169 6.5177 6.6412 6.6492 6.9329 6.9384 7.3219 7.3227 7.8799 7.8812 9.9106 9.9114 10.4395 10.4396 10.6096 10.6104 10.9964 10.9965 11.7555 11.7601 k = 0.2386-0.4825-0.2887 ( 5166 PWs) bands (ev): -26.7762 -26.7762 -13.4015 -13.4015 -13.3942 -13.3941 -13.3808 -13.3808 -13.3647 -13.3647 -12.3835 -12.3825 -12.3775 -12.3774 -12.3655 -12.3648 -12.3351 -12.3346 -12.3224 -12.3221 -12.3095 -12.3092 -9.6268 -9.6263 -8.5403 -8.5394 -8.4497 -8.4494 -2.8774 -2.8768 -2.4204 -2.4194 1.3768 1.3769 3.1946 3.1958 4.9626 4.9640 6.4778 6.4781 6.5919 6.5997 6.9140 6.9184 7.3496 7.3503 7.7817 7.7830 9.8612 9.8619 10.4205 10.4210 10.5763 10.5775 10.9742 10.9743 11.7984 11.8025 k = 0.2500-0.5055-0.3025 ( 5161 PWs) bands (ev): -26.7757 -26.7757 -13.4014 -13.4013 -13.3943 -13.3942 -13.3805 -13.3805 -13.3649 -13.3648 -12.3833 -12.3824 -12.3774 -12.3773 -12.3649 -12.3642 -12.3357 -12.3352 -12.3225 -12.3223 -12.3094 -12.3091 -9.6289 -9.6284 -8.5426 -8.5416 -8.4528 -8.4526 -2.8290 -2.8285 -2.3915 -2.3905 1.3816 1.3817 3.1045 3.1057 4.8719 4.8732 6.4368 6.4379 6.5457 6.5533 6.8947 6.8983 7.3709 7.3713 7.6907 7.6922 9.8094 9.8101 10.4038 10.4050 10.5449 10.5466 10.9468 10.9469 11.8399 11.8434 k = 0.2614-0.5285-0.3162 ( 5174 PWs) bands (ev): -26.7752 -26.7752 -13.4012 -13.4011 -13.3944 -13.3943 -13.3801 -13.3801 -13.3650 -13.3649 -12.3831 -12.3822 -12.3773 -12.3772 -12.3643 -12.3636 -12.3364 -12.3360 -12.3226 -12.3224 -12.3093 -12.3090 -9.6311 -9.6306 -8.5451 -8.5441 -8.4557 -8.4554 -2.7792 -2.7787 -2.3619 -2.3609 1.3828 1.3829 3.0151 3.0163 4.7880 4.7892 6.3948 6.3964 6.5028 6.5101 6.8753 6.8782 7.3731 7.3731 7.6193 7.6211 9.7571 9.7577 10.3889 10.3908 10.5160 10.5184 10.9160 10.9162 11.8790 11.8819 k = 0.2727-0.5514-0.3300 ( 5176 PWs) bands (ev): -26.7748 -26.7748 -13.4010 -13.4009 -13.3945 -13.3943 -13.3798 -13.3798 -13.3652 -13.3651 -12.3829 -12.3820 -12.3771 -12.3771 -12.3637 -12.3630 -12.3371 -12.3367 -12.3227 -12.3225 -12.3092 -12.3089 -9.6333 -9.6328 -8.5478 -8.5468 -8.4583 -8.4580 -2.7281 -2.7275 -2.3319 -2.3309 1.3800 1.3801 2.9270 2.9282 4.7115 4.7127 6.3522 6.3540 6.4632 6.4699 6.8558 6.8583 7.3359 7.3362 7.5876 7.5893 9.7053 9.7059 10.3753 10.3779 10.4905 10.4934 10.8833 10.8835 11.9148 11.9171 k = 0.2841-0.5744-0.3437 ( 5180 PWs) bands (ev): -26.7743 -26.7743 -13.4008 -13.4007 -13.3946 -13.3944 -13.3795 -13.3795 -13.3653 -13.3652 -12.3826 -12.3817 -12.3770 -12.3769 -12.3631 -12.3624 -12.3378 -12.3374 -12.3227 -12.3225 -12.3091 -12.3088 -9.6355 -9.6350 -8.5506 -8.5497 -8.4606 -8.4603 -2.6758 -2.6753 -2.3014 -2.3004 1.3726 1.3726 2.8409 2.8421 4.6428 4.6439 6.3093 6.3112 6.4264 6.4326 6.8365 6.8386 7.2613 7.2615 7.5938 7.5953 9.6550 9.6555 10.3630 10.3663 10.4686 10.4722 10.8497 10.8498 11.9464 11.9481 k = 0.2955-0.5974-0.3575 ( 5186 PWs) bands (ev): -26.7738 -26.7738 -13.4006 -13.4005 -13.3946 -13.3945 -13.3792 -13.3791 -13.3655 -13.3654 -12.3824 -12.3815 -12.3768 -12.3767 -12.3626 -12.3619 -12.3386 -12.3382 -12.3227 -12.3225 -12.3090 -12.3087 -9.6377 -9.6372 -8.5536 -8.5527 -8.4626 -8.4623 -2.6226 -2.6221 -2.2708 -2.2698 1.3602 1.3602 2.7574 2.7585 4.5823 4.5833 6.2668 6.2686 6.3922 6.3978 6.8174 6.8193 7.1688 7.1690 7.6181 7.6194 9.6066 9.6072 10.3522 10.3561 10.4507 10.4548 10.8159 10.8160 11.9727 11.9738 k = 0.3068-0.6204-0.3712 ( 5181 PWs) bands (ev): -26.7734 -26.7734 -13.4004 -13.4003 -13.3947 -13.3945 -13.3789 -13.3788 -13.3656 -13.3655 -12.3822 -12.3813 -12.3767 -12.3766 -12.3621 -12.3614 -12.3393 -12.3390 -12.3226 -12.3225 -12.3090 -12.3087 -9.6398 -9.6394 -8.5567 -8.5559 -8.4643 -8.4641 -2.5687 -2.5682 -2.2400 -2.2390 1.3426 1.3427 2.6768 2.6778 4.5301 4.5311 6.2251 6.2267 6.3600 6.3651 6.7985 6.8002 7.0697 7.0699 7.6493 7.6503 9.5607 9.5612 10.3431 10.3474 10.4369 10.4413 10.7825 10.7827 11.9922 11.9930 k = 0.3182-0.6433-0.3850 ( 5181 PWs) bands (ev): -26.7729 -26.7729 -13.4003 -13.4002 -13.3947 -13.3946 -13.3786 -13.3786 -13.3658 -13.3657 -12.3819 -12.3811 -12.3765 -12.3764 -12.3615 -12.3609 -12.3401 -12.3398 -12.3225 -12.3225 -12.3089 -12.3086 -9.6420 -9.6415 -8.5599 -8.5591 -8.4658 -8.4656 -2.5143 -2.5138 -2.2092 -2.2083 1.3196 1.3197 2.5998 2.6008 4.4865 4.4874 6.1844 6.1859 6.3298 6.3343 6.7797 6.7813 6.9688 6.9690 7.6828 7.6837 9.5173 9.5179 10.3361 10.3406 10.4271 10.4316 10.7499 10.7501 12.0038 12.0041 k = 0.3295-0.6663-0.3987 ( 5176 PWs) bands (ev): -26.7725 -26.7725 -13.4001 -13.4000 -13.3948 -13.3946 -13.3783 -13.3783 -13.3659 -13.3658 -12.3817 -12.3808 -12.3763 -12.3762 -12.3610 -12.3604 -12.3409 -12.3406 -12.3224 -12.3224 -12.3089 -12.3086 -9.6441 -9.6436 -8.5631 -8.5623 -8.4670 -8.4668 -2.4596 -2.4591 -2.1788 -2.1778 1.2914 1.2915 2.5267 2.5276 4.4516 4.4524 6.1451 6.1464 6.3012 6.3052 6.7600 6.7616 6.8690 6.8695 7.7168 7.7176 9.4767 9.4772 10.3314 10.3359 10.4212 10.4257 10.7185 10.7187 12.0061 12.0062 k = 0.3409-0.6893-0.4125 ( 5174 PWs) bands (ev): -26.7721 -26.7721 -13.4000 -13.3998 -13.3948 -13.3946 -13.3780 -13.3780 -13.3660 -13.3660 -12.3814 -12.3806 -12.3762 -12.3761 -12.3606 -12.3599 -12.3417 -12.3414 -12.3223 -12.3223 -12.3089 -12.3086 -9.6461 -9.6457 -8.5663 -8.5656 -8.4681 -8.4678 -2.4050 -2.4045 -2.1487 -2.1478 1.2581 1.2582 2.4578 2.4586 4.4251 4.4259 6.1073 6.1085 6.2741 6.2777 6.7305 6.7325 6.7805 6.7815 7.7502 7.7509 9.4388 9.4393 10.3292 10.3335 10.4191 10.4233 10.6887 10.6889 11.9981 11.9986 k = 0.3523-0.7123-0.4262 ( 5176 PWs) bands (ev): -26.7717 -26.7717 -13.3998 -13.3997 -13.3948 -13.3946 -13.3778 -13.3778 -13.3662 -13.3661 -12.3811 -12.3804 -12.3760 -12.3759 -12.3601 -12.3595 -12.3425 -12.3423 -12.3221 -12.3221 -12.3089 -12.3086 -9.6481 -9.6476 -8.5695 -8.5687 -8.4689 -8.4687 -2.3508 -2.3504 -2.1193 -2.1183 1.2203 1.2205 2.3934 2.3940 4.4069 4.4077 6.0710 6.0721 6.2484 6.2517 6.6557 6.6567 6.7415 6.7416 7.7824 7.7830 9.4038 9.4043 10.3296 10.3335 10.4207 10.4244 10.6606 10.6607 11.9799 11.9807 k = 0.3636-0.7352-0.4400 ( 5174 PWs) bands (ev): -26.7713 -26.7713 -13.3997 -13.3995 -13.3948 -13.3947 -13.3776 -13.3775 -13.3663 -13.3663 -12.3809 -12.3801 -12.3758 -12.3757 -12.3597 -12.3591 -12.3432 -12.3430 -12.3220 -12.3220 -12.3089 -12.3086 -9.6499 -9.6495 -8.5725 -8.5719 -8.4696 -8.4694 -2.2974 -2.2970 -2.0906 -2.0897 1.1787 1.1790 2.3334 2.3340 4.3967 4.3973 6.0363 6.0373 6.2239 6.2269 6.5634 6.5639 6.7230 6.7232 7.8130 7.8134 9.3715 9.3720 10.3322 10.3356 10.4258 10.4289 10.6345 10.6347 11.9519 11.9529 k = 0.3750-0.7582-0.4537 ( 5177 PWs) bands (ev): -26.7709 -26.7709 -13.3995 -13.3994 -13.3949 -13.3947 -13.3773 -13.3773 -13.3665 -13.3664 -12.3806 -12.3799 -12.3757 -12.3756 -12.3592 -12.3587 -12.3440 -12.3438 -12.3218 -12.3218 -12.3089 -12.3086 -9.6517 -9.6513 -8.5755 -8.5748 -8.4701 -8.4700 -2.2453 -2.2448 -2.0630 -2.0621 1.1342 1.1345 2.2780 2.2785 4.3938 4.3944 6.0029 6.0038 6.2004 6.2032 6.4725 6.4729 6.7079 6.7082 7.8416 7.8419 9.3420 9.3425 10.3368 10.3396 10.4342 10.4365 10.6109 10.6110 11.9151 11.9163 k = 0.3864-0.7812-0.4675 ( 5171 PWs) bands (ev): -26.7706 -26.7706 -13.3994 -13.3993 -13.3949 -13.3947 -13.3771 -13.3771 -13.3666 -13.3665 -12.3803 -12.3797 -12.3756 -12.3754 -12.3588 -12.3583 -12.3447 -12.3446 -12.3216 -12.3216 -12.3089 -12.3087 -9.6534 -9.6530 -8.5782 -8.5777 -8.4705 -8.4704 -2.1948 -2.1944 -2.0365 -2.0357 1.0880 1.0883 2.2272 2.2276 4.3976 4.3982 5.9706 5.9715 6.1774 6.1799 6.3865 6.3869 6.6945 6.6947 7.8680 7.8683 9.3153 9.3157 10.3430 10.3450 10.4454 10.4469 10.5903 10.5904 11.8711 11.8724 k = 0.3977-0.8042-0.4812 ( 5171 PWs) bands (ev): -26.7703 -26.7703 -13.3993 -13.3992 -13.3949 -13.3947 -13.3769 -13.3769 -13.3667 -13.3667 -12.3801 -12.3794 -12.3754 -12.3753 -12.3584 -12.3580 -12.3454 -12.3453 -12.3214 -12.3214 -12.3090 -12.3087 -9.6549 -9.6546 -8.5808 -8.5803 -8.4709 -8.4708 -2.1467 -2.1463 -2.0114 -2.0106 1.0411 1.0414 2.1809 2.1813 4.4074 4.4079 5.9390 5.9397 6.1536 6.1560 6.3082 6.3087 6.6824 6.6826 7.8920 7.8923 9.2912 9.2917 10.3501 10.3515 10.4582 10.4589 10.5738 10.5738 11.8216 11.8230 k = 0.4091-0.8272-0.4950 ( 5171 PWs) bands (ev): -26.7700 -26.7700 -13.3992 -13.3991 -13.3949 -13.3947 -13.3768 -13.3768 -13.3668 -13.3668 -12.3798 -12.3792 -12.3753 -12.3752 -12.3581 -12.3576 -12.3461 -12.3460 -12.3213 -12.3212 -12.3090 -12.3088 -9.6563 -9.6561 -8.5832 -8.5827 -8.4711 -8.4710 -2.1016 -2.1012 -1.9878 -1.9870 0.9947 0.9951 2.1393 2.1395 4.4221 4.4225 5.9072 5.9079 6.1267 6.1289 6.2418 6.2423 6.6715 6.6717 7.9136 7.9138 9.2699 9.2703 10.3578 10.3586 10.4700 10.4701 10.5636 10.5637 11.7686 11.7701 k = 0.4205-0.8501-0.5087 ( 5176 PWs) bands (ev): -26.7698 -26.7698 -13.3991 -13.3990 -13.3949 -13.3947 -13.3766 -13.3766 -13.3669 -13.3669 -12.3796 -12.3790 -12.3752 -12.3751 -12.3577 -12.3573 -12.3468 -12.3467 -12.3211 -12.3210 -12.3091 -12.3088 -9.6576 -9.6574 -8.5853 -8.5849 -8.4713 -8.4712 -2.0602 -2.0598 -1.9658 -1.9651 0.9502 0.9505 2.1022 2.1024 4.4406 4.4410 5.8746 5.8752 6.0932 6.0950 6.1928 6.1931 6.6619 6.6621 7.9327 7.9328 9.2511 9.2514 10.3656 10.3659 10.4763 10.4769 10.5631 10.5632 11.7141 11.7156 k = 0.4318-0.8731-0.5225 ( 5173 PWs) bands (ev): -26.7695 -26.7695 -13.3990 -13.3989 -13.3948 -13.3947 -13.3765 -13.3765 -13.3670 -13.3670 -12.3793 -12.3789 -12.3752 -12.3750 -12.3574 -12.3570 -12.3473 -12.3473 -12.3209 -12.3209 -12.3091 -12.3089 -9.6587 -9.6585 -8.5872 -8.5869 -8.4715 -8.4714 -2.0233 -2.0229 -1.9454 -1.9447 0.9086 0.9089 2.0698 2.0700 4.4617 4.4621 5.8403 5.8408 6.0545 6.0558 6.1616 6.1616 6.6535 6.6537 7.9492 7.9493 9.2349 9.2352 10.3731 10.3732 10.4757 10.4766 10.5738 10.5738 11.6601 11.6615 k = 0.4432-0.8961-0.5362 ( 5179 PWs) bands (ev): -26.7694 -26.7694 -13.3989 -13.3988 -13.3948 -13.3947 -13.3764 -13.3764 -13.3671 -13.3670 -12.3791 -12.3787 -12.3751 -12.3750 -12.3570 -12.3567 -12.3479 -12.3478 -12.3208 -12.3207 -12.3091 -12.3090 -9.6597 -9.6595 -8.5888 -8.5886 -8.4716 -8.4715 -1.9917 -1.9914 -1.9265 -1.9259 0.8711 0.8713 2.0422 2.0423 4.4839 4.4843 5.8046 5.8050 6.0178 6.0186 6.1415 6.1417 6.6464 6.6465 7.9631 7.9632 9.2213 9.2215 10.3799 10.3803 10.4707 10.4716 10.5918 10.5921 11.6086 11.6099 k = 0.4545-0.9191-0.5500 ( 5171 PWs) bands (ev): -26.7692 -26.7692 -13.3989 -13.3988 -13.3948 -13.3947 -13.3763 -13.3763 -13.3671 -13.3671 -12.3789 -12.3786 -12.3750 -12.3749 -12.3567 -12.3565 -12.3483 -12.3483 -12.3206 -12.3206 -12.3092 -12.3090 -9.6605 -9.6603 -8.5902 -8.5899 -8.4716 -8.4716 -1.9663 -1.9660 -1.9094 -1.9089 0.8388 0.8390 2.0193 2.0194 4.5057 4.5059 5.7691 5.7694 5.9879 5.9885 6.1279 6.1282 6.6405 6.6406 7.9745 7.9745 9.2102 9.2104 10.3860 10.3865 10.4643 10.4651 10.6128 10.6133 11.5617 11.5629 k = 0.4659-0.9420-0.5637 ( 5163 PWs) bands (ev): -26.7691 -26.7691 -13.3988 -13.3988 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3788 -12.3785 -12.3750 -12.3749 -12.3565 -12.3563 -12.3487 -12.3487 -12.3205 -12.3205 -12.3092 -12.3091 -9.6611 -9.6610 -8.5912 -8.5910 -8.4717 -8.4716 -1.9472 -1.9470 -1.8944 -1.8940 0.8126 0.8128 2.0015 2.0015 4.5252 4.5254 5.7369 5.7370 5.9660 5.9663 6.1184 6.1186 6.6359 6.6360 7.9833 7.9833 9.2016 9.2017 10.3911 10.3917 10.4585 10.4592 10.6332 10.6337 11.5217 11.5227 k = 0.4773-0.9650-0.5775 ( 5163 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3786 -12.3784 -12.3750 -12.3749 -12.3563 -12.3562 -12.3490 -12.3490 -12.3204 -12.3204 -12.3092 -12.3091 -9.6615 -9.6615 -8.5920 -8.5918 -8.4717 -8.4717 -1.9343 -1.9342 -1.8824 -1.8822 0.7933 0.7934 1.9886 1.9887 4.5407 4.5408 5.7110 5.7111 5.9512 5.9514 6.1120 6.1121 6.6326 6.6327 7.9895 7.9896 9.1954 9.1955 10.3950 10.3955 10.4539 10.4545 10.6502 10.6506 11.4909 11.4916 k = 0.4886-0.9880-0.5912 ( 5160 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3562 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6618 -9.6618 -8.5924 -8.5923 -8.4717 -8.4717 -1.9268 -1.9268 -1.8747 -1.8746 0.7815 0.7816 1.9809 1.9809 4.5507 4.5508 5.6943 5.6943 5.9428 5.9429 6.1082 6.1083 6.6307 6.6307 7.9933 7.9933 9.1918 9.1918 10.3975 10.3978 10.4512 10.4514 10.6615 10.6618 11.4715 11.4719 k = 0.5000-1.0110-0.6050 ( 5166 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6619 -8.5925 -8.5925 -8.4717 -8.4717 -1.9244 -1.9244 -1.8720 -1.8720 0.7776 0.7776 1.9783 1.9783 4.5543 4.5543 5.6885 5.6885 5.9400 5.9400 6.1070 6.1070 6.6300 6.6300 7.9945 7.9945 9.1906 9.1906 10.3985 10.3985 10.4503 10.4503 10.6656 10.6656 11.4649 11.4649 k = 0.5000-1.0110-0.6050 ( 5166 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6619 -8.5925 -8.5925 -8.4717 -8.4717 -1.9244 -1.9244 -1.8720 -1.8720 0.7776 0.7776 1.9783 1.9783 4.5543 4.5543 5.6885 5.6885 5.9400 5.9400 6.1070 6.1070 6.6300 6.6300 7.9945 7.9945 9.1906 9.1906 10.3985 10.3985 10.4503 10.4503 10.6656 10.6656 11.4649 11.4649 k = 0.5000-0.9960-0.6300 ( 5162 PWs) bands (ev): -26.7689 -26.7689 -13.3989 -13.3987 -13.3948 -13.3946 -13.3761 -13.3761 -13.3673 -13.3672 -12.3787 -12.3785 -12.3749 -12.3747 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3203 -12.3092 -12.3092 -9.6619 -9.6618 -8.5925 -8.5924 -8.4719 -8.4719 -1.9238 -1.9236 -1.8715 -1.8714 0.7785 0.7785 1.9769 1.9769 4.5538 4.5539 5.6883 5.6899 5.9375 5.9389 6.1049 6.1066 6.6197 6.6211 7.9926 7.9932 9.2051 9.2067 10.3684 10.3732 10.4760 10.4819 10.6671 10.6686 11.4724 11.4731 k = 0.5000-0.9811-0.6549 ( 5158 PWs) bands (ev): -26.7689 -26.7689 -13.3991 -13.3988 -13.3947 -13.3944 -13.3761 -13.3761 -13.3673 -13.3672 -12.3791 -12.3787 -12.3746 -12.3742 -12.3561 -12.3560 -12.3492 -12.3491 -12.3205 -12.3203 -12.3093 -12.3092 -9.6619 -9.6619 -8.5923 -8.5922 -8.4724 -8.4724 -1.9218 -1.9214 -1.8697 -1.8695 0.7811 0.7813 1.9726 1.9726 4.5526 4.5528 5.6890 5.6924 5.9313 5.9344 6.1000 6.1033 6.5913 6.5943 7.9873 7.9884 9.2493 9.2524 10.3266 10.3318 10.5197 10.5272 10.6730 10.6761 11.4951 11.4965 k = 0.5000-0.9661-0.6799 ( 5156 PWs) bands (ev): -26.7689 -26.7689 -13.3993 -13.3989 -13.3945 -13.3942 -13.3761 -13.3760 -13.3673 -13.3673 -12.3796 -12.3792 -12.3742 -12.3736 -12.3561 -12.3560 -12.3491 -12.3490 -12.3205 -12.3204 -12.3095 -12.3093 -9.6620 -9.6619 -8.5919 -8.5918 -8.4733 -8.4732 -1.9185 -1.9179 -1.8667 -1.8664 0.7856 0.7858 1.9654 1.9655 4.5507 4.5510 5.6902 5.6956 5.9214 5.9272 6.0916 6.0959 6.5487 6.5532 7.9785 7.9799 9.3207 9.3252 10.2865 10.2920 10.5634 10.5728 10.6837 10.6887 11.5327 11.5348 k = 0.5000-0.9511-0.7049 ( 5162 PWs) bands (ev): -26.7688 -26.7688 -13.3996 -13.3991 -13.3942 -13.3938 -13.3761 -13.3760 -13.3674 -13.3673 -12.3802 -12.3797 -12.3737 -12.3730 -12.3561 -12.3560 -12.3489 -12.3488 -12.3206 -12.3204 -12.3096 -12.3095 -9.6621 -9.6619 -8.5914 -8.5912 -8.4745 -8.4744 -1.9139 -1.9131 -1.8626 -1.8621 0.7919 0.7921 1.9553 1.9554 4.5482 4.5486 5.6908 5.6989 5.9080 5.9181 6.0782 6.0825 6.4975 6.5036 7.9657 7.9672 9.4158 9.4216 10.2507 10.2566 10.6043 10.6157 10.6997 10.7071 11.5842 11.5869 k = 0.5000-0.9362-0.7299 ( 5164 PWs) bands (ev): -26.7688 -26.7688 -13.3999 -13.3994 -13.3939 -13.3935 -13.3761 -13.3759 -13.3675 -13.3673 -12.3808 -12.3802 -12.3731 -12.3724 -12.3561 -12.3559 -12.3487 -12.3486 -12.3207 -12.3204 -12.3098 -12.3097 -9.6622 -9.6620 -8.5907 -8.5905 -8.4760 -8.4759 -1.9080 -1.9071 -1.8573 -1.8566 0.7999 0.8002 1.9424 1.9425 4.5451 4.5456 5.6898 5.7014 5.8907 5.9075 6.0580 6.0608 6.4452 6.4526 7.9485 7.9500 9.5307 9.5375 10.2202 10.2267 10.6410 10.6542 10.7224 10.7316 11.6484 11.6517 k = 0.5000-0.9212-0.7549 ( 5170 PWs) bands (ev): -26.7687 -26.7687 -13.4003 -13.3997 -13.3935 -13.3931 -13.3760 -13.3759 -13.3676 -13.3674 -12.3814 -12.3808 -12.3725 -12.3718 -12.3560 -12.3558 -12.3485 -12.3484 -12.3209 -12.3205 -12.3101 -12.3099 -9.6623 -9.6621 -8.5899 -8.5897 -8.4778 -8.4777 -1.9010 -1.8998 -1.8508 -1.8500 0.8097 0.8100 1.9265 1.9266 4.5416 4.5422 5.6853 5.7016 5.8674 5.8946 6.0283 6.0322 6.3999 6.4077 7.9262 7.9276 9.6614 9.6694 10.1957 10.2032 10.6735 10.6870 10.7521 10.7620 11.7239 11.7278 k = 0.5000-0.9063-0.7799 ( 5176 PWs) bands (ev): -26.7686 -26.7686 -13.4006 -13.4000 -13.3931 -13.3927 -13.3760 -13.3758 -13.3677 -13.3675 -12.3820 -12.3814 -12.3718 -12.3711 -12.3559 -12.3557 -12.3482 -12.3481 -12.3210 -12.3206 -12.3104 -12.3101 -9.6624 -9.6621 -8.5890 -8.5887 -8.4799 -8.4797 -1.8929 -1.8915 -1.8432 -1.8423 0.8211 0.8215 1.9077 1.9078 4.5378 4.5386 5.6753 5.6979 5.8323 5.8728 5.9936 6.0047 6.3673 6.3746 7.8985 7.8997 9.8038 9.8137 10.1777 10.1867 10.7031 10.7159 10.7870 10.7966 11.8091 11.8137 k = 0.5000-0.8913-0.8049 ( 5168 PWs) bands (ev): -26.7686 -26.7686 -13.4009 -13.4002 -13.3927 -13.3923 -13.3759 -13.3757 -13.3678 -13.3676 -12.3825 -12.3819 -12.3712 -12.3705 -12.3558 -12.3556 -12.3480 -12.3478 -12.3211 -12.3207 -12.3107 -12.3104 -9.6626 -9.6623 -8.5879 -8.5876 -8.4822 -8.4820 -1.8838 -1.8821 -1.8346 -1.8335 0.8341 0.8346 1.8860 1.8862 4.5339 4.5349 5.6570 5.6882 5.7789 5.8302 5.9727 5.9868 6.3482 6.3543 7.8652 7.8661 9.9529 9.9665 10.1664 10.1791 10.7315 10.7434 10.8239 10.8331 11.9025 11.9079 k = 0.5000-0.8763-0.8299 ( 5172 PWs) bands (ev): -26.7685 -26.7685 -13.4012 -13.4005 -13.3923 -13.3919 -13.3759 -13.3756 -13.3679 -13.3677 -12.3831 -12.3825 -12.3706 -12.3699 -12.3557 -12.3555 -12.3477 -12.3475 -12.3213 -12.3208 -12.3111 -12.3107 -9.6628 -9.6624 -8.5867 -8.5863 -8.4847 -8.4846 -1.8738 -1.8719 -1.8250 -1.8237 0.8487 0.8493 1.8615 1.8617 4.5302 4.5313 5.6250 5.6642 5.7151 5.7707 5.9721 5.9837 6.3403 6.3451 7.8263 7.8270 10.0901 10.1160 10.1704 10.1954 10.7601 10.7713 10.8607 10.8699 12.0026 12.0091 k = 0.5000-0.8614-0.8549 ( 5170 PWs) bands (ev): -26.7684 -26.7684 -13.4015 -13.4008 -13.3919 -13.3914 -13.3758 -13.3755 -13.3680 -13.3678 -12.3836 -12.3830 -12.3701 -12.3692 -12.3556 -12.3553 -12.3474 -12.3473 -12.3215 -12.3209 -12.3114 -12.3110 -9.6629 -9.6625 -8.5854 -8.5850 -8.4875 -8.4873 -1.8631 -1.8610 -1.8144 -1.8129 0.8649 0.8655 1.8342 1.8344 4.5268 4.5282 5.5701 5.5961 5.6778 5.7158 5.9849 5.9930 6.3404 6.3442 7.7820 7.7826 10.1418 10.1508 10.2965 10.3051 10.7901 10.8010 10.8957 10.9055 12.1077 12.1158 k = 0.5000-0.8464-0.8799 ( 5170 PWs) bands (ev): -26.7683 -26.7683 -13.4018 -13.4011 -13.3915 -13.3910 -13.3758 -13.3754 -13.3682 -13.3679 -12.3841 -12.3835 -12.3695 -12.3687 -12.3554 -12.3551 -12.3471 -12.3470 -12.3216 -12.3210 -12.3118 -12.3114 -9.6631 -9.6627 -8.5840 -8.5835 -8.4904 -8.4902 -1.8518 -1.8495 -1.8029 -1.8013 0.8824 0.8832 1.8042 1.8045 4.5240 4.5256 5.4903 5.5019 5.6564 5.6766 6.0062 6.0116 6.3463 6.3492 7.7329 7.7333 10.1521 10.1553 10.4539 10.4577 10.8236 10.8354 10.9277 10.9391 12.2160 12.2266 k = 0.5000-0.8315-0.9049 ( 5176 PWs) bands (ev): -26.7682 -26.7682 -13.4021 -13.4013 -13.3911 -13.3907 -13.3757 -13.3753 -13.3683 -13.3680 -12.3846 -12.3840 -12.3690 -12.3681 -12.3552 -12.3549 -12.3469 -12.3467 -12.3218 -12.3211 -12.3122 -12.3118 -9.6633 -9.6629 -8.5825 -8.5820 -8.4935 -8.4933 -1.8401 -1.8376 -1.7906 -1.7889 0.9014 0.9022 1.7717 1.7720 4.5221 4.5240 5.3963 5.4010 5.6369 5.6479 6.0334 6.0370 6.3561 6.3584 7.6795 7.6800 10.1598 10.1621 10.5979 10.6015 10.8677 10.8825 10.9560 10.9711 12.3240 12.3394 k = 0.5000-0.8165-0.9299 ( 5172 PWs) bands (ev): -26.7681 -26.7681 -13.4023 -13.4016 -13.3907 -13.3903 -13.3756 -13.3752 -13.3685 -13.3681 -12.3850 -12.3844 -12.3685 -12.3676 -12.3550 -12.3547 -12.3467 -12.3465 -12.3220 -12.3212 -12.3126 -12.3121 -9.6636 -9.6631 -8.5810 -8.5804 -8.4966 -8.4964 -1.8281 -1.8255 -1.7776 -1.7758 0.9216 0.9226 1.7369 1.7372 4.5214 4.5236 5.2967 5.2988 5.6180 5.6241 6.0653 6.0677 6.3690 6.3707 7.6227 7.6232 10.1690 10.1714 10.7044 10.7074 10.9329 10.9583 10.9838 11.0099 12.4230 12.4485 k = 0.5000-0.8016-0.9549 ( 5172 PWs) bands (ev): -26.7680 -26.7680 -13.4026 -13.4018 -13.3903 -13.3899 -13.3755 -13.3751 -13.3687 -13.3682 -12.3855 -12.3849 -12.3680 -12.3671 -12.3547 -12.3544 -12.3465 -12.3463 -12.3221 -12.3213 -12.3131 -12.3125 -9.6638 -9.6633 -8.5794 -8.5787 -8.4998 -8.4996 -1.8162 -1.8133 -1.7641 -1.7621 0.9431 0.9441 1.7000 1.7003 4.5219 4.5246 5.1957 5.1979 5.5999 5.6034 6.1011 6.1026 6.3840 6.3854 7.5632 7.5637 10.1801 10.1827 10.7588 10.7609 10.9840 10.9932 11.0896 11.1000 12.4878 12.5225 k = 0.5000-0.7866-0.9799 ( 5176 PWs) bands (ev): -26.7679 -26.7679 -13.4028 -13.4020 -13.3900 -13.3896 -13.3755 -13.3750 -13.3688 -13.3684 -12.3858 -12.3852 -12.3675 -12.3666 -12.3544 -12.3541 -12.3463 -12.3462 -12.3223 -12.3214 -12.3135 -12.3129 -9.6640 -9.6635 -8.5777 -8.5770 -8.5029 -8.5028 -1.8044 -1.8014 -1.7500 -1.7480 0.9657 0.9669 1.6612 1.6616 4.5240 4.5272 5.0962 5.0993 5.5829 5.5848 6.1402 6.1410 6.4007 6.4018 7.5018 7.5024 10.1929 10.1957 10.7780 10.7801 11.0024 11.0063 11.2324 11.2364 12.5111 12.5350 k = 0.5000-0.7716-1.0049 ( 5178 PWs) bands (ev): -26.7678 -26.7678 -13.4030 -13.4022 -13.3896 -13.3893 -13.3754 -13.3748 -13.3690 -13.3685 -12.3862 -12.3856 -12.3671 -12.3662 -12.3541 -12.3538 -12.3462 -12.3460 -12.3224 -12.3215 -12.3139 -12.3133 -9.6643 -9.6637 -8.5761 -8.5753 -8.5061 -8.5060 -1.7929 -1.7900 -1.7357 -1.7337 0.9894 0.9907 1.6210 1.6215 4.5277 4.5316 5.0001 5.0041 5.5672 5.5682 6.1819 6.1823 6.4187 6.4196 7.4392 7.4399 10.2072 10.2100 10.7769 10.7796 11.0087 11.0134 11.3769 11.3794 12.5339 12.5506 k = 0.5000-0.7567-1.0299 ( 5168 PWs) bands (ev): -26.7677 -26.7677 -13.4032 -13.4024 -13.3893 -13.3890 -13.3753 -13.3747 -13.3692 -13.3686 -12.3865 -12.3859 -12.3667 -12.3658 -12.3537 -12.3534 -12.3462 -12.3460 -12.3225 -12.3215 -12.3143 -12.3136 -9.6645 -9.6639 -8.5745 -8.5736 -8.5091 -8.5090 -1.7821 -1.7791 -1.7213 -1.7194 1.0141 1.0156 1.5797 1.5803 4.5330 4.5380 4.9083 4.9135 5.5528 5.5533 6.2257 6.2258 6.4378 6.4385 7.3761 7.3770 10.2227 10.2256 10.7615 10.7647 11.0086 11.0143 11.5137 11.5159 12.5771 12.5902 k = 0.5000-0.7417-1.0549 ( 5160 PWs) bands (ev): -26.7676 -26.7676 -13.4033 -13.4025 -13.3891 -13.3887 -13.3753 -13.3746 -13.3693 -13.3687 -12.3868 -12.3862 -12.3664 -12.3655 -12.3533 -12.3531 -12.3462 -12.3460 -12.3225 -12.3215 -12.3146 -12.3140 -9.6647 -9.6641 -8.5729 -8.5720 -8.5120 -8.5119 -1.7720 -1.7690 -1.7071 -1.7052 1.0397 1.0414 1.5377 1.5384 4.5398 4.5464 4.8216 4.8286 5.5398 5.5402 6.2709 6.2710 6.4581 6.4586 7.3133 7.3144 10.2392 10.2422 10.7345 10.7381 11.0034 11.0096 11.6387 11.6407 12.6451 12.6561 k = 0.5000-0.7268-1.0799 ( 5164 PWs) bands (ev): -26.7675 -26.7675 -13.4034 -13.4026 -13.3888 -13.3885 -13.3752 -13.3745 -13.3695 -13.3688 -12.3870 -12.3864 -12.3661 -12.3651 -12.3529 -12.3527 -12.3463 -12.3461 -12.3226 -12.3216 -12.3150 -12.3143 -9.6650 -9.6644 -8.5715 -8.5705 -8.5148 -8.5146 -1.7629 -1.7600 -1.6933 -1.6915 1.0662 1.0682 1.4955 1.4964 4.5473 4.5569 4.7408 4.7508 5.5281 5.5286 6.3165 6.3169 6.4797 6.4802 7.2514 7.2527 10.2568 10.2598 10.6981 10.7021 10.9938 11.0004 11.7508 11.7527 12.7347 12.7445 k = 0.5000-0.7118-1.1049 ( 5160 PWs) bands (ev): -26.7674 -26.7674 -13.4036 -13.4027 -13.3886 -13.3883 -13.3752 -13.3744 -13.3696 -13.3689 -12.3872 -12.3866 -12.3658 -12.3649 -12.3526 -12.3523 -12.3464 -12.3462 -12.3226 -12.3215 -12.3153 -12.3146 -9.6652 -9.6645 -8.5701 -8.5691 -8.5172 -8.5170 -1.7551 -1.7523 -1.6802 -1.6785 1.0935 1.0959 1.4535 1.4547 4.5529 4.5692 4.6666 4.6833 5.5178 5.5184 6.3611 6.3617 6.5036 6.5042 7.1909 7.1925 10.2752 10.2782 10.6549 10.6591 10.9808 10.9875 11.8513 11.8530 12.8359 12.8453 k = 0.5000-0.6969-1.1299 ( 5164 PWs) bands (ev): -26.7674 -26.7674 -13.4036 -13.4028 -13.3884 -13.3881 -13.3751 -13.3743 -13.3698 -13.3690 -12.3874 -12.3868 -12.3656 -12.3647 -12.3522 -12.3520 -12.3466 -12.3463 -12.3225 -12.3215 -12.3155 -12.3148 -9.6654 -9.6647 -8.5690 -8.5678 -8.5193 -8.5190 -1.7488 -1.7460 -1.6681 -1.6665 1.1215 1.1244 1.4123 1.4140 4.5469 4.5795 4.6033 4.6363 5.5089 5.5095 6.4023 6.4029 6.5316 6.5326 7.1325 7.1343 10.2945 10.2975 10.6073 10.6115 10.9652 10.9718 11.9421 11.9436 12.9105 12.9213 k = 0.5000-0.6819-1.1549 ( 5172 PWs) bands (ev): -26.7673 -26.7673 -13.4037 -13.4029 -13.3883 -13.3880 -13.3751 -13.3742 -13.3699 -13.3691 -12.3875 -12.3869 -12.3655 -12.3645 -12.3518 -12.3516 -12.3468 -12.3465 -12.3225 -12.3215 -12.3158 -12.3151 -9.6655 -9.6649 -8.5681 -8.5668 -8.5211 -8.5207 -1.7442 -1.7416 -1.6572 -1.6557 1.1500 1.1538 1.3723 1.3748 4.5149 4.5354 4.6037 4.6245 5.5013 5.5018 6.4367 6.4374 6.5663 6.5679 7.0765 7.0788 10.3146 10.3176 10.5574 10.5617 10.9478 10.9542 12.0242 12.0256 12.8712 12.8754 k = 0.5000-0.6669-1.1799 ( 5168 PWs) bands (ev): -26.7673 -26.7673 -13.4038 -13.4030 -13.3882 -13.3879 -13.3750 -13.3741 -13.3700 -13.3692 -12.3876 -12.3870 -12.3653 -12.3643 -12.3515 -12.3514 -12.3470 -12.3467 -12.3225 -12.3214 -12.3159 -12.3152 -9.6657 -9.6650 -8.5674 -8.5661 -8.5224 -8.5220 -1.7416 -1.7391 -1.6478 -1.6465 1.1787 1.1838 1.3343 1.3382 4.4711 4.4830 4.6217 4.6340 5.4948 5.4954 6.4625 6.4632 6.6090 6.6114 7.0236 7.0266 10.3354 10.3383 10.5077 10.5120 10.9294 10.9356 12.0968 12.0979 12.8001 12.8023 k = 0.5000-0.6520-1.2049 ( 5170 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3643 -12.3513 -12.3511 -12.3472 -12.3468 -12.3224 -12.3214 -12.3160 -12.3153 -9.6658 -9.6651 -8.5670 -8.5656 -8.5232 -8.5227 -1.7412 -1.7388 -1.6403 -1.6391 1.2057 1.2140 1.2995 1.3064 4.4296 4.4380 4.6420 4.6506 5.4896 5.4901 6.4802 6.4810 6.6583 6.6617 6.9743 6.9782 10.3561 10.3592 10.4601 10.4649 10.9107 10.9168 12.1562 12.1571 12.7240 12.7253 k = 0.5000-0.6370-1.2299 ( 5176 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3642 -12.3512 -12.3511 -12.3473 -12.3469 -12.3224 -12.3214 -12.3161 -12.3154 -9.6658 -9.6651 -8.5668 -8.5655 -8.5235 -8.5230 -1.7433 -1.7409 -1.6350 -1.6338 1.2232 1.2378 1.2747 1.2880 4.3943 4.4009 4.6637 4.6706 5.4856 5.4861 6.4913 6.4920 6.7115 6.7167 6.9293 6.9349 10.3726 10.3777 10.4191 10.4260 10.8925 10.8984 12.1965 12.1972 12.6462 12.6470 k = 0.5000-0.6221-1.2549 ( 5176 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3643 -12.3512 -12.3511 -12.3472 -12.3469 -12.3224 -12.3214 -12.3161 -12.3154 -9.6658 -9.6651 -8.5669 -8.5656 -8.5233 -8.5229 -1.7480 -1.7457 -1.6320 -1.6310 1.2152 1.2254 1.2906 1.2994 4.3665 4.3720 4.6866 4.6924 5.4830 5.4834 6.4968 6.4975 6.7643 6.7734 6.8900 6.8995 10.3612 10.3672 10.4125 10.4199 10.8753 10.8810 12.2115 12.2124 12.5678 12.5684 k = 0.5000-0.6071-1.2799 ( 5158 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3882 -13.3879 -13.3750 -13.3741 -13.3700 -13.3692 -12.3876 -12.3870 -12.3653 -12.3643 -12.3515 -12.3513 -12.3470 -12.3467 -12.3225 -12.3214 -12.3160 -12.3153 -9.6657 -9.6650 -8.5671 -8.5658 -8.5227 -8.5223 -1.7555 -1.7534 -1.6316 -1.6307 1.1941 1.2002 1.3241 1.3288 4.3465 4.3513 4.7103 4.7153 5.4819 5.4823 6.4973 6.4980 6.8019 6.8188 6.8689 6.8863 10.3305 10.3350 10.4339 10.4393 10.8596 10.8651 12.1996 12.2008 12.4894 12.4899 k = 0.8210-0.5321-1.1400 ( 5158 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3882 -13.3879 -13.3750 -13.3741 -13.3700 -13.3692 -12.3876 -12.3870 -12.3653 -12.3643 -12.3515 -12.3513 -12.3470 -12.3467 -12.3225 -12.3214 -12.3160 -12.3153 -9.6657 -9.6650 -8.5671 -8.5658 -8.5227 -8.5223 -1.7555 -1.7534 -1.6316 -1.6307 1.1941 1.2002 1.3241 1.3288 4.3465 4.3513 4.7103 4.7153 5.4819 5.4823 6.4973 6.4980 6.8019 6.8188 6.8689 6.8863 10.3305 10.3350 10.4339 10.4393 10.8596 10.8651 12.1996 12.2008 12.4894 12.4899 k = 0.8143-0.5186-1.1148 ( 5160 PWs) bands (ev): -26.7673 -26.7673 -13.4037 -13.4029 -13.3883 -13.3880 -13.3751 -13.3742 -13.3699 -13.3691 -12.3876 -12.3869 -12.3654 -12.3645 -12.3518 -12.3516 -12.3467 -12.3464 -12.3225 -12.3215 -12.3158 -12.3151 -9.6655 -9.6648 -8.5675 -8.5663 -8.5217 -8.5214 -1.7661 -1.7641 -1.6341 -1.6334 1.1724 1.1766 1.3615 1.3644 4.3346 4.3389 4.7344 4.7390 5.4827 5.4830 6.4929 6.4936 6.7979 6.8077 6.9111 6.9213 10.3023 10.3063 10.4586 10.4635 10.8459 10.8512 12.1651 12.1666 12.4107 12.4113 k = 0.8076-0.5050-1.0896 ( 5164 PWs) bands (ev): -26.7674 -26.7674 -13.4037 -13.4029 -13.3884 -13.3881 -13.3751 -13.3743 -13.3698 -13.3690 -12.3875 -12.3868 -12.3656 -12.3647 -12.3523 -12.3521 -12.3463 -12.3460 -12.3226 -12.3216 -12.3156 -12.3149 -9.6653 -9.6646 -8.5679 -8.5667 -8.5204 -8.5201 -1.7798 -1.7779 -1.6398 -1.6391 1.1532 1.1565 1.4014 1.4034 4.3309 4.3350 4.7584 4.7628 5.4856 5.4860 6.4837 6.4844 6.7774 6.7828 6.9734 6.9792 10.2803 10.2841 10.4843 10.4890 10.8346 10.8397 12.1153 12.1171 12.3327 12.3335 k = 0.8009-0.4915-1.0643 ( 5162 PWs) bands (ev): -26.7674 -26.7674 -13.4036 -13.4028 -13.3885 -13.3882 -13.3752 -13.3744 -13.3697 -13.3690 -12.3873 -12.3867 -12.3659 -12.3649 -12.3528 -12.3525 -12.3459 -12.3456 -12.3228 -12.3218 -12.3153 -12.3146 -9.6649 -9.6643 -8.5684 -8.5672 -8.5189 -8.5186 -1.7967 -1.7950 -1.6486 -1.6481 1.1376 1.1402 1.4438 1.4452 4.3355 4.3393 4.7818 4.7860 5.4911 5.4916 6.4697 6.4704 6.7575 6.7611 7.0387 7.0427 10.2656 10.2691 10.5105 10.5152 10.8262 10.8311 12.0567 12.0587 12.2557 12.2567 k = 0.7942-0.4780-1.0391 ( 5164 PWs) bands (ev): -26.7676 -26.7676 -13.4035 -13.4027 -13.3887 -13.3884 -13.3752 -13.3745 -13.3695 -13.3688 -12.3872 -12.3865 -12.3662 -12.3652 -12.3533 -12.3530 -12.3454 -12.3451 -12.3229 -12.3219 -12.3150 -12.3143 -9.6645 -9.6639 -8.5687 -8.5677 -8.5171 -8.5169 -1.8168 -1.8153 -1.6608 -1.6603 1.1258 1.1280 1.4888 1.4898 4.3481 4.3518 4.8040 4.8081 5.4998 5.5004 6.4509 6.4516 6.7415 6.7442 7.1051 7.1082 10.2586 10.2620 10.5368 10.5414 10.8211 10.8257 11.9938 11.9959 12.1801 12.1812 k = 0.7875-0.4645-1.0139 ( 5172 PWs) bands (ev): -26.7677 -26.7677 -13.4034 -13.4026 -13.3890 -13.3886 -13.3753 -13.3747 -13.3693 -13.3687 -12.3870 -12.3863 -12.3665 -12.3656 -12.3539 -12.3536 -12.3449 -12.3447 -12.3231 -12.3221 -12.3147 -12.3140 -9.6640 -9.6633 -8.5690 -8.5680 -8.5152 -8.5151 -1.8401 -1.8387 -1.6764 -1.6760 1.1180 1.1198 1.5367 1.5373 4.3685 4.3721 4.8247 4.8288 5.5121 5.5129 6.4274 6.4282 6.7303 6.7325 7.1721 7.1746 10.2594 10.2626 10.5627 10.5673 10.8195 10.8239 11.9294 11.9316 12.1060 12.1072 k = 0.7808-0.4510-0.9887 ( 5164 PWs) bands (ev): -26.7679 -26.7679 -13.4033 -13.4025 -13.3892 -13.3889 -13.3754 -13.3748 -13.3691 -13.3686 -12.3868 -12.3861 -12.3669 -12.3660 -12.3544 -12.3541 -12.3443 -12.3441 -12.3233 -12.3223 -12.3143 -12.3136 -9.6633 -9.6627 -8.5691 -8.5682 -8.5132 -8.5131 -1.8665 -1.8652 -1.6955 -1.6951 1.1142 1.1157 1.5875 1.5879 4.3965 4.4002 4.8435 4.8477 5.5286 5.5295 6.3994 6.4002 6.7243 6.7261 7.2393 7.2414 10.2680 10.2712 10.5878 10.5925 10.8218 10.8258 11.8653 11.8677 12.0338 12.0353 k = 0.7742-0.4374-0.9635 ( 5162 PWs) bands (ev): -26.7680 -26.7680 -13.4032 -13.4024 -13.3895 -13.3891 -13.3756 -13.3750 -13.3689 -13.3684 -12.3865 -12.3859 -12.3674 -12.3665 -12.3550 -12.3546 -12.3438 -12.3436 -12.3235 -12.3226 -12.3139 -12.3132 -9.6626 -9.6620 -8.5691 -8.5682 -8.5111 -8.5110 -1.8959 -1.8946 -1.7178 -1.7175 1.1142 1.1155 1.6414 1.6417 4.4318 4.4355 4.8602 4.8645 5.5494 5.5505 6.3672 6.3681 6.7234 6.7250 7.3065 7.3083 10.2843 10.2873 10.6116 10.6163 10.8280 10.8317 11.8030 11.8056 11.9639 11.9656 k = 0.7675-0.4239-0.9383 ( 5162 PWs) bands (ev): -26.7683 -26.7683 -13.4031 -13.4023 -13.3898 -13.3894 -13.3757 -13.3752 -13.3687 -13.3683 -12.3863 -12.3857 -12.3679 -12.3670 -12.3555 -12.3551 -12.3433 -12.3431 -12.3237 -12.3228 -12.3135 -12.3128 -9.6617 -9.6611 -8.5689 -8.5680 -8.5089 -8.5089 -1.9280 -1.9269 -1.7434 -1.7431 1.1179 1.1190 1.6987 1.6988 4.4741 4.4779 4.8749 4.8795 5.5749 5.5762 6.3312 6.3320 6.7277 6.7292 7.3733 7.3749 10.3078 10.3107 10.6338 10.6384 10.8381 10.8414 11.7433 11.7461 11.8968 11.8987 k = 0.7608-0.4104-0.9131 ( 5160 PWs) bands (ev): -26.7685 -26.7685 -13.4029 -13.4022 -13.3901 -13.3897 -13.3758 -13.3754 -13.3685 -13.3681 -12.3861 -12.3854 -12.3684 -12.3676 -12.3560 -12.3556 -12.3427 -12.3425 -12.3240 -12.3230 -12.3131 -12.3125 -9.6607 -9.6601 -8.5684 -8.5676 -8.5067 -8.5067 -1.9626 -1.9616 -1.7721 -1.7718 1.1250 1.1259 1.7592 1.7594 4.5229 4.5269 4.8879 4.8927 5.6050 5.6065 6.2917 6.2925 6.7370 6.7384 7.4396 7.4410 10.3380 10.3409 10.6541 10.6586 10.8516 10.8545 11.6871 11.6900 11.8329 11.8351 k = 0.7541-0.3969-0.8879 ( 5168 PWs) bands (ev): -26.7687 -26.7687 -13.4028 -13.4020 -13.3904 -13.3900 -13.3760 -13.3756 -13.3683 -13.3679 -12.3858 -12.3852 -12.3690 -12.3682 -12.3566 -12.3561 -12.3422 -12.3420 -12.3242 -12.3232 -12.3127 -12.3121 -9.6596 -9.6590 -8.5678 -8.5670 -8.5045 -8.5044 -1.9996 -1.9987 -1.8038 -1.8034 1.1352 1.1359 1.8231 1.8234 4.5778 4.5821 4.8995 4.9047 5.6396 5.6413 6.2493 6.2500 6.7512 6.7525 7.5049 7.5062 10.3743 10.3771 10.6726 10.6770 10.8677 10.8701 11.6350 11.6382 11.7730 11.7755 k = 0.7474-0.3834-0.8627 ( 5156 PWs) bands (ev): -26.7690 -26.7690 -13.4026 -13.4019 -13.3907 -13.3903 -13.3762 -13.3758 -13.3681 -13.3677 -12.3856 -12.3849 -12.3696 -12.3688 -12.3570 -12.3566 -12.3417 -12.3414 -12.3244 -12.3234 -12.3123 -12.3117 -9.6584 -9.6578 -8.5670 -8.5662 -8.5022 -8.5021 -2.0386 -2.0379 -1.8381 -1.8377 1.1482 1.1488 1.8904 1.8908 4.6384 4.6430 4.9105 4.9162 5.6783 5.6803 6.2045 6.2051 6.7702 6.7714 7.5692 7.5704 10.4157 10.4185 10.6893 10.6935 10.8850 10.8871 11.5877 11.5912 11.7179 11.7207 k = 0.7407-0.3698-0.8375 ( 5154 PWs) bands (ev): -26.7693 -26.7693 -13.4025 -13.4018 -13.3910 -13.3907 -13.3764 -13.3760 -13.3679 -13.3676 -12.3853 -12.3847 -12.3702 -12.3694 -12.3575 -12.3571 -12.3411 -12.3409 -12.3245 -12.3236 -12.3120 -12.3114 -9.6570 -9.6565 -8.5660 -8.5652 -8.4999 -8.4997 -2.0795 -2.0788 -1.8750 -1.8744 1.1635 1.1640 1.9610 1.9615 4.7039 4.7092 4.9218 4.9282 5.7207 5.7230 6.1580 6.1584 6.7937 6.7949 7.6322 7.6333 10.4612 10.4639 10.7042 10.7084 10.9021 10.9040 11.5458 11.5496 11.6685 11.6718 k = 0.7340-0.3563-0.8123 ( 5150 PWs) bands (ev): -26.7697 -26.7697 -13.4024 -13.4016 -13.3914 -13.3910 -13.3766 -13.3763 -13.3676 -13.3674 -12.3851 -12.3844 -12.3708 -12.3700 -12.3580 -12.3575 -12.3406 -12.3403 -12.3247 -12.3238 -12.3116 -12.3110 -9.6556 -9.6550 -8.5647 -8.5639 -8.4976 -8.4973 -2.1218 -2.1212 -1.9140 -1.9134 1.1808 1.1813 2.0348 2.0354 4.7733 4.7796 4.9344 4.9420 5.7662 5.7690 6.1104 6.1108 6.8216 6.8227 7.6936 7.6946 10.5095 10.5122 10.7174 10.7216 10.9176 10.9194 11.5100 11.5142 11.6260 11.6298 k = 0.7273-0.3428-0.7871 ( 5154 PWs) bands (ev): -26.7700 -26.7700 -13.4022 -13.4015 -13.3917 -13.3913 -13.3768 -13.3765 -13.3674 -13.3672 -12.3848 -12.3842 -12.3714 -12.3707 -12.3585 -12.3580 -12.3401 -12.3398 -12.3249 -12.3240 -12.3113 -12.3107 -9.6540 -9.6535 -8.5633 -8.5625 -8.4952 -8.4949 -2.1655 -2.1649 -1.9550 -1.9543 1.1998 1.2001 2.1117 2.1124 4.8439 4.8522 4.9509 4.9607 5.8136 5.8173 6.0626 6.0639 6.8536 6.8547 7.7532 7.7541 10.5587 10.5615 10.7284 10.7327 10.9300 10.9318 11.4814 11.4859 11.5915 11.5959 k = 0.7207-0.3293-0.7619 ( 5148 PWs) bands (ev): -26.7704 -26.7704 -13.4021 -13.4014 -13.3920 -13.3916 -13.3770 -13.3768 -13.3672 -13.3670 -12.3846 -12.3839 -12.3720 -12.3713 -12.3590 -12.3584 -12.3396 -12.3392 -12.3250 -12.3241 -12.3110 -12.3104 -9.6524 -9.6518 -8.5618 -8.5610 -8.4927 -8.4924 -2.2100 -2.2095 -1.9976 -1.9969 1.2199 1.2202 2.1915 2.1923 4.9075 4.9174 4.9811 4.9926 5.8600 5.8658 6.0173 6.0207 6.8895 6.8906 7.8108 7.8116 10.6065 10.6098 10.7366 10.7416 10.9385 10.9406 11.4608 11.4655 11.5659 11.5707 k = 0.7140-0.3158-0.7367 ( 5152 PWs) bands (ev): -26.7708 -26.7708 -13.4020 -13.4013 -13.3923 -13.3919 -13.3772 -13.3771 -13.3670 -13.3668 -12.3844 -12.3837 -12.3726 -12.3720 -12.3594 -12.3589 -12.3391 -12.3387 -12.3251 -12.3242 -12.3108 -12.3102 -9.6506 -9.6500 -8.5601 -8.5592 -8.4902 -8.4899 -2.2554 -2.2549 -2.0417 -2.0408 1.2408 1.2410 2.2739 2.2748 4.9506 4.9561 5.0441 5.0516 5.8926 5.9032 5.9859 5.9941 6.9292 6.9302 7.8662 7.8669 10.6494 10.6543 10.7411 10.7482 10.9429 10.9454 11.4496 11.4541 11.5496 11.5547 k = 0.7073-0.3022-0.7115 ( 5150 PWs) bands (ev): -26.7712 -26.7712 -13.4019 -13.4012 -13.3926 -13.3922 -13.3775 -13.3773 -13.3668 -13.3666 -12.3842 -12.3835 -12.3732 -12.3726 -12.3599 -12.3593 -12.3386 -12.3382 -12.3251 -12.3243 -12.3105 -12.3100 -9.6487 -9.6482 -8.5583 -8.5574 -8.4876 -8.4873 -2.3012 -2.3006 -2.0869 -2.0859 1.2621 1.2622 2.3587 2.3596 4.9797 4.9816 5.1271 5.1311 5.8824 5.8920 6.0064 6.0138 6.9723 6.9733 7.9193 7.9200 10.6816 10.6906 10.7425 10.7543 10.9441 10.9472 11.4485 11.4527 11.5422 11.5474 k = 0.7006-0.2887-0.6862 ( 5148 PWs) bands (ev): -26.7716 -26.7716 -13.4018 -13.4011 -13.3929 -13.3925 -13.3778 -13.3776 -13.3665 -13.3664 -12.3840 -12.3833 -12.3738 -12.3731 -12.3604 -12.3598 -12.3382 -12.3377 -12.3251 -12.3243 -12.3103 -12.3098 -9.6468 -9.6462 -8.5563 -8.5554 -8.4849 -8.4845 -2.3472 -2.3466 -2.1329 -2.1319 1.2834 1.2835 2.4455 2.4464 5.0065 5.0069 5.2167 5.2192 5.8462 5.8533 6.0583 6.0632 7.0187 7.0196 7.9701 7.9707 10.6949 10.7082 10.7474 10.7642 10.9435 10.9472 11.4579 11.4616 11.5429 11.5479 k = 0.6939-0.2752-0.6610 ( 5156 PWs) bands (ev): -26.7721 -26.7721 -13.4017 -13.4011 -13.3932 -13.3928 -13.3780 -13.3779 -13.3663 -13.3662 -12.3839 -12.3832 -12.3743 -12.3737 -12.3609 -12.3603 -12.3377 -12.3372 -12.3251 -12.3243 -12.3101 -12.3096 -9.6448 -9.6442 -8.5543 -8.5534 -8.4821 -8.4817 -2.3933 -2.3926 -2.1796 -2.1785 1.3044 1.3045 2.5338 2.5349 5.0346 5.0359 5.3096 5.3115 5.8062 5.8123 6.1173 6.1211 7.0680 7.0689 8.0185 8.0190 10.6882 10.7007 10.7591 10.7757 10.9425 10.9467 11.4763 11.4795 11.5501 11.5549 k = 0.6872-0.2617-0.6358 ( 5154 PWs) bands (ev): -26.7725 -26.7725 -13.4016 -13.4011 -13.3934 -13.3930 -13.3783 -13.3782 -13.3661 -13.3660 -12.3838 -12.3831 -12.3748 -12.3742 -12.3614 -12.3608 -12.3372 -12.3367 -12.3251 -12.3242 -12.3100 -12.3095 -9.6427 -9.6422 -8.5523 -8.5513 -8.4792 -8.4788 -2.4391 -2.4384 -2.2266 -2.2254 1.3248 1.3250 2.6233 2.6244 5.0664 5.0685 5.4036 5.4053 5.7688 5.7745 6.1792 6.1825 7.1201 7.1210 8.0645 8.0649 10.6684 10.6800 10.7642 10.7804 10.9419 10.9462 11.4999 11.5026 11.5624 11.5668 k = 0.6805-0.2482-0.6106 ( 5156 PWs) bands (ev): -26.7730 -26.7730 -13.4016 -13.4010 -13.3936 -13.3932 -13.3786 -13.3786 -13.3659 -13.3658 -12.3837 -12.3830 -12.3752 -12.3747 -12.3619 -12.3613 -12.3368 -12.3362 -12.3250 -12.3242 -12.3099 -12.3094 -9.6406 -9.6401 -8.5502 -8.5492 -8.4761 -8.4757 -2.4846 -2.4838 -2.2737 -2.2724 1.3444 1.3445 2.7134 2.7146 5.1026 5.1053 5.4951 5.4966 5.7390 5.7447 6.2431 6.2461 7.1747 7.1756 8.1083 8.1086 10.6402 10.6520 10.7575 10.7744 10.9408 10.9450 11.5215 11.5234 11.5774 11.5808 k = 0.6739-0.2346-0.5854 ( 5154 PWs) bands (ev): -26.7735 -26.7735 -13.4016 -13.4011 -13.3937 -13.3934 -13.3789 -13.3789 -13.3657 -13.3656 -12.3837 -12.3829 -12.3757 -12.3752 -12.3625 -12.3618 -12.3363 -12.3357 -12.3248 -12.3240 -12.3098 -12.3093 -9.6385 -9.6379 -8.5481 -8.5471 -8.4729 -8.4725 -2.5296 -2.5287 -2.3208 -2.3194 1.3628 1.3630 2.8036 2.8048 5.1435 5.1468 5.5714 5.5731 5.7299 5.7356 6.3086 6.3113 7.2315 7.2324 8.1500 8.1503 10.6060 10.6189 10.7390 10.7571 10.9375 10.9416 11.5316 11.5330 11.5916 11.5939 k = 0.6672-0.2211-0.5602 ( 5160 PWs) bands (ev): -26.7740 -26.7740 -13.4016 -13.4011 -13.3938 -13.3935 -13.3793 -13.3792 -13.3656 -13.3655 -12.3836 -12.3828 -12.3760 -12.3756 -12.3630 -12.3623 -12.3359 -12.3353 -12.3246 -12.3239 -12.3097 -12.3093 -9.6363 -9.6357 -8.5461 -8.5451 -8.4695 -8.4692 -2.5738 -2.5728 -2.3675 -2.3660 1.3800 1.3802 2.8931 2.8943 5.1893 5.1932 5.6026 5.6057 5.7718 5.7766 6.3752 6.3779 7.2903 7.2911 8.1899 8.1902 10.5676 10.5820 10.7098 10.7295 10.9301 10.9341 11.5245 11.5261 11.6062 11.6076 k = 0.6605-0.2076-0.5350 ( 5166 PWs) bands (ev): -26.7745 -26.7745 -13.4016 -13.4012 -13.3939 -13.3936 -13.3796 -13.3796 -13.3654 -13.3653 -12.3837 -12.3828 -12.3764 -12.3760 -12.3636 -12.3629 -12.3354 -12.3348 -12.3244 -12.3237 -12.3097 -12.3093 -9.6341 -9.6336 -8.5441 -8.5431 -8.4660 -8.4656 -2.6172 -2.6161 -2.4138 -2.4122 1.3958 1.3960 2.9812 2.9825 5.2401 5.2447 5.5978 5.6022 5.8562 5.8602 6.4429 6.4455 7.3507 7.3515 8.2284 8.2287 10.5257 10.5421 10.6716 10.6931 10.9170 10.9210 11.5057 11.5076 11.6230 11.6240 k = 0.6538-0.1941-0.5098 ( 5166 PWs) bands (ev): -26.7750 -26.7750 -13.4017 -13.4013 -13.3940 -13.3937 -13.3799 -13.3799 -13.3652 -13.3651 -12.3837 -12.3828 -12.3767 -12.3763 -12.3642 -12.3634 -12.3350 -12.3344 -12.3242 -12.3234 -12.3097 -12.3093 -9.6319 -9.6314 -8.5422 -8.5412 -8.4623 -8.4619 -2.6595 -2.6584 -2.4593 -2.4576 1.4101 1.4103 3.0672 3.0685 5.2957 5.3012 5.5867 5.5921 5.9537 5.9575 6.5113 6.5139 7.4125 7.4132 8.2659 8.2661 10.4807 10.4997 10.6258 10.6495 10.8973 10.9013 11.4828 11.4846 11.6414 11.6421 k = 0.6471-0.1806-0.4846 ( 5172 PWs) bands (ev): -26.7755 -26.7755 -13.4017 -13.4014 -13.3940 -13.3937 -13.3803 -13.3803 -13.3650 -13.3649 -12.3837 -12.3829 -12.3769 -12.3766 -12.3648 -12.3640 -12.3346 -12.3340 -12.3239 -12.3232 -12.3098 -12.3093 -9.6297 -9.6292 -8.5404 -8.5394 -8.4584 -8.4581 -2.7008 -2.6995 -2.5040 -2.5023 1.4228 1.4231 3.1500 3.1513 5.3560 5.3628 5.5793 5.5859 6.0548 6.0586 6.5804 6.5829 7.4753 7.4761 8.3028 8.3030 10.4327 10.4546 10.5743 10.6005 10.8705 10.8747 11.4587 11.4604 11.6605 11.6611 k = 0.6404-0.1670-0.4594 ( 5176 PWs) bands (ev): -26.7760 -26.7760 -13.4018 -13.4015 -13.3940 -13.3937 -13.3807 -13.3806 -13.3649 -13.3648 -12.3838 -12.3829 -12.3772 -12.3769 -12.3654 -12.3646 -12.3342 -12.3336 -12.3236 -12.3229 -12.3098 -12.3094 -9.6276 -9.6270 -8.5387 -8.5378 -8.4544 -8.4541 -2.7408 -2.7395 -2.5477 -2.5459 1.4340 1.4343 3.2289 3.2302 5.4202 5.4291 5.5790 5.5876 6.1564 6.1603 6.6499 6.6524 7.5390 7.5397 8.3395 8.3399 10.3812 10.4062 10.5192 10.5480 10.8369 10.8414 11.4343 11.4357 11.6800 11.6805 k = 0.6337-0.1535-0.4342 ( 5164 PWs) bands (ev): -26.7765 -26.7765 -13.4019 -13.4017 -13.3939 -13.3937 -13.3810 -13.3810 -13.3647 -13.3646 -12.3839 -12.3830 -12.3774 -12.3771 -12.3660 -12.3652 -12.3338 -12.3331 -12.3232 -12.3225 -12.3099 -12.3095 -9.6254 -9.6249 -8.5371 -8.5362 -8.4502 -8.4499 -2.7795 -2.7781 -2.5902 -2.5883 1.4436 1.4439 3.3028 3.3041 5.4868 5.4994 5.5884 5.6005 6.2570 6.2611 6.7196 6.7220 7.6031 7.6038 8.3767 8.3772 10.3257 10.3532 10.4626 10.4935 10.7971 10.8020 11.4092 11.4106 11.6994 11.6998 k = 0.6270-0.1400-0.4090 ( 5158 PWs) bands (ev): -26.7770 -26.7770 -13.4021 -13.4018 -13.3938 -13.3937 -13.3814 -13.3814 -13.3646 -13.3645 -12.3840 -12.3831 -12.3775 -12.3773 -12.3666 -12.3659 -12.3334 -12.3328 -12.3228 -12.3222 -12.3100 -12.3096 -9.6234 -9.6228 -8.5357 -8.5348 -8.4459 -8.4456 -2.8168 -2.8152 -2.6314 -2.6295 1.4517 1.4520 3.3709 3.3721 5.5509 5.5693 5.6127 5.6306 6.3555 6.3597 6.7892 6.7917 7.6675 7.6681 8.4147 8.4153 10.2655 10.2944 10.4066 10.4384 10.7525 10.7579 11.3832 11.3848 11.7183 11.7187 k = 0.6204-0.1265-0.3838 ( 5156 PWs) bands (ev): -26.7775 -26.7775 -13.4022 -13.4020 -13.3937 -13.3936 -13.3818 -13.3818 -13.3644 -13.3643 -12.3841 -12.3832 -12.3776 -12.3774 -12.3673 -12.3665 -12.3330 -12.3324 -12.3224 -12.3218 -12.3101 -12.3097 -9.6213 -9.6208 -8.5344 -8.5335 -8.4415 -8.4413 -2.8525 -2.8509 -2.6712 -2.6692 1.4584 1.4587 3.4324 3.4336 5.6055 5.6209 5.6708 5.6855 6.4509 6.4553 6.8585 6.8610 7.7316 7.7322 8.4537 8.4545 10.2009 10.2298 10.3517 10.3830 10.7047 10.7107 11.3559 11.3579 11.7363 11.7367 k = 0.6137-0.1130-0.3586 ( 5160 PWs) bands (ev): -26.7779 -26.7779 -13.4024 -13.4022 -13.3936 -13.3935 -13.3822 -13.3822 -13.3643 -13.3642 -12.3842 -12.3833 -12.3778 -12.3776 -12.3679 -12.3671 -12.3326 -12.3320 -12.3220 -12.3214 -12.3102 -12.3099 -9.6194 -9.6189 -8.5332 -8.5324 -8.4371 -8.4368 -2.8867 -2.8850 -2.7095 -2.7074 1.4637 1.4641 3.4869 3.4880 5.6556 5.6649 5.7522 5.7606 6.5424 6.5470 6.9272 6.9297 7.7953 7.7960 8.4939 8.4950 10.1324 10.1605 10.2969 10.3268 10.6559 10.6624 11.3274 11.3300 11.7529 11.7534 k = 0.6070-0.0994-0.3334 ( 5162 PWs) bands (ev): -26.7784 -26.7784 -13.4025 -13.4024 -13.3935 -13.3933 -13.3826 -13.3826 -13.3641 -13.3641 -12.3843 -12.3834 -12.3778 -12.3777 -12.3685 -12.3678 -12.3323 -12.3317 -12.3216 -12.3210 -12.3104 -12.3100 -9.6175 -9.6170 -8.5321 -8.5314 -8.4326 -8.4324 -2.9192 -2.9175 -2.7460 -2.7440 1.4679 1.4682 3.5339 3.5350 5.7113 5.7175 5.8406 5.8457 6.6290 6.6339 6.9948 6.9975 7.8582 7.8590 8.5348 8.5363 10.0613 10.0884 10.2406 10.2687 10.6082 10.6153 11.2981 11.3012 11.7677 11.7684 k = 0.6003-0.0859-0.3082 ( 5166 PWs) bands (ev): -26.7789 -26.7789 -13.4027 -13.4026 -13.3933 -13.3932 -13.3830 -13.3830 -13.3640 -13.3639 -12.3844 -12.3835 -12.3779 -12.3777 -12.3692 -12.3684 -12.3319 -12.3314 -12.3212 -12.3206 -12.3105 -12.3102 -9.6157 -9.6152 -8.5312 -8.5304 -8.4281 -8.4279 -2.9500 -2.9483 -2.7809 -2.7788 1.4709 1.4712 3.5736 3.5746 5.7764 5.7810 5.9333 5.9366 6.7102 6.7154 7.0611 7.0640 7.9199 7.9209 8.5755 8.5776 9.9892 10.0158 10.1812 10.2078 10.5641 10.5716 11.2682 11.2719 11.7802 11.7813 k = 0.5936-0.0724-0.2829 ( 5174 PWs) bands (ev): -26.7793 -26.7793 -13.4028 -13.4027 -13.3931 -13.3930 -13.3834 -13.3834 -13.3639 -13.3638 -12.3845 -12.3836 -12.3779 -12.3778 -12.3698 -12.3691 -12.3316 -12.3311 -12.3207 -12.3202 -12.3107 -12.3104 -9.6140 -9.6135 -8.5303 -8.5297 -8.4237 -8.4235 -2.9791 -2.9773 -2.8138 -2.8118 1.4730 1.4733 3.6061 3.6071 5.8518 5.8555 6.0295 6.0316 6.7854 6.7909 7.1256 7.1287 7.9801 7.9813 8.6143 8.6171 9.9184 9.9448 10.1181 10.1438 10.5253 10.5332 11.2381 11.2424 11.7895 11.7912 k = 0.5869-0.0589-0.2577 ( 5176 PWs) bands (ev): -26.7797 -26.7797 -13.4030 -13.4029 -13.3929 -13.3928 -13.3838 -13.3838 -13.3638 -13.3637 -12.3845 -12.3836 -12.3780 -12.3778 -12.3704 -12.3697 -12.3313 -12.3308 -12.3203 -12.3198 -12.3108 -12.3106 -9.6123 -9.6119 -8.5296 -8.5290 -8.4193 -8.4192 -3.0063 -3.0046 -2.8449 -2.8429 1.4742 1.4745 3.6321 3.6330 5.9374 5.9406 6.1284 6.1297 6.8542 6.8600 7.1879 7.1912 8.0383 8.0398 8.6482 8.6520 9.8509 9.8778 10.0524 10.0776 10.4931 10.5013 11.2082 11.2131 11.7939 11.7965 k = 0.5802-0.0454-0.2325 ( 5178 PWs) bands (ev): -26.7801 -26.7801 -13.4031 -13.4031 -13.3927 -13.3926 -13.3842 -13.3842 -13.3637 -13.3636 -12.3846 -12.3837 -12.3780 -12.3779 -12.3710 -12.3703 -12.3310 -12.3305 -12.3199 -12.3194 -12.3110 -12.3108 -9.6108 -9.6104 -8.5289 -8.5284 -8.4151 -8.4150 -3.0317 -3.0300 -2.8739 -2.8719 1.4748 1.4750 3.6521 3.6529 6.0326 6.0355 6.2293 6.2303 6.9164 6.9226 7.2475 7.2510 8.0940 8.0960 8.6732 8.6781 9.7886 9.8163 9.9874 10.0124 10.4680 10.4763 11.1789 11.1843 11.7899 11.7938 k = 0.5736-0.0318-0.2073 ( 5180 PWs) bands (ev): -26.7805 -26.7805 -13.4033 -13.4032 -13.3924 -13.3924 -13.3846 -13.3846 -13.3636 -13.3635 -12.3846 -12.3838 -12.3780 -12.3779 -12.3716 -12.3709 -12.3308 -12.3303 -12.3195 -12.3190 -12.3112 -12.3110 -9.6094 -9.6091 -8.5284 -8.5278 -8.4110 -8.4110 -3.0551 -3.0535 -2.9008 -2.8989 1.4747 1.4750 3.6671 3.6678 6.1365 6.1391 6.3314 6.3326 6.9721 6.9787 7.3039 7.3078 8.1466 8.1493 8.6842 8.6904 9.7315 9.7592 9.9304 9.9547 10.4500 10.4582 11.1504 11.1563 11.7710 11.7750 k = 0.5669-0.0183-0.1821 ( 5180 PWs) bands (ev): -26.7808 -26.7808 -13.4034 -13.4034 -13.3922 -13.3921 -13.3850 -13.3850 -13.3635 -13.3634 -12.3846 -12.3838 -12.3780 -12.3779 -12.3721 -12.3715 -12.3305 -12.3301 -12.3190 -12.3186 -12.3114 -12.3112 -9.6081 -9.6078 -8.5279 -8.5274 -8.4072 -8.4071 -3.0767 -3.0751 -2.9256 -2.9238 1.4742 1.4745 3.6777 3.6784 6.2481 6.2504 6.4338 6.4357 7.0215 7.0286 7.3567 7.3608 8.1952 8.1988 8.6764 8.6840 9.6759 9.7006 9.8935 9.9145 10.4389 10.4471 11.1228 11.1292 11.7290 11.7315 k = 0.5602-0.0048-0.1569 ( 5174 PWs) bands (ev): -26.7811 -26.7811 -13.4035 -13.4035 -13.3919 -13.3919 -13.3854 -13.3854 -13.3634 -13.3634 -12.3846 -12.3839 -12.3779 -12.3779 -12.3727 -12.3721 -12.3303 -12.3299 -12.3187 -12.3183 -12.3115 -12.3114 -9.6069 -9.6066 -8.5275 -8.5270 -8.4036 -8.4035 -3.0962 -3.0947 -2.9482 -2.9464 1.4734 1.4737 3.6849 3.6855 6.3662 6.3683 6.5357 6.5387 7.0651 7.0728 7.4053 7.4097 8.2387 8.2438 8.6468 8.6560 9.6155 9.6345 9.8872 9.9025 10.4346 10.4426 11.0962 11.1031 11.6626 11.6692 k = 0.5535 0.0087-0.1317 ( 5178 PWs) bands (ev): -26.7814 -26.7814 -13.4037 -13.4036 -13.3916 -13.3916 -13.3858 -13.3858 -13.3633 -13.3633 -12.3846 -12.3839 -12.3779 -12.3778 -12.3732 -12.3726 -12.3301 -12.3297 -12.3183 -12.3179 -12.3117 -12.3116 -9.6059 -9.6056 -8.5271 -8.5267 -8.4003 -8.4002 -3.1138 -3.1124 -2.9685 -2.9669 1.4724 1.4726 3.6893 3.6898 6.4895 6.4917 6.6356 6.6404 7.1036 7.1121 7.4493 7.4540 8.2751 8.2826 8.5957 8.6070 9.5486 9.5621 9.9118 9.9222 10.4370 10.4447 11.0705 11.0778 11.5837 11.5940 k = 0.5468 0.0222-0.1065 ( 5180 PWs) bands (ev): -26.7817 -26.7817 -13.4038 -13.4038 -13.3913 -13.3913 -13.3863 -13.3862 -13.3633 -13.3632 -12.3846 -12.3840 -12.3779 -12.3778 -12.3736 -12.3731 -12.3299 -12.3296 -12.3179 -12.3176 -12.3118 -12.3118 -9.6049 -9.6047 -8.5268 -8.5265 -8.3972 -8.3972 -3.1294 -3.1281 -2.9865 -2.9850 1.4713 1.4715 3.6918 3.6922 6.6161 6.6193 6.7321 6.7398 7.1378 7.1473 7.4881 7.4931 8.3004 8.3122 8.5276 8.5428 9.4785 9.4880 9.9614 9.9687 10.4460 10.4533 11.0454 11.0532 11.4999 11.5120 k = 0.5401 0.0358-0.0813 ( 5182 PWs) bands (ev): -26.7819 -26.7819 -13.4039 -13.4039 -13.3910 -13.3910 -13.3867 -13.3866 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3740 -12.3736 -12.3298 -12.3295 -12.3176 -12.3173 -12.3120 -12.3119 -9.6041 -9.6039 -8.5265 -8.5262 -8.3946 -8.3945 -3.1429 -3.1417 -3.0022 -3.0009 1.4701 1.4703 3.6927 3.6931 6.7428 6.7498 6.8230 6.8366 7.1689 7.1798 7.5215 7.5267 8.3031 8.3218 8.4563 8.4778 9.4098 9.4165 10.0289 10.0344 10.4618 10.4687 11.0203 11.0284 11.4150 11.4274 k = 0.5334 0.0493-0.0561 ( 5186 PWs) bands (ev): -26.7821 -26.7821 -13.4039 -13.4039 -13.3907 -13.3907 -13.3871 -13.3870 -13.3632 -13.3631 -12.3845 -12.3840 -12.3778 -12.3777 -12.3744 -12.3740 -12.3296 -12.3294 -12.3174 -12.3171 -12.3121 -12.3121 -9.6034 -9.6032 -8.5263 -8.5261 -8.3922 -8.3922 -3.1543 -3.1533 -3.0154 -3.0143 1.4689 1.4691 3.6928 3.6931 6.8611 6.8785 6.9084 6.9346 7.1987 7.2112 7.5492 7.5544 8.2588 8.2770 8.4193 8.4395 9.3463 9.3512 10.1073 10.1117 10.4848 10.4911 10.9943 11.0026 11.3317 11.3433 k = 0.5267 0.0628-0.0309 ( 5184 PWs) bands (ev): -26.7822 -26.7822 -13.4040 -13.4040 -13.3904 -13.3904 -13.3874 -13.3874 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3747 -12.3743 -12.3295 -12.3293 -12.3171 -12.3169 -12.3122 -12.3122 -9.6028 -9.6026 -8.5262 -8.5260 -8.3903 -8.3903 -3.1636 -3.1628 -3.0263 -3.0254 1.4679 1.4681 3.6923 3.6925 6.9540 6.9683 7.0194 7.0449 7.2294 7.2437 7.5714 7.5766 8.1689 8.1804 8.4175 8.4304 9.2912 9.2948 10.1894 10.1929 10.5158 10.5212 10.9658 10.9739 11.2524 11.2622 k = 0.5201 0.0763-0.0057 ( 5186 PWs) bands (ev): -26.7824 -26.7824 -13.4041 -13.4041 -13.3901 -13.3901 -13.3878 -13.3878 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3749 -12.3747 -12.3294 -12.3293 -12.3169 -12.3167 -12.3123 -12.3123 -9.6023 -9.6022 -8.5260 -8.5259 -8.3888 -8.3888 -3.1709 -3.1703 -3.0348 -3.0341 1.4671 1.4672 3.6916 3.6918 7.0174 7.0237 7.1420 7.1614 7.2654 7.2810 7.5894 7.5942 8.0584 8.0659 8.4213 8.4294 9.2469 9.2494 10.2669 10.2696 10.5564 10.5604 10.9326 10.9397 11.1800 11.1877 k = 0.5134 0.0898 0.0195 ( 5192 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3897 -13.3897 -13.3882 -13.3882 -13.3631 -13.3631 -12.3843 -12.3841 -12.3776 -12.3776 -12.3751 -12.3749 -12.3293 -12.3292 -12.3168 -12.3166 -12.3124 -12.3124 -9.6020 -9.6019 -8.5259 -8.5258 -8.3877 -8.3877 -3.1761 -3.1757 -3.0408 -3.0403 1.4665 1.4665 3.6909 3.6910 7.0583 7.0610 7.2391 7.2493 7.3245 7.3348 7.6068 7.6115 7.9411 7.9458 8.4235 8.4285 9.2148 9.2164 10.3305 10.3322 10.6075 10.6099 10.8919 10.8974 11.1199 11.1253 k = 0.5067 0.1034 0.0447 ( 5216 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3894 -13.3894 -13.3886 -13.3886 -13.3631 -13.3631 -12.3843 -12.3842 -12.3776 -12.3776 -12.3752 -12.3751 -12.3293 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6018 -9.6018 -8.5259 -8.5258 -8.3870 -8.3870 -3.1791 -3.1789 -3.0444 -3.0441 1.4661 1.4661 3.6904 3.6905 7.0809 7.0819 7.2847 7.2858 7.4035 7.4090 7.6348 7.6393 7.8277 7.8297 8.4245 8.4268 9.1956 9.1964 10.3716 10.3725 10.6647 10.6654 10.8446 10.8478 11.0800 11.0829 k = 0.5000 0.1169 0.0699 ( 5210 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.1801 -3.1801 -3.0455 -3.0455 1.4660 1.4660 3.6903 3.6903 7.0883 7.0883 7.2965 7.2965 7.4418 7.4418 7.6734 7.6734 7.7562 7.7562 8.4254 8.4254 9.1895 9.1895 10.3860 10.3860 10.6991 10.6991 10.8153 10.8153 11.0670 11.0670 k = 0.5000 0.1169 0.0699 ( 5210 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.1801 -3.1801 -3.0455 -3.0455 1.4660 1.4660 3.6903 3.6903 7.0883 7.0883 7.2965 7.2965 7.4418 7.4418 7.6734 7.6734 7.7562 7.7562 8.4254 8.4254 9.1895 9.1895 10.3860 10.3860 10.6991 10.6991 10.8153 10.8153 11.0670 11.0670 k = 0.4722 0.1104 0.0661 ( 5201 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.1853 -3.1853 -3.0397 -3.0397 1.4631 1.4631 3.6953 3.6953 7.0881 7.0881 7.2967 7.2967 7.4404 7.4404 7.6612 7.6612 7.7561 7.7561 8.4369 8.4369 9.1895 9.1895 10.3794 10.3794 10.6916 10.6917 10.8203 10.8203 11.0737 11.0737 k = 0.4444 0.1039 0.0622 ( 5189 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.1990 -3.1990 -3.0247 -3.0247 1.4547 1.4547 3.7101 3.7101 7.0873 7.0873 7.2972 7.2972 7.4353 7.4353 7.6278 7.6278 7.7557 7.7557 8.4692 8.4692 9.1895 9.1895 10.3609 10.3609 10.6706 10.6708 10.8343 10.8343 11.0935 11.0935 k = 0.4167 0.0974 0.0583 ( 5194 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.2172 -3.2172 -3.0042 -3.0042 1.4411 1.4411 3.7342 3.7342 7.0859 7.0859 7.2980 7.2980 7.4233 7.4233 7.5825 7.5825 7.7551 7.7551 8.5164 8.5164 9.1897 9.1897 10.3334 10.3334 10.6399 10.6401 10.8553 10.8553 11.1254 11.1254 k = 0.3889 0.0909 0.0544 ( 5194 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.2374 -3.2374 -2.9809 -2.9809 1.4229 1.4229 3.7670 3.7670 7.0833 7.0833 7.2992 7.2992 7.3968 7.3968 7.5393 7.5393 7.7542 7.7542 8.5725 8.5725 9.1899 9.1899 10.3003 10.3003 10.6034 10.6036 10.8815 10.8815 11.1678 11.1678 k = 0.3611 0.0844 0.0505 ( 5185 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5257 -8.5257 -8.3868 -8.3868 -3.2580 -3.2580 -2.9564 -2.9564 1.4010 1.4010 3.8076 3.8076 7.0788 7.0788 7.3006 7.3006 7.3484 7.3484 7.5111 7.5111 7.7531 7.7531 8.6329 8.6329 9.1903 9.1903 10.2642 10.2642 10.5639 10.5641 10.9121 10.9121 11.2188 11.2188 k = 0.3333 0.0779 0.0466 ( 5191 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5257 -8.5257 -8.3868 -8.3868 -3.2785 -3.2785 -2.9315 -2.9315 1.3761 1.3761 3.8547 3.8547 7.0702 7.0702 7.2846 7.2846 7.3022 7.3022 7.4972 7.4972 7.7518 7.7518 8.6942 8.6942 9.1908 9.1908 10.2271 10.2271 10.5238 10.5240 10.9468 10.9468 11.2763 11.2763 k = 0.3056 0.0714 0.0427 ( 5179 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5257 -8.5257 -8.3868 -8.3868 -3.2981 -3.2981 -2.9068 -2.9068 1.3492 1.3492 3.9071 3.9071 7.0523 7.0523 7.2200 7.2200 7.3040 7.3040 7.4907 7.4907 7.7503 7.7504 8.7540 8.7540 9.1917 9.1917 10.1904 10.1904 10.4843 10.4845 10.9859 10.9859 11.3383 11.3383 k = 0.2778 0.0649 0.0389 ( 5182 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5256 -8.5256 -8.3868 -8.3868 -3.3167 -3.3167 -2.8829 -2.8829 1.3213 1.3213 3.9637 3.9637 7.0149 7.0149 7.1706 7.1706 7.3059 7.3059 7.4875 7.4875 7.7488 7.7488 8.8106 8.8106 9.1930 9.1930 10.1551 10.1551 10.4465 10.4467 11.0295 11.0295 11.4033 11.4033 k = 0.2500 0.0584 0.0350 ( 5179 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5256 -8.5256 -8.3868 -8.3868 -3.3339 -3.3339 -2.8601 -2.8601 1.2932 1.2932 4.0228 4.0228 6.9545 6.9545 7.1436 7.1436 7.3079 7.3079 7.4860 7.4860 7.7472 7.7472 8.8628 8.8628 9.1949 9.1949 10.1218 10.1218 10.4110 10.4112 11.0779 11.0779 11.4695 11.4695 k = 0.2222 0.0519 0.0311 ( 5176 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5256 -8.5256 -8.3868 -8.3868 -3.3497 -3.3497 -2.8387 -2.8387 1.2657 1.2657 4.0831 4.0831 6.8814 6.8814 7.1309 7.1309 7.3100 7.3100 7.4854 7.4854 7.7456 7.7456 8.9095 8.9095 9.1974 9.1974 10.0911 10.0911 10.3784 10.3786 11.1310 11.1310 11.5354 11.5354 k = 0.1944 0.0455 0.0272 ( 5164 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5255 -8.5255 -8.3868 -8.3868 -3.3639 -3.3639 -2.8190 -2.8190 1.2397 1.2397 4.1429 4.1429 6.8055 6.8055 7.1245 7.1245 7.3120 7.3120 7.4853 7.4853 7.7440 7.7440 8.9502 8.9502 9.2008 9.2008 10.0634 10.0634 10.3490 10.3492 11.1887 11.1887 11.5992 11.5992 k = 0.1667 0.0390 0.0233 ( 5143 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5255 -8.5255 -8.3868 -8.3868 -3.3763 -3.3763 -2.8013 -2.8013 1.2157 1.2157 4.2005 4.2005 6.7321 6.7321 7.1209 7.1209 7.3138 7.3138 7.4855 7.4855 7.7425 7.7425 8.9844 8.9844 9.2051 9.2051 10.0390 10.0390 10.3231 10.3232 11.2507 11.2507 11.6588 11.6588 k = 0.1389 0.0325 0.0194 ( 5137 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5255 -8.5255 -8.3868 -8.3868 -3.3870 -3.3870 -2.7859 -2.7859 1.1944 1.1944 4.2540 4.2540 6.6644 6.6644 7.1188 7.1188 7.3156 7.3156 7.4858 7.4858 7.7412 7.7412 9.0119 9.0119 9.2102 9.2102 10.0180 10.0180 10.3009 10.3010 11.3165 11.3165 11.7113 11.7113 k = 0.1111 0.0260 0.0155 ( 5137 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.3958 -3.3958 -2.7730 -2.7730 1.1762 1.1762 4.3016 4.3016 6.6049 6.6049 7.1175 7.1175 7.3170 7.3170 7.4862 7.4862 7.7400 7.7400 9.0331 9.0331 9.2158 9.2158 10.0007 10.0007 10.2825 10.2826 11.3855 11.3855 11.7524 11.7524 k = 0.0833 0.0195 0.0117 ( 5146 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4028 -3.4028 -2.7628 -2.7628 1.1617 1.1617 4.3413 4.3413 6.5559 6.5559 7.1167 7.1167 7.3183 7.3183 7.4866 7.4866 7.7390 7.7390 9.0485 9.0485 9.2212 9.2212 9.9871 9.9871 10.2681 10.2681 11.4565 11.4565 11.7752 11.7752 k = 0.0556 0.0130 0.0078 ( 5155 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4077 -3.4077 -2.7553 -2.7553 1.1511 1.1511 4.3713 4.3713 6.5192 6.5192 7.1162 7.1162 7.3192 7.3192 7.4869 7.4869 7.7383 7.7383 9.0587 9.0587 9.2258 9.2258 9.9773 9.9773 10.2577 10.2578 11.5276 11.5276 11.7714 11.7714 k = 0.0278 0.0065 0.0039 ( 5155 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4107 -3.4107 -2.7508 -2.7508 1.1446 1.1446 4.3900 4.3900 6.4965 6.4965 7.1159 7.1159 7.3197 7.3197 7.4870 7.4870 7.7379 7.7379 9.0645 9.0645 9.2289 9.2289 9.9714 9.9714 10.2515 10.2515 11.5945 11.5945 11.7411 11.7411 k = 0.0000 0.0000 0.0000 ( 5167 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4117 -3.4117 -2.7493 -2.7493 1.1425 1.1425 4.3963 4.3963 6.4888 6.4888 7.1158 7.1158 7.3199 7.3199 7.4871 7.4871 7.7377 7.7377 9.0664 9.0664 9.2299 9.2299 9.9695 9.9695 10.2494 10.2494 11.6341 11.6341 11.7124 11.7124 k = 0.0000 0.0000 0.0000 ( 5167 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6016 -9.6016 -8.5254 -8.5254 -8.3868 -8.3868 -3.4117 -3.4117 -2.7493 -2.7493 1.1425 1.1425 4.3963 4.3963 6.4888 6.4888 7.1158 7.1158 7.3199 7.3199 7.4871 7.4871 7.7377 7.7377 9.0664 9.0664 9.2299 9.2299 9.9695 9.9695 10.2494 10.2494 11.6341 11.6341 11.7124 11.7124 k = 0.0067-0.0135-0.0251 ( 5163 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3894 -13.3894 -13.3886 -13.3886 -13.3631 -13.3631 -12.3843 -12.3842 -12.3776 -12.3776 -12.3752 -12.3751 -12.3293 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6016 -8.5254 -8.5254 -8.3870 -8.3870 -3.4104 -3.4104 -2.7485 -2.7484 1.1433 1.1433 4.3930 4.3930 6.4876 6.4883 7.1125 7.1151 7.3176 7.3177 7.4770 7.4789 7.7260 7.7260 9.0730 9.0879 9.2198 9.2381 9.9737 9.9771 10.2529 10.2530 11.6284 11.6302 11.7085 11.7127 k = 0.0133-0.0269-0.0502 ( 5163 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3897 -13.3897 -13.3882 -13.3882 -13.3631 -13.3631 -12.3843 -12.3841 -12.3776 -12.3776 -12.3751 -12.3749 -12.3293 -12.3292 -12.3167 -12.3166 -12.3124 -12.3124 -9.6019 -9.6018 -8.5255 -8.5254 -8.3877 -8.3877 -3.4065 -3.4065 -2.7460 -2.7458 1.1458 1.1458 4.3831 4.3832 6.4845 6.4859 7.1049 7.1105 7.3107 7.3111 7.4482 7.4522 7.6943 7.6944 9.0981 9.1369 9.2056 9.2511 9.9897 9.9963 10.2635 10.2639 11.6135 11.6159 11.7016 11.7085 k = 0.0200-0.0404-0.0753 ( 5161 PWs) bands (ev): -26.7824 -26.7824 -13.4041 -13.4041 -13.3901 -13.3901 -13.3878 -13.3878 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3749 -12.3747 -12.3294 -12.3293 -12.3169 -12.3167 -12.3123 -12.3123 -9.6022 -9.6021 -8.5256 -8.5255 -8.3888 -8.3888 -3.4001 -3.3999 -2.7417 -2.7415 1.1500 1.1500 4.3666 4.3668 6.4787 6.4808 7.0923 7.1020 7.2986 7.3004 7.4016 7.4076 7.6503 7.6506 9.1205 9.1864 9.2073 9.2828 10.0170 10.0268 10.2812 10.2826 11.5886 11.5901 11.6916 11.6987 k = 0.0266-0.0538-0.1004 ( 5161 PWs) bands (ev): -26.7822 -26.7822 -13.4040 -13.4040 -13.3904 -13.3904 -13.3875 -13.3874 -13.3632 -13.3631 -12.3844 -12.3840 -12.3777 -12.3777 -12.3747 -12.3744 -12.3295 -12.3293 -12.3171 -12.3169 -12.3122 -12.3122 -9.6027 -9.6025 -8.5257 -8.5255 -8.3903 -8.3903 -3.3910 -3.3908 -2.7357 -2.7355 1.1558 1.1558 4.3437 4.3439 6.4685 6.4716 7.0736 7.0892 7.2785 7.2854 7.3432 7.3493 7.6006 7.6011 9.1249 9.1657 9.2871 9.3399 10.0544 10.0677 10.3072 10.3103 11.5523 11.5529 11.6776 11.6830 k = 0.0333-0.0673-0.1255 ( 5157 PWs) bands (ev): -26.7821 -26.7821 -13.4040 -13.4039 -13.3907 -13.3907 -13.3871 -13.3871 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3744 -12.3740 -12.3296 -12.3294 -12.3173 -12.3171 -12.3121 -12.3121 -9.6032 -9.6031 -8.5259 -8.5257 -8.3922 -8.3922 -3.3793 -3.3791 -2.7281 -2.7278 1.1631 1.1632 4.3145 4.3148 6.4518 6.4558 7.0471 7.0713 7.2371 7.2617 7.2897 7.2947 7.5478 7.5486 9.1152 9.1423 9.3698 9.4108 10.0998 10.1167 10.3436 10.3490 11.5035 11.5057 11.6587 11.6617 k = 0.0399-0.0808-0.1506 ( 5159 PWs) bands (ev): -26.7819 -26.7819 -13.4039 -13.4039 -13.3910 -13.3910 -13.3867 -13.3867 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3741 -12.3736 -12.3298 -12.3295 -12.3176 -12.3173 -12.3120 -12.3119 -9.6039 -9.6037 -8.5261 -8.5258 -8.3945 -8.3945 -3.3651 -3.3649 -2.7188 -2.7184 1.1719 1.1720 4.2792 4.2795 6.4252 6.4303 7.0115 7.0463 7.1748 7.2127 7.2568 7.2657 7.4917 7.4933 9.0984 9.1177 9.4481 9.4825 10.1486 10.1687 10.3949 10.4025 11.4451 11.4485 11.6339 11.6355 k = 0.0466-0.0942-0.1757 ( 5163 PWs) bands (ev): -26.7817 -26.7817 -13.4038 -13.4038 -13.3913 -13.3913 -13.3863 -13.3862 -13.3633 -13.3633 -12.3846 -12.3840 -12.3779 -12.3778 -12.3736 -12.3731 -12.3299 -12.3296 -12.3179 -12.3176 -12.3118 -12.3117 -9.6048 -9.6045 -8.5264 -8.5261 -8.3972 -8.3971 -3.3484 -3.3481 -2.7077 -2.7073 1.1821 1.1822 4.2380 4.2384 6.3852 6.3911 6.9681 7.0116 7.1181 7.1623 7.2331 7.2418 7.4316 7.4352 9.0778 9.0922 9.5179 9.5480 10.1953 10.2168 10.4651 10.4733 11.3802 11.3845 11.6028 11.6052 k = 0.0533-0.1077-0.2008 ( 5173 PWs) bands (ev): -26.7814 -26.7814 -13.4037 -13.4037 -13.3916 -13.3916 -13.3859 -13.3858 -13.3634 -13.3633 -12.3846 -12.3839 -12.3779 -12.3779 -12.3732 -12.3726 -12.3301 -12.3297 -12.3183 -12.3179 -12.3117 -12.3116 -9.6057 -9.6054 -8.5267 -8.5263 -8.4002 -8.4001 -3.3291 -3.3288 -2.6951 -2.6946 1.1935 1.1936 4.1910 4.1915 6.3286 6.3350 6.9228 6.9690 7.0767 7.1212 7.2080 7.2184 7.3678 7.3749 9.0549 9.0660 9.5780 9.6047 10.2361 10.2570 10.5523 10.5593 11.3141 11.3191 11.5670 11.5702 k = 0.0599-0.1211-0.2259 ( 5171 PWs) bands (ev): -26.7811 -26.7811 -13.4036 -13.4035 -13.3919 -13.3919 -13.3854 -13.3854 -13.3634 -13.3634 -12.3846 -12.3839 -12.3780 -12.3779 -12.3727 -12.3721 -12.3303 -12.3299 -12.3186 -12.3183 -12.3115 -12.3114 -9.6068 -9.6065 -8.5271 -8.5266 -8.4035 -8.4034 -3.3074 -3.3071 -2.6808 -2.6803 1.2061 1.2062 4.1387 4.1393 6.2547 6.2609 6.8815 6.9264 7.0460 7.0866 7.1799 7.1950 7.3009 7.3145 9.0301 9.0388 9.6289 9.6528 10.2707 10.2898 10.6450 10.6496 11.2551 11.2613 11.5275 11.5310 k = 0.0666-0.1346-0.2510 ( 5171 PWs) bands (ev): -26.7808 -26.7808 -13.4034 -13.4034 -13.3922 -13.3921 -13.3850 -13.3850 -13.3635 -13.3634 -12.3846 -12.3838 -12.3780 -12.3779 -12.3722 -12.3716 -12.3305 -12.3301 -12.3190 -12.3186 -12.3113 -12.3112 -9.6080 -9.6076 -8.5275 -8.5270 -8.4070 -8.4070 -3.2832 -3.2829 -2.6650 -2.6644 1.2197 1.2198 4.0813 4.0819 6.1656 6.1713 6.8452 6.8880 7.0199 7.0542 7.1477 7.1723 7.2330 7.2583 9.0035 9.0105 9.6721 9.6935 10.3003 10.3172 10.7214 10.7230 11.2188 11.2268 11.4854 11.4887 k = 0.0732-0.1481-0.2760 ( 5171 PWs) bands (ev): -26.7805 -26.7805 -13.4033 -13.4032 -13.3924 -13.3924 -13.3846 -13.3846 -13.3636 -13.3635 -12.3846 -12.3838 -12.3780 -12.3779 -12.3716 -12.3710 -12.3308 -12.3303 -12.3194 -12.3190 -12.3112 -12.3110 -9.6093 -9.6089 -8.5280 -8.5275 -8.4109 -8.4108 -3.2567 -3.2563 -2.6475 -2.6469 1.2340 1.2341 4.0191 4.0198 6.0651 6.0702 6.8108 6.8518 6.9933 7.0200 7.1118 7.1483 7.1704 7.2117 8.9748 8.9804 9.7092 9.7283 10.3261 10.3409 10.7520 10.7532 11.2246 11.2351 11.4420 11.4447 k = 0.0799-0.1615-0.3011 ( 5167 PWs) bands (ev): -26.7801 -26.7801 -13.4031 -13.4031 -13.3927 -13.3926 -13.3842 -13.3842 -13.3637 -13.3636 -12.3846 -12.3837 -12.3780 -12.3779 -12.3711 -12.3704 -12.3310 -12.3305 -12.3198 -12.3194 -12.3110 -12.3108 -9.6107 -9.6103 -8.5286 -8.5280 -8.4149 -8.4148 -3.2277 -3.2273 -2.6285 -2.6279 1.2489 1.2491 3.9526 3.9534 5.9573 5.9618 6.7732 6.8128 6.9579 6.9835 7.0751 7.0998 7.1435 7.1784 8.9437 8.9482 9.7416 9.7587 10.3491 10.3616 10.7288 10.7312 11.2676 11.2803 11.3989 11.4004 k = 0.0865-0.1750-0.3262 ( 5171 PWs) bands (ev): -26.7797 -26.7797 -13.4030 -13.4029 -13.3929 -13.3928 -13.3838 -13.3838 -13.3638 -13.3637 -12.3845 -12.3836 -12.3780 -12.3779 -12.3705 -12.3698 -12.3313 -12.3308 -12.3203 -12.3198 -12.3108 -12.3106 -9.6122 -9.6118 -8.5292 -8.5286 -8.4191 -8.4190 -3.1965 -3.1961 -2.6081 -2.6073 1.2642 1.2643 3.8820 3.8829 5.8458 5.8497 6.7279 6.7657 6.9101 6.9443 7.0393 7.0507 7.1365 7.1587 8.9100 8.9136 9.7704 9.7855 10.3693 10.3795 10.6724 10.6755 11.3073 11.3230 11.3570 11.3597 k = 0.0932-0.1884-0.3513 ( 5175 PWs) bands (ev): -26.7793 -26.7793 -13.4028 -13.4028 -13.3931 -13.3930 -13.3834 -13.3834 -13.3639 -13.3638 -12.3844 -12.3836 -12.3780 -12.3778 -12.3698 -12.3691 -12.3316 -12.3310 -12.3207 -12.3202 -12.3107 -12.3104 -9.6138 -9.6134 -8.5300 -8.5293 -8.4234 -8.4233 -3.1630 -3.1626 -2.5862 -2.5854 1.2796 1.2797 3.8079 3.8088 5.7331 5.7366 6.6716 6.7063 6.8594 6.8986 7.0023 7.0123 7.1388 7.1521 8.8733 8.8763 9.7961 9.8095 10.3857 10.3934 10.6023 10.6064 11.3034 11.3152 11.3368 11.3404 k = 0.0999-0.2019-0.3764 ( 5175 PWs) bands (ev): -26.7789 -26.7789 -13.4027 -13.4026 -13.3933 -13.3932 -13.3830 -13.3830 -13.3640 -13.3639 -12.3844 -12.3835 -12.3779 -12.3778 -12.3692 -12.3685 -12.3319 -12.3313 -12.3211 -12.3206 -12.3105 -12.3102 -9.6155 -9.6150 -8.5308 -8.5301 -8.4278 -8.4276 -3.1273 -3.1269 -2.5628 -2.5620 1.2948 1.2950 3.7305 3.7315 5.6215 5.6246 6.6042 6.6341 6.8112 6.8493 6.9659 6.9772 7.1489 7.1565 8.8335 8.8360 9.8191 9.8310 10.3935 10.3983 10.5326 10.5397 11.2713 11.2776 11.3275 11.3318 k = 0.1065-0.2154-0.4015 ( 5183 PWs) bands (ev): -26.7785 -26.7785 -13.4025 -13.4024 -13.3935 -13.3933 -13.3826 -13.3826 -13.3641 -13.3640 -12.3843 -12.3834 -12.3779 -12.3777 -12.3686 -12.3679 -12.3322 -12.3316 -12.3216 -12.3210 -12.3103 -12.3100 -9.6173 -9.6168 -8.5318 -8.5310 -8.4323 -8.4321 -3.0895 -3.0891 -2.5382 -2.5373 1.3096 1.3098 3.6503 3.6514 5.5123 5.5152 6.5273 6.5523 6.7647 6.7988 6.9303 6.9421 7.1647 7.1691 8.7907 8.7929 9.8394 9.8499 10.3735 10.3800 10.4854 10.4971 11.2397 11.2444 11.3121 11.3165 k = 0.1132-0.2288-0.4266 ( 5181 PWs) bands (ev): -26.7780 -26.7780 -13.4024 -13.4022 -13.3936 -13.3935 -13.3822 -13.3822 -13.3643 -13.3642 -12.3842 -12.3833 -12.3778 -12.3776 -12.3680 -12.3672 -12.3326 -12.3320 -12.3220 -12.3214 -12.3102 -12.3099 -9.6192 -9.6187 -8.5328 -8.5320 -8.4367 -8.4365 -3.0497 -3.0492 -2.5122 -2.5113 1.3236 1.3238 3.5677 3.5689 5.4069 5.4095 6.4437 6.4645 6.7174 6.7469 6.8952 6.9069 7.1845 7.1871 8.7450 8.7468 9.8562 9.8655 10.3198 10.3266 10.4765 10.4880 11.2130 11.2168 11.2964 11.3007 k = 0.1198-0.2423-0.4517 ( 5175 PWs) bands (ev): -26.7775 -26.7775 -13.4022 -13.4020 -13.3937 -13.3936 -13.3818 -13.3818 -13.3644 -13.3643 -12.3841 -12.3832 -12.3777 -12.3775 -12.3673 -12.3666 -12.3329 -12.3323 -12.3224 -12.3218 -12.3101 -12.3097 -9.6211 -9.6206 -8.5340 -8.5332 -8.4412 -8.4409 -3.0079 -3.0074 -2.4850 -2.4841 1.3365 1.3367 3.4831 3.4843 5.3062 5.3087 6.3557 6.3732 6.6673 6.6926 6.8613 6.8723 7.2067 7.2084 8.6963 8.6980 9.8680 9.8761 10.2569 10.2626 10.4829 10.4926 11.1926 11.1959 11.2835 11.2878 k = 0.1265-0.2557-0.4768 ( 5167 PWs) bands (ev): -26.7770 -26.7770 -13.4021 -13.4019 -13.3939 -13.3937 -13.3814 -13.3814 -13.3645 -13.3644 -12.3840 -12.3831 -12.3776 -12.3774 -12.3667 -12.3659 -12.3333 -12.3327 -12.3228 -12.3222 -12.3100 -12.3096 -9.6231 -9.6226 -8.5354 -8.5345 -8.4455 -8.4453 -2.9642 -2.9637 -2.4566 -2.4557 1.3479 1.3481 3.3968 3.3981 5.2112 5.2135 6.2650 6.2800 6.6134 6.6349 6.8290 6.8390 7.2298 7.2312 8.6450 8.6466 9.8719 9.8787 10.2004 10.2050 10.4918 10.5001 11.1793 11.1823 11.2753 11.2796 k = 0.1331-0.2692-0.5019 ( 5161 PWs) bands (ev): -26.7765 -26.7765 -13.4020 -13.4017 -13.3939 -13.3937 -13.3811 -13.3810 -13.3647 -13.3646 -12.3839 -12.3830 -12.3774 -12.3772 -12.3661 -12.3653 -12.3337 -12.3331 -12.3232 -12.3225 -12.3099 -12.3095 -9.6252 -9.6247 -8.5368 -8.5359 -8.4498 -8.4495 -2.9187 -2.9182 -2.4271 -2.4262 1.3576 1.3578 3.3093 3.3106 5.1224 5.1246 6.1730 6.1861 6.5552 6.5735 6.7984 6.8073 7.2527 7.2540 8.5913 8.5928 9.8636 9.8689 10.1591 10.1625 10.5001 10.5073 11.1736 11.1766 11.2725 11.2769 k = 0.1398-0.2827-0.5270 ( 5157 PWs) bands (ev): -26.7760 -26.7760 -13.4019 -13.4015 -13.3940 -13.3938 -13.3807 -13.3807 -13.3648 -13.3647 -12.3838 -12.3829 -12.3773 -12.3770 -12.3654 -12.3647 -12.3341 -12.3335 -12.3235 -12.3228 -12.3098 -12.3094 -9.6273 -9.6268 -8.5384 -8.5374 -8.4540 -8.4537 -2.8715 -2.8710 -2.3966 -2.3957 1.3651 1.3653 3.2208 3.2222 5.0407 5.0428 6.0805 6.0921 6.4926 6.5082 6.7695 6.7774 7.2743 7.2757 8.5354 8.5369 9.8406 9.8443 10.1378 10.1401 10.5067 10.5130 11.1759 11.1791 11.2755 11.2801 k = 0.1465-0.2961-0.5521 ( 5165 PWs) bands (ev): -26.7755 -26.7755 -13.4018 -13.4014 -13.3940 -13.3937 -13.3803 -13.3803 -13.3650 -13.3649 -12.3837 -12.3829 -12.3770 -12.3767 -12.3648 -12.3641 -12.3345 -12.3339 -12.3238 -12.3231 -12.3097 -12.3093 -9.6295 -9.6289 -8.5401 -8.5391 -8.4580 -8.4577 -2.8228 -2.8223 -2.3652 -2.3643 1.3703 1.3704 3.1318 3.1331 4.9666 4.9686 5.9882 5.9986 6.4258 6.4392 6.7424 6.7493 7.2934 7.2949 8.4777 8.4791 9.8053 9.8080 10.1349 10.1368 10.5115 10.5171 11.1859 11.1894 11.2844 11.2891 k = 0.1531-0.3096-0.5772 ( 5165 PWs) bands (ev): -26.7750 -26.7750 -13.4017 -13.4013 -13.3940 -13.3937 -13.3800 -13.3800 -13.3652 -13.3651 -12.3837 -12.3828 -12.3768 -12.3764 -12.3642 -12.3635 -12.3349 -12.3343 -12.3241 -12.3234 -12.3097 -12.3092 -9.6316 -9.6311 -8.5419 -8.5409 -8.4619 -8.4615 -2.7726 -2.7721 -2.3330 -2.3320 1.3727 1.3728 3.0425 3.0438 4.9006 4.9024 5.8966 5.9062 6.3553 6.3670 6.7169 6.7230 7.3091 7.3107 8.4183 8.4197 9.7642 9.7665 10.1453 10.1474 10.5148 10.5199 11.2034 11.2074 11.2989 11.3040 k = 0.1598-0.3231-0.6023 ( 5169 PWs) bands (ev): -26.7745 -26.7745 -13.4016 -13.4012 -13.3939 -13.3936 -13.3796 -13.3796 -13.3653 -13.3652 -12.3837 -12.3828 -12.3765 -12.3761 -12.3637 -12.3629 -12.3353 -12.3347 -12.3244 -12.3236 -12.3097 -12.3092 -9.6338 -9.6333 -8.5438 -8.5428 -8.4656 -8.4652 -2.7211 -2.7206 -2.3000 -2.2990 1.3721 1.3722 2.9533 2.9546 4.8430 4.8448 5.8063 5.8151 6.2815 6.2918 6.6928 6.6982 7.3203 7.3221 8.3576 8.3591 9.7233 9.7257 10.1645 10.1668 10.5172 10.5219 11.2276 11.2321 11.3191 11.3244 k = 0.1664-0.3365-0.6274 ( 5167 PWs) bands (ev): -26.7740 -26.7740 -13.4016 -13.4011 -13.3939 -13.3935 -13.3793 -13.3793 -13.3655 -13.3654 -12.3837 -12.3829 -12.3761 -12.3757 -12.3631 -12.3624 -12.3358 -12.3352 -12.3246 -12.3239 -12.3097 -12.3092 -9.6360 -9.6355 -8.5457 -8.5448 -8.4691 -8.4687 -2.6685 -2.6680 -2.2664 -2.2654 1.3684 1.3686 2.8643 2.8656 4.7943 4.7960 5.7174 5.7256 6.2050 6.2141 6.6702 6.6749 7.3262 7.3281 8.2958 8.2973 9.6867 9.6892 10.1896 10.1921 10.5192 10.5235 11.2578 11.2629 11.3444 11.3501 k = 0.1731-0.3500-0.6525 ( 5171 PWs) bands (ev): -26.7736 -26.7736 -13.4016 -13.4011 -13.3937 -13.3934 -13.3790 -13.3789 -13.3657 -13.3656 -12.3837 -12.3829 -12.3758 -12.3753 -12.3625 -12.3619 -12.3362 -12.3356 -12.3248 -12.3240 -12.3098 -12.3093 -9.6382 -9.6376 -8.5478 -8.5468 -8.4725 -8.4721 -2.6149 -2.6144 -2.2323 -2.2313 1.3616 1.3617 2.7760 2.7773 4.7546 4.7562 5.6304 5.6381 6.1261 6.1343 6.6489 6.6531 7.3261 7.3281 8.2332 8.2348 9.6568 9.6594 10.2190 10.2216 10.5214 10.5254 11.2933 11.2989 11.3748 11.3808 k = 0.1797-0.3634-0.6776 ( 5173 PWs) bands (ev): -26.7731 -26.7731 -13.4016 -13.4011 -13.3936 -13.3932 -13.3787 -13.3786 -13.3659 -13.3658 -12.3837 -12.3830 -12.3753 -12.3748 -12.3620 -12.3613 -12.3366 -12.3361 -12.3249 -12.3242 -12.3098 -12.3093 -9.6403 -9.6398 -8.5499 -8.5489 -8.4757 -8.4753 -2.5605 -2.5601 -2.1978 -2.1968 1.3516 1.3517 2.6886 2.6897 4.7241 4.7256 5.5456 5.5529 6.0455 6.0528 6.6289 6.6327 7.3194 7.3214 8.1700 8.1716 9.6350 9.6378 10.2515 10.2542 10.5244 10.5281 11.3332 11.3392 11.4098 11.4161 k = 0.1864-0.3769-0.7027 ( 5173 PWs) bands (ev): -26.7726 -26.7726 -13.4016 -13.4011 -13.3934 -13.3930 -13.3784 -13.3783 -13.3661 -13.3659 -12.3838 -12.3831 -12.3749 -12.3743 -12.3615 -12.3608 -12.3371 -12.3366 -12.3251 -12.3242 -12.3099 -12.3094 -9.6425 -9.6419 -8.5519 -8.5510 -8.4788 -8.4784 -2.5056 -2.5051 -2.1630 -2.1621 1.3386 1.3386 2.6022 2.6033 4.7027 4.7042 5.4631 5.4700 5.9634 5.9702 6.6103 6.6137 7.3057 7.3078 8.1064 8.1080 9.6222 9.6251 10.2864 10.2892 10.5286 10.5321 11.3769 11.3832 11.4492 11.4556 k = 0.1931-0.3904-0.7278 ( 5175 PWs) bands (ev): -26.7721 -26.7721 -13.4017 -13.4011 -13.3932 -13.3928 -13.3781 -13.3780 -13.3663 -13.3661 -12.3839 -12.3832 -12.3744 -12.3738 -12.3610 -12.3603 -12.3376 -12.3371 -12.3251 -12.3243 -12.3101 -12.3095 -9.6445 -9.6440 -8.5540 -8.5531 -8.4817 -8.4813 -2.4502 -2.4498 -2.1281 -2.1272 1.3227 1.3227 2.5172 2.5182 4.6903 4.6917 5.3833 5.3899 5.8805 5.8868 6.5930 6.5961 7.2852 7.2873 8.0426 8.0443 9.6188 9.6217 10.3231 10.3260 10.5343 10.5375 11.4238 11.4300 11.4927 11.4991 k = 0.1997-0.4038-0.7529 ( 5175 PWs) bands (ev): -26.7717 -26.7717 -13.4018 -13.4011 -13.3929 -13.3925 -13.3778 -13.3777 -13.3665 -13.3663 -12.3841 -12.3834 -12.3739 -12.3732 -12.3605 -12.3599 -12.3380 -12.3376 -12.3251 -12.3243 -12.3102 -12.3097 -9.6465 -9.6460 -8.5560 -8.5551 -8.4845 -8.4841 -2.3948 -2.3944 -2.0933 -2.0924 1.3043 1.3044 2.4336 2.4346 4.6866 4.6880 5.3063 5.3126 5.7972 5.8030 6.5770 6.5798 7.2579 7.2599 7.9788 7.9805 9.6246 9.6276 10.3610 10.3640 10.5418 10.5447 11.4733 11.4792 11.5402 11.5461 k = 0.2064-0.4173-0.7780 ( 5171 PWs) bands (ev): -26.7713 -26.7713 -13.4019 -13.4012 -13.3927 -13.3923 -13.3776 -13.3774 -13.3667 -13.3665 -12.3842 -12.3835 -12.3733 -12.3727 -12.3600 -12.3594 -12.3385 -12.3381 -12.3251 -12.3243 -12.3104 -12.3099 -9.6485 -9.6479 -8.5580 -8.5571 -8.4872 -8.4868 -2.3396 -2.3391 -2.0586 -2.0577 1.2839 1.2840 2.3519 2.3528 4.6913 4.6926 5.2324 5.2385 5.7139 5.7193 6.5624 6.5649 7.2243 7.2263 7.9151 7.9168 9.6393 9.6423 10.3995 10.4025 10.5512 10.5539 11.5250 11.5302 11.5911 11.5964 k = 0.2130-0.4307-0.8030 ( 5177 PWs) bands (ev): -26.7709 -26.7709 -13.4020 -13.4013 -13.3924 -13.3920 -13.3773 -13.3771 -13.3669 -13.3667 -12.3844 -12.3837 -12.3727 -12.3720 -12.3595 -12.3590 -12.3390 -12.3386 -12.3251 -12.3242 -12.3107 -12.3101 -9.6503 -9.6498 -8.5598 -8.5590 -8.4898 -8.4895 -2.2848 -2.2843 -2.0242 -2.0234 1.2619 1.2621 2.2720 2.2728 4.7038 4.7049 5.1619 5.1677 5.6310 5.6361 6.5491 6.5515 7.1851 7.1871 7.8518 7.8535 9.6622 9.6653 10.4377 10.4410 10.5627 10.5652 11.5787 11.5828 11.6451 11.6494 k = 0.2197-0.4442-0.8281 ( 5171 PWs) bands (ev): -26.7705 -26.7705 -13.4021 -13.4014 -13.3921 -13.3917 -13.3771 -13.3769 -13.3671 -13.3669 -12.3846 -12.3839 -12.3721 -12.3714 -12.3591 -12.3585 -12.3395 -12.3391 -12.3250 -12.3241 -12.3109 -12.3104 -9.6521 -9.6515 -8.5616 -8.5607 -8.4923 -8.4920 -2.2308 -2.2303 -1.9903 -1.9895 1.2390 1.2393 2.1941 2.1949 4.7232 4.7242 5.0950 5.1004 5.5492 5.5540 6.5373 6.5395 7.1411 7.1431 7.7890 7.7907 9.6925 9.6957 10.4748 10.4785 10.5762 10.5788 11.6340 11.6368 11.7016 11.7049 k = 0.2263-0.4577-0.8532 ( 5165 PWs) bands (ev): -26.7701 -26.7701 -13.4022 -13.4015 -13.3918 -13.3914 -13.3768 -13.3766 -13.3673 -13.3671 -12.3848 -12.3842 -12.3715 -12.3708 -12.3586 -12.3581 -12.3400 -12.3396 -12.3249 -12.3240 -12.3112 -12.3106 -9.6538 -9.6532 -8.5631 -8.5623 -8.4947 -8.4945 -2.1779 -2.1773 -1.9570 -1.9563 1.2158 1.2162 2.1185 2.1192 4.7488 4.7494 5.0321 5.0371 5.4691 5.4736 6.5269 6.5289 7.0933 7.0951 7.7267 7.7284 9.7293 9.7326 10.5098 10.5141 10.5920 10.5949 11.6906 11.6921 11.7602 11.7623 k = 0.2330-0.4711-0.8783 ( 5161 PWs) bands (ev): -26.7697 -26.7697 -13.4024 -13.4016 -13.3914 -13.3910 -13.3766 -13.3764 -13.3675 -13.3673 -12.3851 -12.3844 -12.3709 -12.3701 -12.3581 -12.3576 -12.3405 -12.3402 -12.3248 -12.3239 -12.3115 -12.3109 -9.6553 -9.6548 -8.5646 -8.5638 -8.4971 -8.4969 -2.1264 -2.1258 -1.9246 -1.9240 1.1929 1.1934 2.0452 2.0458 4.7787 4.7788 4.9741 4.9782 5.3916 5.3958 6.5179 6.5198 7.0424 7.0442 7.6652 7.6669 9.7717 9.7750 10.5417 10.5469 10.6098 10.6134 11.7483 11.7485 11.8202 11.8215 k = 0.2397-0.4846-0.9034 ( 5167 PWs) bands (ev): -26.7694 -26.7694 -13.4025 -13.4018 -13.3911 -13.3907 -13.3764 -13.3761 -13.3678 -13.3675 -12.3853 -12.3847 -12.3703 -12.3695 -12.3576 -12.3572 -12.3410 -12.3407 -12.3246 -12.3237 -12.3119 -12.3112 -9.6568 -9.6562 -8.5658 -8.5650 -8.4995 -8.4993 -2.0769 -2.0761 -1.8932 -1.8926 1.1711 1.1717 1.9744 1.9749 4.8081 4.8105 4.9228 4.9252 5.3182 5.3220 6.5104 6.5121 6.9896 6.9912 7.6046 7.6062 9.8186 9.8219 10.5701 10.5761 10.6294 10.6338 11.8056 11.8072 11.8807 11.8825 k = 0.2463-0.4980-0.9285 ( 5159 PWs) bands (ev): -26.7691 -26.7691 -13.4026 -13.4019 -13.3908 -13.3904 -13.3762 -13.3759 -13.3680 -13.3677 -12.3856 -12.3849 -12.3697 -12.3689 -12.3572 -12.3567 -12.3415 -12.3413 -12.3244 -12.3235 -12.3122 -12.3116 -9.6582 -9.6576 -8.5669 -8.5661 -8.5018 -8.5016 -2.0295 -2.0287 -1.8629 -1.8623 1.1510 1.1517 1.9062 1.9066 4.8222 4.8329 4.8842 4.8928 5.2516 5.2548 6.5042 6.5058 6.9358 6.9374 7.5450 7.5466 9.8690 9.8724 10.5948 10.6015 10.6499 10.6549 11.8633 11.8663 11.9418 11.9446 k = 0.2530-0.5115-0.9536 ( 5159 PWs) bands (ev): -26.7688 -26.7688 -13.4028 -13.4020 -13.3904 -13.3901 -13.3760 -13.3757 -13.3682 -13.3679 -12.3858 -12.3852 -12.3691 -12.3682 -12.3567 -12.3562 -12.3421 -12.3418 -12.3242 -12.3233 -12.3126 -12.3119 -9.6594 -9.6588 -8.5677 -8.5669 -8.5041 -8.5039 -1.9849 -1.9838 -1.8339 -1.8333 1.1333 1.1341 1.8405 1.8409 4.7981 4.8116 4.8863 4.8986 5.1974 5.1998 6.4994 6.5009 6.8820 6.8835 7.4865 7.4881 9.9219 9.9254 10.6163 10.6234 10.6698 10.6752 11.9208 11.9250 12.0037 12.0075 k = 0.2596-0.5250-0.9787 ( 5155 PWs) bands (ev): -26.7685 -26.7685 -13.4029 -13.4021 -13.3901 -13.3898 -13.3759 -13.3755 -13.3684 -13.3680 -12.3861 -12.3854 -12.3685 -12.3676 -12.3562 -12.3558 -12.3426 -12.3424 -12.3240 -12.3231 -12.3130 -12.3123 -9.6605 -9.6599 -8.5684 -8.5675 -8.5063 -8.5062 -1.9432 -1.9420 -1.8064 -1.8058 1.1186 1.1196 1.7776 1.7779 4.7606 4.7732 4.8927 4.9057 5.1657 5.1676 6.4959 6.4973 6.8294 6.8308 7.4292 7.4308 9.9764 9.9800 10.6346 10.6418 10.6879 10.6934 11.9773 11.9824 12.0666 12.0711 k = 0.2663-0.5384-1.0038 ( 5169 PWs) bands (ev): -26.7683 -26.7683 -13.4030 -13.4023 -13.3898 -13.3895 -13.3757 -13.3753 -13.3687 -13.3682 -12.3863 -12.3857 -12.3680 -12.3671 -12.3557 -12.3553 -12.3431 -12.3429 -12.3238 -12.3229 -12.3134 -12.3127 -9.6615 -9.6609 -8.5688 -8.5680 -8.5085 -8.5084 -1.9049 -1.9035 -1.7805 -1.7799 1.1075 1.1087 1.7174 1.7177 4.7239 4.7368 4.8748 4.8890 5.1659 5.1679 6.4936 6.4950 6.7789 6.7802 7.3733 7.3749 10.0315 10.0352 10.6486 10.6556 10.7043 10.7097 12.0314 12.0368 12.1306 12.1353 k = 0.2729-0.5519-1.0289 ( 5169 PWs) bands (ev): -26.7681 -26.7681 -13.4032 -13.4024 -13.3895 -13.3892 -13.3756 -13.3751 -13.3689 -13.3684 -12.3865 -12.3859 -12.3675 -12.3666 -12.3551 -12.3548 -12.3437 -12.3435 -12.3236 -12.3226 -12.3138 -12.3131 -9.6624 -9.6618 -8.5691 -8.5682 -8.5107 -8.5106 -1.8702 -1.8686 -1.7565 -1.7557 1.1005 1.1018 1.6599 1.6603 4.6905 4.7047 4.8347 4.8503 5.1936 5.1954 6.4924 6.4937 6.7319 6.7332 7.3189 7.3206 10.0862 10.0900 10.6564 10.6630 10.7199 10.7250 12.0816 12.0869 12.1959 12.2004 k = 0.2796-0.5653-1.0540 ( 5161 PWs) bands (ev): -26.7679 -26.7679 -13.4033 -13.4025 -13.3893 -13.3889 -13.3755 -13.3749 -13.3691 -13.3685 -12.3867 -12.3861 -12.3670 -12.3661 -12.3546 -12.3542 -12.3442 -12.3440 -12.3234 -12.3224 -12.3141 -12.3135 -9.6632 -9.6626 -8.5692 -8.5682 -8.5128 -8.5127 -1.8395 -1.8377 -1.7343 -1.7335 1.0979 1.0995 1.6052 1.6058 4.6607 4.6775 4.7835 4.8013 5.2359 5.2373 6.4921 6.4935 6.6897 6.6910 7.2662 7.2679 10.1395 10.1434 10.6562 10.6622 10.7360 10.7407 12.1266 12.1313 12.2620 12.2659 k = 0.2863-0.5788-1.0791 ( 5163 PWs) bands (ev): -26.7677 -26.7677 -13.4034 -13.4026 -13.3890 -13.3887 -13.3754 -13.3747 -13.3693 -13.3687 -12.3870 -12.3863 -12.3666 -12.3656 -12.3540 -12.3537 -12.3447 -12.3445 -12.3232 -12.3222 -12.3145 -12.3138 -9.6639 -9.6632 -8.5691 -8.5681 -8.5148 -8.5147 -1.8129 -1.8109 -1.7142 -1.7132 1.1001 1.1019 1.5533 1.5540 4.6338 4.6553 4.7286 4.7508 5.2837 5.2849 6.4926 6.4940 6.6539 6.6552 7.2154 7.2172 10.1904 10.1944 10.6476 10.6532 10.7524 10.7570 12.1652 12.1690 12.3277 12.3309 k = 0.2929-0.5923-1.1042 ( 5161 PWs) bands (ev): -26.7676 -26.7676 -13.4035 -13.4027 -13.3888 -13.3885 -13.3753 -13.3746 -13.3694 -13.3688 -12.3871 -12.3865 -12.3662 -12.3653 -12.3535 -12.3532 -12.3452 -12.3450 -12.3230 -12.3220 -12.3149 -12.3142 -9.6644 -9.6638 -8.5688 -8.5678 -8.5167 -8.5165 -1.7906 -1.7883 -1.6963 -1.6951 1.1072 1.1093 1.5041 1.5050 4.6076 4.6374 4.6745 4.7049 5.3319 5.3328 6.4935 6.4951 6.6260 6.6274 7.1666 7.1685 10.2375 10.2416 10.6317 10.6368 10.7687 10.7733 12.1965 12.1994 12.3912 12.3936 k = 0.2996-0.6057-1.1293 ( 5153 PWs) bands (ev): -26.7675 -26.7675 -13.4036 -13.4028 -13.3886 -13.3883 -13.3752 -13.3744 -13.3696 -13.3689 -12.3873 -12.3867 -12.3659 -12.3649 -12.3529 -12.3527 -12.3457 -12.3455 -12.3229 -12.3218 -12.3152 -12.3145 -9.6648 -9.6642 -8.5685 -8.5674 -8.5185 -8.5183 -1.7725 -1.7701 -1.6805 -1.6793 1.1192 1.1216 1.4575 1.4588 4.5780 4.6117 4.6354 4.6697 5.3768 5.3776 6.4950 6.4967 6.6078 6.6093 7.1201 7.1223 10.2791 10.2832 10.6104 10.6152 10.7842 10.7887 12.2202 12.2224 12.4502 12.4520 k = 0.3062-0.6192-1.1544 ( 5157 PWs) bands (ev): -26.7674 -26.7674 -13.4037 -13.4029 -13.3884 -13.3881 -13.3751 -13.3743 -13.3698 -13.3690 -12.3874 -12.3868 -12.3657 -12.3647 -12.3524 -12.3522 -12.3462 -12.3460 -12.3227 -12.3217 -12.3155 -12.3148 -9.6652 -9.6646 -8.5681 -8.5669 -8.5201 -8.5198 -1.7587 -1.7562 -1.6671 -1.6657 1.1359 1.1389 1.4136 1.4154 4.5420 4.5643 4.6265 4.6493 5.4159 5.4166 6.4970 6.4987 6.6005 6.6022 7.0763 7.0787 10.3123 10.3165 10.5872 10.5913 10.7981 10.8027 12.2365 12.2381 12.5026 12.5039 k = 0.3129-0.6326-1.1795 ( 5161 PWs) bands (ev): -26.7673 -26.7673 -13.4037 -13.4029 -13.3883 -13.3880 -13.3751 -13.3742 -13.3699 -13.3691 -12.3876 -12.3869 -12.3655 -12.3645 -12.3519 -12.3517 -12.3466 -12.3463 -12.3226 -12.3215 -12.3157 -12.3150 -9.6655 -9.6648 -8.5676 -8.5664 -8.5215 -8.5211 -1.7491 -1.7466 -1.6558 -1.6545 1.1569 1.1607 1.3723 1.3749 4.5022 4.5171 4.6268 4.6420 5.4471 5.4477 6.4995 6.5011 6.6052 6.6073 7.0355 7.0382 10.3329 10.3368 10.5671 10.5704 10.8099 10.8144 12.2460 12.2471 12.5466 12.5476 k = 0.3195-0.6461-1.2046 ( 5165 PWs) bands (ev): -26.7673 -26.7673 -13.4038 -13.4030 -13.3882 -13.3879 -13.3750 -13.3741 -13.3700 -13.3692 -12.3876 -12.3870 -12.3653 -12.3643 -12.3515 -12.3514 -12.3470 -12.3466 -12.3225 -12.3215 -12.3159 -12.3152 -9.6656 -9.6650 -8.5672 -8.5659 -8.5225 -8.5221 -1.7435 -1.7410 -1.6467 -1.6454 1.1813 1.1866 1.3337 1.3377 4.4627 4.4733 4.6335 4.6444 5.4690 5.4695 6.5018 6.5031 6.6230 6.6256 6.9982 7.0013 10.3352 10.3389 10.5565 10.5587 10.8188 10.8232 12.2495 12.2503 12.5792 12.5800 k = 0.3262-0.6596-1.2297 ( 5157 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3643 -12.3513 -12.3511 -12.3472 -12.3468 -12.3224 -12.3214 -12.3160 -12.3153 -9.6657 -9.6651 -8.5669 -8.5656 -8.5232 -8.5228 -1.7417 -1.7393 -1.6397 -1.6385 1.2068 1.2152 1.2985 1.3056 4.4256 4.4337 4.6463 4.6547 5.4814 5.4819 6.5028 6.5038 6.6539 6.6574 6.9648 6.9687 10.3170 10.3208 10.5579 10.5599 10.8242 10.8286 12.2482 12.2489 12.5915 12.5919 k = 0.3329-0.6730-1.2548 ( 5173 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3642 -12.3512 -12.3511 -12.3473 -12.3469 -12.3224 -12.3214 -12.3161 -12.3154 -9.6658 -9.6651 -8.5668 -8.5655 -8.5235 -8.5230 -1.7435 -1.7412 -1.6347 -1.6336 1.2235 1.2383 1.2743 1.2878 4.3923 4.3988 4.6652 4.6720 5.4850 5.4854 6.5015 6.5023 6.6971 6.7018 6.9360 6.9411 10.2829 10.2870 10.5680 10.5705 10.8255 10.8297 12.2435 12.2442 12.5615 12.5617 k = 0.3395-0.6865-1.2799 ( 5169 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3643 -12.3512 -12.3511 -12.3472 -12.3469 -12.3224 -12.3214 -12.3161 -12.3154 -9.6658 -9.6651 -8.5669 -8.5656 -8.5233 -8.5228 -1.7485 -1.7463 -1.6315 -1.6306 1.2128 1.2222 1.2941 1.3022 4.3635 4.3689 4.6902 4.6958 5.4810 5.4814 6.4972 6.4979 6.7497 6.7567 6.9127 6.9202 10.2396 10.2439 10.5819 10.5849 10.8219 10.8260 12.2367 12.2376 12.4734 12.4741 k = 0.6605-0.5696-1.2099 ( 5169 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3881 -13.3878 -13.3750 -13.3741 -13.3700 -13.3692 -12.3877 -12.3871 -12.3652 -12.3643 -12.3512 -12.3511 -12.3472 -12.3469 -12.3224 -12.3214 -12.3161 -12.3154 -9.6658 -9.6651 -8.5669 -8.5656 -8.5233 -8.5228 -1.7485 -1.7463 -1.6315 -1.6306 1.2128 1.2222 1.2941 1.3022 4.3635 4.3689 4.6902 4.6958 5.4810 5.4814 6.4972 6.4979 6.7497 6.7567 6.9127 6.9202 10.2396 10.2439 10.5819 10.5849 10.8219 10.8260 12.2367 12.2376 12.4734 12.4741 k = 0.6538-0.5410-1.2099 ( 5167 PWs) bands (ev): -26.7672 -26.7672 -13.4038 -13.4030 -13.3882 -13.3879 -13.3750 -13.3741 -13.3700 -13.3692 -12.3876 -12.3870 -12.3653 -12.3643 -12.3515 -12.3513 -12.3471 -12.3467 -12.3224 -12.3214 -12.3160 -12.3153 -9.6657 -9.6650 -8.5673 -8.5660 -8.5226 -8.5222 -1.7565 -1.7545 -1.6301 -1.6293 1.1879 1.1934 1.3305 1.3347 4.3395 4.3441 4.7213 4.7261 5.4712 5.4716 6.4896 6.4903 6.8053 6.8180 6.8974 6.9105 10.1918 10.1962 10.5961 10.5995 10.8128 10.8166 12.2282 12.2303 12.3447 12.3465 k = 0.6471-0.5124-1.2099 ( 5165 PWs) bands (ev): -26.7673 -26.7673 -13.4037 -13.4029 -13.3883 -13.3880 -13.3751 -13.3742 -13.3699 -13.3691 -12.3875 -12.3869 -12.3654 -12.3645 -12.3518 -12.3516 -12.3468 -12.3465 -12.3225 -12.3214 -12.3158 -12.3151 -9.6656 -9.6649 -8.5679 -8.5667 -8.5214 -8.5210 -1.7671 -1.7652 -1.6303 -1.6296 1.1610 1.1649 1.3697 1.3724 4.3209 4.3249 4.7584 4.7626 5.4574 5.4578 6.4786 6.4793 6.8433 6.8598 6.9134 6.9304 10.1426 10.1471 10.6090 10.6125 10.7976 10.8011 12.1875 12.1953 12.2247 12.2324 k = 0.6404-0.4838-1.2099 ( 5157 PWs) bands (ev): -26.7673 -26.7673 -13.4037 -13.4028 -13.3884 -13.3881 -13.3751 -13.3743 -13.3698 -13.3690 -12.3874 -12.3868 -12.3656 -12.3646 -12.3521 -12.3519 -12.3466 -12.3463 -12.3225 -12.3215 -12.3156 -12.3149 -9.6654 -9.6647 -8.5688 -8.5676 -8.5197 -8.5194 -1.7798 -1.7781 -1.6320 -1.6314 1.1346 1.1377 1.4099 1.4117 4.3078 4.3114 4.8013 4.8050 5.4415 5.4418 6.4644 6.4650 6.8514 6.8602 6.9800 6.9893 10.0944 10.0990 10.6196 10.6233 10.7758 10.7788 12.0365 12.0384 12.2189 12.2209 k = 0.6337-0.4552-1.2099 ( 5165 PWs) bands (ev): -26.7674 -26.7674 -13.4036 -13.4028 -13.3886 -13.3883 -13.3751 -13.3744 -13.3697 -13.3690 -12.3873 -12.3866 -12.3658 -12.3649 -12.3525 -12.3523 -12.3464 -12.3462 -12.3225 -12.3215 -12.3154 -12.3147 -9.6652 -9.6646 -8.5699 -8.5688 -8.5176 -8.5174 -1.7944 -1.7927 -1.6349 -1.6345 1.1094 1.1119 1.4501 1.4514 4.3002 4.3034 4.8498 4.8532 5.4250 5.4253 6.4474 6.4479 6.8515 6.8568 7.0566 7.0624 10.0489 10.0536 10.6276 10.6314 10.7472 10.7497 11.8751 11.8761 12.2162 12.2176 k = 0.6270-0.4266-1.2099 ( 5169 PWs) bands (ev): -26.7675 -26.7675 -13.4035 -13.4027 -13.3888 -13.3885 -13.3752 -13.3745 -13.3695 -13.3689 -12.3871 -12.3864 -12.3661 -12.3651 -12.3529 -12.3527 -12.3463 -12.3460 -12.3225 -12.3215 -12.3151 -12.3144 -9.6650 -9.6644 -8.5712 -8.5702 -8.5152 -8.5150 -1.8103 -1.8088 -1.6390 -1.6386 1.0854 1.0875 1.4896 1.4905 4.2981 4.3011 4.9038 4.9068 5.4094 5.4097 6.4281 6.4286 6.8519 6.8555 7.1343 7.1385 10.0076 10.0123 10.6323 10.6368 10.7117 10.7143 11.7111 11.7118 12.2164 12.2177 k = 0.6204-0.3980-1.2099 ( 5161 PWs) bands (ev): -26.7676 -26.7676 -13.4033 -13.4025 -13.3890 -13.3887 -13.3753 -13.3746 -13.3693 -13.3687 -12.3868 -12.3862 -12.3664 -12.3654 -12.3533 -12.3530 -12.3462 -12.3459 -12.3225 -12.3215 -12.3147 -12.3141 -9.6648 -9.6642 -8.5727 -8.5717 -8.5125 -8.5123 -1.8273 -1.8259 -1.6441 -1.6438 1.0627 1.0645 1.5276 1.5284 4.3012 4.3039 4.9629 4.9656 5.3960 5.3965 6.4074 6.4077 6.8537 6.8562 7.2101 7.2135 9.9719 9.9767 10.6292 10.6391 10.6693 10.6778 11.5468 11.5473 12.2199 12.2213 k = 0.6137-0.3694-1.2099 ( 5166 PWs) bands (ev): -26.7677 -26.7677 -13.4032 -13.4024 -13.3893 -13.3889 -13.3753 -13.3747 -13.3692 -13.3686 -12.3865 -12.3859 -12.3667 -12.3658 -12.3537 -12.3534 -12.3461 -12.3459 -12.3225 -12.3215 -12.3144 -12.3137 -9.6645 -9.6639 -8.5742 -8.5734 -8.5096 -8.5095 -1.8450 -1.8437 -1.6500 -1.6497 1.0412 1.0428 1.5637 1.5643 4.3090 4.3115 5.0270 5.0293 5.3861 5.3869 6.3857 6.3860 6.8564 6.8583 7.2819 7.2848 9.9432 9.9480 10.6013 10.6147 10.6443 10.6572 11.3839 11.3843 12.2267 12.2282 k = 0.6070-0.3408-1.2099 ( 5164 PWs) bands (ev): -26.7678 -26.7678 -13.4030 -13.4022 -13.3896 -13.3892 -13.3754 -13.3749 -13.3690 -13.3685 -12.3862 -12.3856 -12.3671 -12.3662 -12.3541 -12.3538 -12.3462 -12.3460 -12.3224 -12.3215 -12.3140 -12.3134 -9.6643 -9.6637 -8.5758 -8.5750 -8.5065 -8.5064 -1.8631 -1.8620 -1.6564 -1.6563 1.0210 1.0224 1.5974 1.5979 4.3208 4.3232 5.0957 5.0974 5.3810 5.3824 6.3637 6.3640 6.8596 6.8609 7.3475 7.3500 9.9226 9.9274 10.5498 10.5584 10.6426 10.6516 11.2240 11.2245 12.2367 12.2385 k = 0.6003-0.3122-1.2099 ( 5172 PWs) bands (ev): -26.7679 -26.7679 -13.4028 -13.4020 -13.3899 -13.3896 -13.3755 -13.3750 -13.3688 -13.3684 -12.3859 -12.3853 -12.3675 -12.3666 -12.3544 -12.3541 -12.3462 -12.3460 -12.3223 -12.3214 -12.3136 -12.3130 -9.6640 -9.6635 -8.5775 -8.5768 -8.5034 -8.5032 -1.8814 -1.8803 -1.6634 -1.6633 1.0019 1.0032 1.6284 1.6289 4.3359 4.3380 5.1682 5.1696 5.3818 5.3843 6.3418 6.3420 6.8625 6.8633 7.4049 7.4070 9.9111 9.9160 10.4886 10.4953 10.6391 10.6469 11.0696 11.0704 12.2497 12.2518 k = 0.5936-0.2836-1.2099 ( 5172 PWs) bands (ev): -26.7680 -26.7680 -13.4026 -13.4018 -13.3903 -13.3899 -13.3756 -13.3751 -13.3687 -13.3682 -12.3855 -12.3849 -12.3679 -12.3670 -12.3547 -12.3544 -12.3464 -12.3462 -12.3222 -12.3213 -12.3131 -12.3126 -9.6638 -9.6633 -8.5791 -8.5785 -8.5002 -8.5000 -1.8995 -1.8985 -1.6707 -1.6706 0.9841 0.9853 1.6566 1.6569 4.3530 4.3550 5.2431 5.2460 5.3896 5.3945 6.3204 6.3205 6.8644 6.8649 7.4521 7.4541 9.9095 9.9144 10.4216 10.4272 10.6302 10.6376 10.9253 10.9266 12.2652 12.2677 k = 0.5869-0.2550-1.2099 ( 5168 PWs) bands (ev): -26.7681 -26.7681 -13.4023 -13.4016 -13.3906 -13.3902 -13.3756 -13.3752 -13.3685 -13.3681 -12.3851 -12.3845 -12.3684 -12.3675 -12.3550 -12.3547 -12.3465 -12.3464 -12.3220 -12.3212 -12.3127 -12.3122 -9.6636 -9.6631 -8.5807 -8.5801 -8.4969 -8.4968 -1.9173 -1.9164 -1.6781 -1.6781 0.9675 0.9685 1.6817 1.6820 4.3712 4.3730 5.3177 5.3259 5.4056 5.4161 6.2997 6.2998 6.8647 6.8650 7.4877 7.4896 9.9181 9.9228 10.3507 10.3554 10.6049 10.6118 10.8040 10.8060 12.2827 12.2856 k = 0.5802-0.2264-1.2099 ( 5172 PWs) bands (ev): -26.7682 -26.7682 -13.4021 -13.4014 -13.3910 -13.3906 -13.3757 -13.3754 -13.3683 -13.3680 -12.3846 -12.3840 -12.3689 -12.3681 -12.3552 -12.3549 -12.3467 -12.3466 -12.3219 -12.3212 -12.3123 -12.3118 -9.6633 -9.6629 -8.5823 -8.5818 -8.4938 -8.4936 -1.9344 -1.9337 -1.6856 -1.6856 0.9520 0.9530 1.7038 1.7041 4.3893 4.3908 5.3850 5.4076 5.4318 5.4567 6.2800 6.2801 6.8625 6.8631 7.5105 7.5122 9.9361 9.9406 10.2777 10.2814 10.5378 10.5427 10.7336 10.7366 12.3017 12.3051 k = 0.5736-0.1978-1.2099 ( 5172 PWs) bands (ev): -26.7683 -26.7683 -13.4018 -13.4011 -13.3914 -13.3910 -13.3758 -13.3755 -13.3682 -13.3678 -12.3842 -12.3836 -12.3695 -12.3686 -12.3555 -12.3552 -12.3470 -12.3468 -12.3217 -12.3211 -12.3119 -12.3114 -9.6631 -9.6627 -8.5838 -8.5833 -8.4907 -8.4905 -1.9509 -1.9502 -1.6930 -1.6929 0.9378 0.9386 1.7230 1.7232 4.4062 4.4076 5.4383 5.4615 5.4974 5.5230 6.2614 6.2615 6.8574 6.8585 7.5197 7.5213 9.9614 9.9657 10.2052 10.2076 10.4328 10.4359 10.7117 10.7158 12.3214 12.3254 k = 0.5669-0.1691-1.2099 ( 5172 PWs) bands (ev): -26.7684 -26.7684 -13.4015 -13.4008 -13.3918 -13.3914 -13.3759 -13.3756 -13.3680 -13.3677 -12.3837 -12.3831 -12.3700 -12.3692 -12.3557 -12.3554 -12.3472 -12.3471 -12.3216 -12.3210 -12.3115 -12.3111 -9.6629 -9.6625 -8.5852 -8.5848 -8.4878 -8.4876 -1.9664 -1.9657 -1.7001 -1.7000 0.9247 0.9254 1.7395 1.7397 4.4213 4.4225 5.4878 5.5051 5.5844 5.6043 6.2441 6.2443 6.8489 6.8505 7.5153 7.5168 9.9864 9.9922 10.1361 10.1424 10.3201 10.3231 10.7105 10.7154 12.3413 12.3459 k = 0.5602-0.1405-1.2099 ( 5172 PWs) bands (ev): -26.7685 -26.7685 -13.4012 -13.4006 -13.3922 -13.3918 -13.3759 -13.3757 -13.3679 -13.3676 -12.3831 -12.3825 -12.3706 -12.3698 -12.3558 -12.3556 -12.3475 -12.3474 -12.3214 -12.3209 -12.3111 -12.3107 -9.6627 -9.6624 -8.5865 -8.5862 -8.4850 -8.4848 -1.9808 -1.9803 -1.7069 -1.7068 0.9128 0.9135 1.7534 1.7536 4.4341 4.4351 5.5416 5.5566 5.6735 5.6913 6.2283 6.2286 6.8365 6.8387 7.4976 7.4990 9.9848 9.9986 10.0875 10.1077 10.2147 10.2214 10.7197 10.7249 12.3607 12.3659 k = 0.5535-0.1119-1.2099 ( 5180 PWs) bands (ev): -26.7686 -26.7686 -13.4009 -13.4003 -13.3926 -13.3922 -13.3760 -13.3758 -13.3677 -13.3675 -12.3826 -12.3820 -12.3712 -12.3704 -12.3559 -12.3557 -12.3478 -12.3477 -12.3212 -12.3208 -12.3107 -12.3104 -9.6626 -9.6622 -8.5878 -8.5874 -8.4824 -8.4822 -1.9940 -1.9935 -1.7132 -1.7131 0.9021 0.9027 1.7650 1.7652 4.4445 4.4453 5.6014 5.6156 5.7633 5.7807 6.2140 6.2144 6.8196 6.8226 7.4678 7.4690 9.9389 9.9535 10.0612 10.0858 10.1541 10.1640 10.7371 10.7424 12.3789 12.3848 k = 0.5468-0.0833-1.2099 ( 5178 PWs) bands (ev): -26.7686 -26.7686 -13.4006 -13.4000 -13.3931 -13.3926 -13.3760 -13.3758 -13.3676 -13.3674 -12.3820 -12.3814 -12.3718 -12.3711 -12.3560 -12.3558 -12.3480 -12.3479 -12.3211 -12.3207 -12.3104 -12.3101 -9.6624 -9.6621 -8.5888 -8.5885 -8.4800 -8.4799 -2.0059 -2.0055 -1.7190 -1.7189 0.8926 0.8931 1.7745 1.7747 4.4525 4.4531 5.6664 5.6803 5.8532 5.8709 6.2014 6.2019 6.7978 6.8018 7.4275 7.4285 9.8781 9.8908 9.9940 10.0078 10.1774 10.1802 10.7625 10.7678 12.3953 12.4020 k = 0.5401-0.0547-1.2099 ( 5184 PWs) bands (ev): -26.7687 -26.7687 -13.4003 -13.3997 -13.3934 -13.3930 -13.3761 -13.3759 -13.3675 -13.3674 -12.3814 -12.3808 -12.3724 -12.3717 -12.3561 -12.3559 -12.3483 -12.3482 -12.3210 -12.3206 -12.3101 -12.3099 -9.6623 -9.6620 -8.5898 -8.5895 -8.4779 -8.4778 -2.0165 -2.0161 -1.7242 -1.7241 0.8844 0.8848 1.7822 1.7823 4.4584 4.4589 5.7348 5.7485 5.9423 5.9605 6.1907 6.1914 6.7708 6.7760 7.3790 7.3797 9.8179 9.8289 9.9206 9.9306 10.2123 10.2153 10.7958 10.8010 12.4095 12.4167 k = 0.5334-0.0261-1.2099 ( 5180 PWs) bands (ev): -26.7688 -26.7688 -13.4000 -13.3994 -13.3938 -13.3934 -13.3761 -13.3760 -13.3674 -13.3673 -12.3808 -12.3803 -12.3730 -12.3724 -12.3562 -12.3560 -12.3485 -12.3484 -12.3209 -12.3206 -12.3098 -12.3096 -9.6622 -9.6620 -8.5906 -8.5904 -8.4761 -8.4760 -2.0255 -2.0252 -1.7287 -1.7286 0.8774 0.8778 1.7883 1.7884 4.4626 4.4630 5.8039 5.8174 6.0292 6.0479 6.1822 6.1836 6.7384 6.7451 7.3251 7.3256 9.7631 9.7726 9.8559 9.8639 10.2453 10.2483 10.8359 10.8406 12.4209 12.4286 k = 0.5267 0.0025-1.2099 ( 5180 PWs) bands (ev): -26.7688 -26.7688 -13.3996 -13.3992 -13.3942 -13.3938 -13.3761 -13.3760 -13.3673 -13.3672 -12.3803 -12.3797 -12.3736 -12.3730 -12.3562 -12.3561 -12.3487 -12.3486 -12.3208 -12.3205 -12.3096 -12.3094 -9.6621 -9.6619 -8.5913 -8.5911 -8.4745 -8.4745 -2.0329 -2.0327 -1.7324 -1.7324 0.8717 0.8720 1.7930 1.7931 4.4654 4.4657 5.8705 5.8835 6.1103 6.1272 6.1787 6.1832 6.7006 6.7091 7.2694 7.2699 9.7161 9.7238 9.8024 9.8089 10.2726 10.2752 10.8797 10.8838 12.4294 12.4372 k = 0.5201 0.0311-1.2099 ( 5174 PWs) bands (ev): -26.7689 -26.7689 -13.3993 -13.3989 -13.3944 -13.3941 -13.3762 -13.3761 -13.3673 -13.3672 -12.3797 -12.3792 -12.3742 -12.3736 -12.3562 -12.3561 -12.3488 -12.3488 -12.3207 -12.3205 -12.3094 -12.3093 -9.6620 -9.6619 -8.5918 -8.5917 -8.4733 -8.4733 -2.0388 -2.0386 -1.7354 -1.7354 0.8672 0.8674 1.7965 1.7965 4.4672 4.4675 5.9307 5.9422 6.1551 6.1585 6.2095 6.2277 6.6583 6.6687 7.2166 7.2173 9.6783 9.6842 9.7609 9.7657 10.2933 10.2952 10.9228 10.9261 12.4350 12.4423 k = 0.5134 0.0597-1.2099 ( 5178 PWs) bands (ev): -26.7689 -26.7689 -13.3991 -13.3988 -13.3946 -13.3944 -13.3762 -13.3761 -13.3672 -13.3672 -12.3792 -12.3788 -12.3746 -12.3742 -12.3562 -12.3562 -12.3490 -12.3489 -12.3206 -12.3205 -12.3093 -12.3092 -9.6619 -9.6618 -8.5922 -8.5921 -8.4725 -8.4724 -2.0430 -2.0429 -1.7376 -1.7375 0.8640 0.8642 1.7988 1.7989 4.4684 4.4685 5.9798 5.9887 6.1576 6.1587 6.2780 6.2968 6.6138 6.6254 7.1724 7.1731 9.6510 9.6549 9.7314 9.7346 10.3075 10.3088 10.9596 10.9619 12.4384 12.4442 k = 0.5067 0.0883-1.2099 ( 5184 PWs) bands (ev): -26.7689 -26.7689 -13.3989 -13.3987 -13.3947 -13.3946 -13.3762 -13.3762 -13.3672 -13.3672 -12.3787 -12.3785 -12.3749 -12.3746 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3092 -12.3091 -9.6619 -9.6618 -8.5924 -8.5924 -8.4719 -8.4719 -2.0455 -2.0455 -1.7388 -1.7388 0.8621 0.8622 1.8002 1.8002 4.4689 4.4690 6.0130 6.0179 6.1569 6.1573 6.3387 6.3523 6.5743 6.5840 7.1426 7.1431 9.6347 9.6367 9.7140 9.7156 10.3158 10.3164 10.9847 10.9859 12.4404 12.4437 k = 0.5000 0.1169-1.2099 ( 5194 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5925 -8.5925 -8.4717 -8.4717 -2.0463 -2.0463 -1.7393 -1.7393 0.8615 0.8615 1.8007 1.8007 4.4692 4.4692 6.0263 6.0263 6.1567 6.1567 6.3708 6.3708 6.5600 6.5600 7.1322 7.1322 9.6299 9.6299 9.7088 9.7088 10.3187 10.3187 10.9940 10.9940 12.4421 12.4421 k = 0.5000 0.1169-1.2099 ( 5194 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5925 -8.5925 -8.4717 -8.4717 -2.0463 -2.0463 -1.7393 -1.7393 0.8615 0.8615 1.8007 1.8007 4.4692 4.4692 6.0263 6.0263 6.1567 6.1567 6.3708 6.3708 6.5600 6.5600 7.1322 7.1322 9.6299 9.6299 9.7088 9.7088 10.3187 10.3187 10.9940 10.9940 12.4421 12.4421 k = 0.5229 0.1222-1.1999 ( 5186 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5925 -8.5924 -8.4717 -8.4717 -2.0461 -2.0461 -1.7399 -1.7399 0.8609 0.8609 1.8023 1.8023 4.4694 4.4694 6.0241 6.0242 6.1566 6.1567 6.3731 6.3734 6.5482 6.5486 7.1450 7.1452 9.6234 9.6242 9.7128 9.7139 10.3219 10.3224 10.9888 10.9889 12.4489 12.4490 k = 0.5459 0.1276-1.1899 ( 5187 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5924 -8.5924 -8.4717 -8.4717 -2.0453 -2.0453 -1.7416 -1.7416 0.8592 0.8592 1.8069 1.8069 4.4702 4.4703 6.0178 6.0179 6.1563 6.1565 6.3798 6.3805 6.5162 6.5171 7.1806 7.1809 9.6069 9.6079 9.7249 9.7267 10.3314 10.3324 10.9736 10.9738 12.4685 12.4688 k = 0.5688 0.1330-1.1799 ( 5191 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5924 -8.5924 -8.4717 -8.4717 -2.0439 -2.0439 -1.7446 -1.7445 0.8564 0.8565 1.8145 1.8145 4.4715 4.4716 6.0078 6.0079 6.1559 6.1563 6.3899 6.3914 6.4709 6.4726 7.2325 7.2329 9.5828 9.5839 9.7433 9.7455 10.3464 10.3478 10.9496 10.9499 12.4975 12.4979 k = 0.5917 0.1383-1.1699 ( 5192 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3947 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3091 -12.3091 -9.6618 -9.6618 -8.5924 -8.5923 -8.4717 -8.4717 -2.0421 -2.0421 -1.7487 -1.7486 0.8529 0.8529 1.8247 1.8247 4.4732 4.4734 5.9947 5.9948 6.1555 6.1559 6.3959 6.4007 6.4231 6.4281 7.2946 7.2950 9.5531 9.5540 9.7674 9.7697 10.3654 10.3673 10.9185 10.9188 12.5268 12.5275 k = 0.6146 0.1437-1.1599 ( 5184 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3092 -12.3091 -9.6617 -9.6617 -8.5923 -8.5922 -8.4717 -8.4717 -2.0397 -2.0397 -1.7539 -1.7539 0.8486 0.8487 1.8373 1.8374 4.4754 4.4755 5.9789 5.9790 6.1550 6.1554 6.3566 6.3582 6.4266 6.4285 7.3623 7.3628 9.5193 9.5199 9.7970 9.7994 10.3870 10.3893 10.8819 10.8824 12.5336 12.5345 k = 0.6376 0.1490-1.1500 ( 5177 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3092 -12.3091 -9.6617 -9.6616 -8.5922 -8.5921 -8.4717 -8.4717 -2.0369 -2.0369 -1.7603 -1.7602 0.8440 0.8441 1.8520 1.8520 4.4778 4.4779 5.9610 5.9611 6.1543 6.1548 6.3025 6.3031 6.4449 6.4458 7.4328 7.4332 9.4825 9.4830 9.8321 9.8346 10.4100 10.4127 10.8417 10.8423 12.4968 12.4975 k = 0.6605 0.1544-1.1400 ( 5181 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3489 -12.3205 -12.3205 -12.3092 -12.3091 -9.6616 -9.6616 -8.5921 -8.5920 -8.4717 -8.4717 -2.0335 -2.0335 -1.7677 -1.7676 0.8393 0.8394 1.8682 1.8682 4.4804 4.4806 5.9413 5.9413 6.1532 6.1535 6.2500 6.2502 6.4649 6.4655 7.5038 7.5043 9.4441 9.4445 9.8724 9.8750 10.4333 10.4365 10.7996 10.8004 12.4304 12.4309 k = 0.6605 0.1544-1.1400 ( 5181 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3489 -12.3205 -12.3205 -12.3092 -12.3091 -9.6616 -9.6616 -8.5921 -8.5920 -8.4717 -8.4717 -2.0335 -2.0335 -1.7677 -1.7676 0.8393 0.8394 1.8682 1.8682 4.4804 4.4806 5.9413 5.9413 6.1532 6.1535 6.2500 6.2502 6.4649 6.4655 7.5038 7.5043 9.4441 9.4445 9.8724 9.8750 10.4333 10.4365 10.7996 10.8004 12.4304 12.4309 k = 0.6567 0.1535-1.1112 ( 5180 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3988 -13.3948 -13.3947 -13.3762 -13.3762 -13.3671 -13.3671 -12.3787 -12.3785 -12.3749 -12.3749 -12.3565 -12.3563 -12.3487 -12.3487 -12.3206 -12.3206 -12.3092 -12.3091 -9.6613 -9.6612 -8.5915 -8.5913 -8.4717 -8.4717 -2.0435 -2.0435 -1.7787 -1.7785 0.8477 0.8479 1.8912 1.8912 4.4756 4.4758 5.9393 5.9393 6.1656 6.1657 6.2317 6.2322 6.4743 6.4746 7.5385 7.5390 9.4379 9.4383 9.8999 9.9026 10.4247 10.4279 10.7820 10.7828 12.4330 12.4334 k = 0.6528 0.1526-1.0824 ( 5177 PWs) bands (ev): -26.7692 -26.7692 -13.3989 -13.3988 -13.3948 -13.3947 -13.3763 -13.3763 -13.3671 -13.3671 -12.3789 -12.3786 -12.3750 -12.3749 -12.3567 -12.3565 -12.3484 -12.3484 -12.3207 -12.3206 -12.3091 -12.3090 -9.6607 -9.6606 -8.5905 -8.5903 -8.4717 -8.4716 -2.0582 -2.0581 -1.7945 -1.7943 0.8617 0.8620 1.9213 1.9213 4.4720 4.4723 5.9383 5.9384 6.1572 6.1574 6.2385 6.2392 6.4857 6.4860 7.5750 7.5755 9.4338 9.4341 9.9322 9.9349 10.4205 10.4238 10.7645 10.7653 12.4328 12.4330 k = 0.6490 0.1517-1.0535 ( 5180 PWs) bands (ev): -26.7693 -26.7693 -13.3989 -13.3988 -13.3948 -13.3947 -13.3764 -13.3764 -13.3671 -13.3670 -12.3791 -12.3787 -12.3750 -12.3749 -12.3569 -12.3567 -12.3480 -12.3479 -12.3208 -12.3208 -12.3091 -12.3090 -9.6600 -9.6598 -8.5893 -8.5890 -8.4716 -8.4716 -2.0771 -2.0771 -1.8150 -1.8148 0.8810 0.8814 1.9581 1.9581 4.4701 4.4705 5.9374 5.9377 6.1357 6.1357 6.2643 6.2647 6.4993 6.4995 7.6130 7.6135 9.4318 9.4320 9.9692 9.9719 10.4210 10.4245 10.7470 10.7478 12.4299 12.4300 k = 0.6452 0.1508-1.0247 ( 5166 PWs) bands (ev): -26.7695 -26.7695 -13.3990 -13.3989 -13.3948 -13.3947 -13.3765 -13.3765 -13.3670 -13.3670 -12.3793 -12.3788 -12.3751 -12.3750 -12.3572 -12.3569 -12.3475 -12.3474 -12.3209 -12.3209 -12.3091 -12.3089 -9.6590 -9.6588 -8.5878 -8.5874 -8.4715 -8.4715 -2.1000 -2.1000 -1.8399 -1.8396 0.9051 0.9055 2.0013 2.0013 4.4705 4.4709 5.9347 5.9352 6.1133 6.1135 6.2976 6.2978 6.5149 6.5152 7.6523 7.6528 9.4320 9.4320 10.0106 10.0133 10.4266 10.4302 10.7295 10.7305 12.4245 12.4245 k = 0.6414 0.1499-0.9959 ( 5165 PWs) bands (ev): -26.7697 -26.7697 -13.3991 -13.3990 -13.3948 -13.3947 -13.3766 -13.3766 -13.3669 -13.3669 -12.3795 -12.3790 -12.3752 -12.3750 -12.3576 -12.3572 -12.3470 -12.3469 -12.3211 -12.3210 -12.3091 -12.3089 -9.6580 -9.6577 -8.5859 -8.5855 -8.4714 -8.4713 -2.1266 -2.1266 -1.8688 -1.8684 0.9333 0.9337 2.0504 2.0505 4.4736 4.4741 5.9278 5.9285 6.0956 6.0958 6.3355 6.3356 6.5325 6.5329 7.6926 7.6932 9.4342 9.4343 10.0563 10.0591 10.4372 10.4409 10.7122 10.7132 12.4168 12.4169 k = 0.6376 0.1490-0.9671 ( 5164 PWs) bands (ev): -26.7699 -26.7699 -13.3992 -13.3990 -13.3948 -13.3947 -13.3767 -13.3767 -13.3668 -13.3668 -12.3797 -12.3792 -12.3752 -12.3751 -12.3579 -12.3575 -12.3463 -12.3462 -12.3213 -12.3212 -12.3090 -12.3088 -9.6567 -9.6565 -8.5839 -8.5834 -8.4712 -8.4711 -2.1564 -2.1563 -1.9012 -1.9008 0.9649 0.9653 2.1052 2.1053 4.4802 4.4807 5.9142 5.9152 6.0860 6.0861 6.3768 6.3772 6.5522 6.5527 7.7339 7.7345 9.4384 9.4386 10.1062 10.1091 10.4529 10.4568 10.6949 10.6960 12.4073 12.4074 k = 0.6337 0.1482-0.9383 ( 5161 PWs) bands (ev): -26.7702 -26.7702 -13.3993 -13.3991 -13.3948 -13.3947 -13.3769 -13.3769 -13.3667 -13.3667 -12.3800 -12.3794 -12.3753 -12.3752 -12.3583 -12.3578 -12.3457 -12.3456 -12.3214 -12.3214 -12.3090 -12.3087 -9.6554 -9.6551 -8.5815 -8.5810 -8.4710 -8.4709 -2.1891 -2.1889 -1.9368 -1.9363 0.9992 0.9997 2.1652 2.1653 4.4906 4.4912 5.8932 5.8943 6.0854 6.0855 6.4214 6.4222 6.5738 6.5745 7.7760 7.7765 9.4445 9.4447 10.1601 10.1630 10.4735 10.4776 10.6779 10.6791 12.3961 12.3962 k = 0.6299 0.1473-0.9095 ( 5154 PWs) bands (ev): -26.7705 -26.7705 -13.3994 -13.3992 -13.3948 -13.3947 -13.3771 -13.3771 -13.3666 -13.3666 -12.3803 -12.3796 -12.3755 -12.3753 -12.3587 -12.3582 -12.3450 -12.3449 -12.3216 -12.3216 -12.3090 -12.3087 -9.6538 -9.6535 -8.5790 -8.5784 -8.4707 -8.4706 -2.2242 -2.2240 -1.9751 -1.9745 1.0355 1.0359 2.2298 2.2301 4.5055 4.5061 5.8659 5.8673 6.0928 6.0929 6.4691 6.4702 6.5974 6.5984 7.8186 7.8191 9.4521 9.4525 10.2178 10.2206 10.4986 10.5031 10.6612 10.6628 12.3833 12.3835 k = 0.6261 0.1464-0.8807 ( 5160 PWs) bands (ev): -26.7708 -26.7708 -13.3995 -13.3994 -13.3948 -13.3946 -13.3773 -13.3773 -13.3665 -13.3665 -12.3805 -12.3798 -12.3756 -12.3755 -12.3591 -12.3586 -12.3443 -12.3441 -12.3218 -12.3218 -12.3089 -12.3087 -9.6522 -9.6518 -8.5763 -8.5756 -8.4703 -8.4701 -2.2613 -2.2611 -2.0157 -2.0150 1.0729 1.0733 2.2988 2.2991 4.5253 4.5260 5.8346 5.8361 6.1064 6.1064 6.5195 6.5212 6.6229 6.6244 7.8618 7.8622 9.4611 9.4615 10.2789 10.2817 10.5273 10.5323 10.6455 10.6476 12.3692 12.3694 k = 0.6223 0.1455-0.8519 ( 5167 PWs) bands (ev): -26.7712 -26.7712 -13.3996 -13.3995 -13.3948 -13.3946 -13.3775 -13.3775 -13.3664 -13.3663 -12.3808 -12.3801 -12.3757 -12.3756 -12.3595 -12.3590 -12.3435 -12.3433 -12.3219 -12.3219 -12.3089 -12.3086 -9.6504 -9.6501 -8.5734 -8.5727 -8.4698 -8.4696 -2.3001 -2.2998 -2.0581 -2.0574 1.1109 1.1112 2.3715 2.3718 4.5505 4.5513 5.8009 5.8025 6.1246 6.1246 6.5723 6.5749 6.6506 6.6528 7.9053 7.9057 9.4709 9.4714 10.3432 10.3459 10.5568 10.5626 10.6331 10.6360 12.3537 12.3538 k = 0.6185 0.1446-0.8231 ( 5173 PWs) bands (ev): -26.7715 -26.7715 -13.3998 -13.3996 -13.3948 -13.3946 -13.3777 -13.3777 -13.3662 -13.3662 -12.3811 -12.3803 -12.3759 -12.3758 -12.3599 -12.3594 -12.3428 -12.3425 -12.3221 -12.3221 -12.3089 -12.3086 -9.6486 -9.6482 -8.5703 -8.5696 -8.4691 -8.4690 -2.3403 -2.3399 -2.1021 -2.1012 1.1486 1.1489 2.4475 2.4479 4.5816 4.5824 5.7663 5.7680 6.1465 6.1465 6.6267 6.6308 6.6807 6.6843 7.9493 7.9496 9.4814 9.4819 10.4100 10.4127 10.5771 10.5824 10.6351 10.6377 12.3367 12.3367 k = 0.6146 0.1437-0.7943 ( 5176 PWs) bands (ev): -26.7719 -26.7719 -13.3999 -13.3998 -13.3948 -13.3946 -13.3780 -13.3780 -13.3661 -13.3660 -12.3813 -12.3805 -12.3760 -12.3759 -12.3604 -12.3598 -12.3420 -12.3417 -12.3223 -12.3222 -12.3089 -12.3086 -9.6466 -9.6462 -8.5672 -8.5664 -8.4683 -8.4681 -2.3814 -2.3810 -2.1471 -2.1462 1.1855 1.1858 2.5263 2.5268 4.6187 4.6196 5.7316 5.7335 6.1714 6.1715 6.6799 6.6864 6.7154 6.7215 7.9936 7.9939 9.4919 9.4926 10.4781 10.4803 10.5774 10.5798 10.6639 10.6639 12.3177 12.3178 k = 0.6108 0.1428-0.7655 ( 5172 PWs) bands (ev): -26.7724 -26.7724 -13.4001 -13.3999 -13.3948 -13.3946 -13.3782 -13.3782 -13.3660 -13.3659 -12.3816 -12.3808 -12.3762 -12.3761 -12.3609 -12.3603 -12.3412 -12.3409 -12.3224 -12.3224 -12.3089 -12.3086 -9.6446 -9.6441 -8.5640 -8.5632 -8.4674 -8.4671 -2.4232 -2.4227 -2.1930 -2.1919 1.2210 1.2212 2.6073 2.6079 4.6622 4.6632 5.6978 5.6998 6.1990 6.1990 6.7263 6.7327 6.7639 6.7699 8.0382 8.0385 9.5022 9.5030 10.5353 10.5354 10.5808 10.5819 10.7027 10.7038 12.2962 12.2964 k = 0.6070 0.1419-0.7367 ( 5172 PWs) bands (ev): -26.7728 -26.7728 -13.4002 -13.4001 -13.3947 -13.3945 -13.3785 -13.3785 -13.3658 -13.3658 -12.3819 -12.3810 -12.3764 -12.3763 -12.3614 -12.3607 -12.3404 -12.3401 -12.3225 -12.3224 -12.3090 -12.3086 -9.6425 -9.6420 -8.5607 -8.5599 -8.4662 -8.4659 -2.4654 -2.4648 -2.2393 -2.2381 1.2547 1.2549 2.6900 2.6907 4.7122 4.7133 5.6657 5.6677 6.2289 6.2289 6.7657 6.7700 6.8255 6.8293 8.0833 8.0834 9.5119 9.5127 10.5367 10.5380 10.6362 10.6387 10.7451 10.7466 12.2716 12.2721 k = 0.6032 0.1410-0.7079 ( 5170 PWs) bands (ev): -26.7732 -26.7732 -13.4004 -13.4003 -13.3947 -13.3945 -13.3788 -13.3788 -13.3657 -13.3656 -12.3821 -12.3813 -12.3766 -12.3765 -12.3619 -12.3612 -12.3396 -12.3393 -12.3226 -12.3225 -12.3090 -12.3087 -9.6404 -9.6399 -8.5575 -8.5567 -8.4647 -8.4645 -2.5077 -2.5069 -2.2858 -2.2846 1.2863 1.2864 2.7737 2.7745 4.7688 4.7700 5.6360 5.6381 6.2609 6.2609 6.8032 6.8062 6.8922 6.8947 8.1287 8.1288 9.5206 9.5214 10.5223 10.5233 10.7089 10.7110 10.7881 10.7895 12.2435 12.2441 k = 0.5993 0.1401-0.6790 ( 5170 PWs) bands (ev): -26.7737 -26.7737 -13.4006 -13.4005 -13.3946 -13.3945 -13.3791 -13.3791 -13.3655 -13.3655 -12.3824 -12.3815 -12.3767 -12.3766 -12.3624 -12.3618 -12.3388 -12.3385 -12.3227 -12.3225 -12.3091 -12.3087 -9.6382 -9.6377 -8.5544 -8.5535 -8.4631 -8.4628 -2.5498 -2.5490 -2.3323 -2.3309 1.3154 1.3154 2.8578 2.8588 4.8319 4.8332 5.6095 5.6118 6.2948 6.2949 6.8408 6.8431 6.9619 6.9637 8.1746 8.1746 9.5278 9.5288 10.5059 10.5066 10.7822 10.7831 10.8315 10.8319 12.2115 12.2124 k = 0.5955 0.1392-0.6502 ( 5171 PWs) bands (ev): -26.7742 -26.7742 -13.4007 -13.4006 -13.3946 -13.3944 -13.3794 -13.3794 -13.3654 -13.3653 -12.3826 -12.3817 -12.3769 -12.3768 -12.3630 -12.3623 -12.3381 -12.3377 -12.3227 -12.3225 -12.3091 -12.3088 -9.6360 -9.6355 -8.5513 -8.5504 -8.4611 -8.4608 -2.5916 -2.5907 -2.3785 -2.3770 1.3418 1.3418 2.9416 2.9426 4.9014 4.9029 5.5871 5.5895 6.3305 6.3306 6.8791 6.8809 7.0342 7.0355 8.2209 8.2210 9.5334 9.5344 10.4889 10.4895 10.8417 10.8437 10.8820 10.8844 12.1757 12.1768 k = 0.5917 0.1383-0.6214 ( 5175 PWs) bands (ev): -26.7747 -26.7747 -13.4009 -13.4008 -13.3945 -13.3943 -13.3797 -13.3797 -13.3652 -13.3651 -12.3828 -12.3819 -12.3770 -12.3770 -12.3636 -12.3629 -12.3373 -12.3369 -12.3227 -12.3225 -12.3092 -12.3089 -9.6338 -9.6333 -8.5484 -8.5475 -8.4589 -8.4586 -2.6329 -2.6318 -2.4242 -2.4226 1.3654 1.3655 3.0244 3.0254 4.9772 4.9788 5.5697 5.5722 6.3679 6.3680 6.9182 6.9197 7.1088 7.1097 8.2677 8.2679 9.5371 9.5381 10.4718 10.4723 10.8761 10.8788 10.9512 10.9542 12.1360 12.1372 k = 0.5879 0.1374-0.5926 ( 5172 PWs) bands (ev): -26.7751 -26.7751 -13.4011 -13.4010 -13.3944 -13.3943 -13.3801 -13.3800 -13.3651 -13.3650 -12.3831 -12.3821 -12.3772 -12.3771 -12.3642 -12.3634 -12.3366 -12.3362 -12.3226 -12.3224 -12.3093 -12.3090 -9.6316 -9.6311 -8.5457 -8.5448 -8.4563 -8.4560 -2.6734 -2.6722 -2.4692 -2.4675 1.3863 1.3864 3.1051 3.1062 5.0588 5.0607 5.5582 5.5609 6.4067 6.4069 6.9581 6.9594 7.1854 7.1860 8.3149 8.3152 9.5385 9.5396 10.4550 10.4554 10.8956 10.8982 11.0261 11.0288 12.0918 12.0932 k = 0.5841 0.1365-0.5638 ( 5178 PWs) bands (ev): -26.7756 -26.7756 -13.4013 -13.4012 -13.3943 -13.3942 -13.3804 -13.3804 -13.3649 -13.3648 -12.3833 -12.3823 -12.3773 -12.3772 -12.3648 -12.3640 -12.3359 -12.3354 -12.3226 -12.3223 -12.3094 -12.3091 -9.6294 -9.6289 -8.5432 -8.5422 -8.4534 -8.4532 -2.7130 -2.7118 -2.5133 -2.5116 1.4045 1.4047 3.1830 3.1842 5.1460 5.1480 5.5536 5.5565 6.4470 6.4471 6.9987 6.9997 7.2637 7.2642 8.3626 8.3630 9.5376 9.5388 10.4385 10.4388 10.9027 10.9050 11.1006 11.1031 12.0420 12.0436 k = 0.5802 0.1356-0.5350 ( 5176 PWs) bands (ev): -26.7761 -26.7761 -13.4015 -13.4014 -13.3942 -13.3941 -13.3808 -13.3807 -13.3648 -13.3647 -12.3835 -12.3825 -12.3774 -12.3774 -12.3654 -12.3647 -12.3352 -12.3348 -12.3224 -12.3222 -12.3095 -12.3092 -9.6272 -9.6267 -8.5409 -8.5399 -8.4503 -8.4500 -2.7516 -2.7503 -2.5564 -2.5546 1.4201 1.4203 3.2572 3.2584 5.2381 5.2404 5.5571 5.5603 6.4884 6.4886 7.0397 7.0406 7.3436 7.3439 8.4106 8.4112 9.5341 9.5354 10.4226 10.4229 10.8968 10.8988 11.1728 11.1750 11.9857 11.9876 k = 0.5764 0.1348-0.5062 ( 5176 PWs) bands (ev): -26.7766 -26.7766 -13.4017 -13.4016 -13.3941 -13.3940 -13.3811 -13.3811 -13.3646 -13.3646 -12.3836 -12.3827 -12.3776 -12.3775 -12.3660 -12.3653 -12.3346 -12.3341 -12.3223 -12.3220 -12.3097 -12.3094 -9.6251 -9.6246 -8.5388 -8.5379 -8.4469 -8.4466 -2.7890 -2.7876 -2.5983 -2.5965 1.4333 1.4335 3.3267 3.3279 5.3345 5.3373 5.5697 5.5733 6.5309 6.5312 7.0811 7.0818 7.4247 7.4248 8.4588 8.4595 9.5282 9.5297 10.4075 10.4077 10.8772 10.8789 11.2412 11.2431 11.9232 11.9256 k = 0.5726 0.1339-0.4774 ( 5176 PWs) bands (ev): -26.7771 -26.7771 -13.4019 -13.4018 -13.3940 -13.3938 -13.3815 -13.3815 -13.3645 -13.3644 -12.3838 -12.3829 -12.3777 -12.3776 -12.3667 -12.3659 -12.3340 -12.3335 -12.3221 -12.3217 -12.3098 -12.3095 -9.6230 -9.6225 -8.5369 -8.5360 -8.4432 -8.4430 -2.8251 -2.8236 -2.6389 -2.6370 1.4442 1.4444 3.3907 3.3919 5.4340 5.4375 5.5928 5.5972 6.5743 6.5746 7.1226 7.1232 7.5065 7.5065 8.5068 8.5077 9.5200 9.5216 10.3932 10.3934 10.8435 10.8448 11.3038 11.3054 11.8568 11.8597 k = 0.5688 0.1330-0.4486 ( 5170 PWs) bands (ev): -26.7776 -26.7776 -13.4021 -13.4020 -13.3938 -13.3937 -13.3819 -13.3819 -13.3644 -13.3643 -12.3840 -12.3830 -12.3777 -12.3777 -12.3673 -12.3666 -12.3335 -12.3330 -12.3218 -12.3215 -12.3100 -12.3097 -9.6210 -9.6205 -8.5352 -8.5344 -8.4393 -8.4391 -2.8599 -2.8583 -2.6781 -2.6761 1.4530 1.4532 3.4485 3.4497 5.5339 5.5385 5.6293 5.6348 6.6185 6.6188 7.1639 7.1645 7.5886 7.5887 8.5541 8.5553 9.5098 9.5116 10.3799 10.3802 10.7955 10.7966 11.3575 11.3586 11.7917 11.7953 k = 0.5650 0.1321-0.4198 ( 5175 PWs) bands (ev): -26.7780 -26.7780 -13.4023 -13.4022 -13.3936 -13.3935 -13.3823 -13.3822 -13.3642 -13.3642 -12.3841 -12.3832 -12.3778 -12.3777 -12.3680 -12.3672 -12.3330 -12.3325 -12.3215 -12.3211 -12.3101 -12.3099 -9.6191 -9.6186 -8.5338 -8.5330 -8.4353 -8.4351 -2.8931 -2.8915 -2.7157 -2.7137 1.4599 1.4602 3.4997 3.5008 5.6256 5.6306 5.6887 5.6947 6.6632 6.6636 7.2049 7.2054 7.6704 7.6707 8.5999 8.6014 9.4983 9.5005 10.3677 10.3680 10.7337 10.7345 11.3966 11.3971 11.7365 11.7409 k = 0.5611 0.1312-0.3910 ( 5174 PWs) bands (ev): -26.7785 -26.7785 -13.4024 -13.4024 -13.3935 -13.3934 -13.3827 -13.3826 -13.3641 -13.3640 -12.3842 -12.3833 -12.3779 -12.3778 -12.3686 -12.3679 -12.3325 -12.3320 -12.3212 -12.3208 -12.3103 -12.3101 -9.6172 -9.6168 -8.5325 -8.5317 -8.4311 -8.4310 -2.9249 -2.9232 -2.7517 -2.7497 1.4652 1.4655 3.5438 3.5449 5.7000 5.7022 5.7824 5.7856 6.7082 6.7087 7.2453 7.2457 7.7514 7.7518 8.6428 8.6448 9.4866 9.4892 10.3563 10.3567 10.6593 10.6599 11.4121 11.4121 11.7030 11.7083 k = 0.5573 0.1303-0.3622 ( 5176 PWs) bands (ev): -26.7789 -26.7789 -13.4026 -13.4026 -13.3933 -13.3932 -13.3830 -13.3830 -13.3640 -13.3639 -12.3843 -12.3834 -12.3779 -12.3778 -12.3692 -12.3685 -12.3321 -12.3316 -12.3209 -12.3205 -12.3105 -12.3102 -9.6154 -9.6150 -8.5314 -8.5307 -8.4269 -8.4268 -2.9549 -2.9532 -2.7860 -2.7839 1.4691 1.4694 3.5810 3.5820 5.7713 5.7716 5.8913 5.8928 6.7535 6.7540 7.2848 7.2851 7.8308 7.8314 8.6811 8.6836 9.4762 9.4794 10.3446 10.3453 10.5753 10.5756 11.3983 11.3984 11.6989 11.7045 k = 0.5535 0.1294-0.3334 ( 5176 PWs) bands (ev): -26.7794 -26.7794 -13.4028 -13.4028 -13.3931 -13.3930 -13.3834 -13.3834 -13.3639 -13.3638 -12.3844 -12.3835 -12.3780 -12.3779 -12.3699 -12.3691 -12.3317 -12.3312 -12.3205 -12.3201 -12.3107 -12.3104 -9.6137 -9.6133 -8.5305 -8.5298 -8.4227 -8.4226 -2.9833 -2.9816 -2.8183 -2.8163 1.4718 1.4721 3.6116 3.6125 5.8487 5.8493 6.0047 6.0054 6.7986 6.7992 7.3231 7.3233 7.9079 7.9088 8.7120 8.7151 9.4693 9.4733 10.3285 10.3300 10.4883 10.4886 11.3635 11.3641 11.7170 11.7226 k = 0.5497 0.1285-0.3046 ( 5179 PWs) bands (ev): -26.7798 -26.7798 -13.4030 -13.4029 -13.3929 -13.3928 -13.3838 -13.3838 -13.3638 -13.3637 -12.3845 -12.3836 -12.3780 -12.3779 -12.3705 -12.3698 -12.3314 -12.3309 -12.3201 -12.3197 -12.3108 -12.3106 -9.6122 -9.6117 -8.5297 -8.5290 -8.4185 -8.4184 -3.0099 -3.0082 -2.8488 -2.8468 1.4734 1.4737 3.6359 3.6368 5.9349 5.9360 6.1197 6.1200 6.8435 6.8442 7.3599 7.3600 7.9819 7.9830 8.7322 8.7362 9.4683 9.4732 10.2928 10.2958 10.4167 10.4181 11.3198 11.3211 11.7444 11.7501 k = 0.5459 0.1276-0.2757 ( 5177 PWs) bands (ev): -26.7801 -26.7801 -13.4031 -13.4031 -13.3926 -13.3926 -13.3843 -13.3842 -13.3637 -13.3636 -12.3846 -12.3837 -12.3780 -12.3779 -12.3711 -12.3704 -12.3311 -12.3306 -12.3197 -12.3193 -12.3110 -12.3108 -9.6107 -9.6103 -8.5290 -8.5284 -8.4145 -8.4144 -3.0348 -3.0331 -2.8773 -2.8753 1.4742 1.4745 3.6548 3.6555 6.0301 6.0314 6.2350 6.2352 6.8880 6.8888 7.3948 7.3949 8.0517 8.0533 8.7384 8.7432 9.4749 9.4809 10.2194 10.2234 10.3849 10.3868 11.2744 11.2763 11.7713 11.7775 k = 0.5420 0.1267-0.2469 ( 5177 PWs) bands (ev): -26.7805 -26.7805 -13.4033 -13.4033 -13.3924 -13.3924 -13.3847 -13.3846 -13.3636 -13.3635 -12.3846 -12.3838 -12.3780 -12.3779 -12.3716 -12.3710 -12.3308 -12.3303 -12.3194 -12.3190 -12.3112 -12.3110 -9.6093 -9.6089 -8.5284 -8.5278 -8.4105 -8.4105 -3.0577 -3.0561 -2.9037 -2.9018 1.4743 1.4746 3.6688 3.6695 6.1333 6.1348 6.3497 6.3500 6.9316 6.9326 7.4277 7.4277 8.1165 8.1187 8.7279 8.7336 9.4887 9.4959 10.1289 10.1335 10.3783 10.3800 11.2302 11.2326 11.7830 11.7886 k = 0.5382 0.1258-0.2181 ( 5182 PWs) bands (ev): -26.7808 -26.7808 -13.4034 -13.4034 -13.3922 -13.3921 -13.3851 -13.3850 -13.3635 -13.3634 -12.3846 -12.3838 -12.3780 -12.3779 -12.3722 -12.3716 -12.3305 -12.3301 -12.3190 -12.3186 -12.3114 -12.3112 -9.6080 -9.6077 -8.5279 -8.5274 -8.4068 -8.4067 -3.0788 -3.0772 -2.9280 -2.9262 1.4740 1.4742 3.6788 3.6794 6.2439 6.2454 6.4628 6.4632 6.9744 6.9756 7.4581 7.4582 8.1751 8.1783 8.6994 8.7062 9.5048 9.5133 10.0447 10.0503 10.3818 10.3835 11.1880 11.1911 11.7440 11.7441 k = 0.5344 0.1249-0.1893 ( 5187 PWs) bands (ev): -26.7812 -26.7812 -13.4035 -13.4035 -13.3919 -13.3919 -13.3855 -13.3855 -13.3634 -13.3634 -12.3846 -12.3839 -12.3779 -12.3779 -12.3727 -12.3721 -12.3303 -12.3299 -12.3186 -12.3182 -12.3115 -12.3114 -9.6068 -9.6065 -8.5274 -8.5270 -8.4032 -8.4032 -3.0980 -3.0965 -2.9501 -2.9484 1.4732 1.4735 3.6855 3.6861 6.3605 6.3619 6.5730 6.5739 7.0162 7.0176 7.4859 7.4860 8.2264 8.2309 8.6536 8.6618 9.5122 9.5215 9.9846 9.9909 10.3916 10.3932 11.1481 11.1518 11.6621 11.6654 k = 0.5306 0.1240-0.1605 ( 5186 PWs) bands (ev): -26.7814 -26.7814 -13.4037 -13.4037 -13.3916 -13.3916 -13.3859 -13.3859 -13.3633 -13.3633 -12.3846 -12.3839 -12.3779 -12.3778 -12.3732 -12.3726 -12.3301 -12.3297 -12.3183 -12.3179 -12.3117 -12.3116 -9.6058 -9.6055 -8.5271 -8.5267 -8.4000 -8.4000 -3.1152 -3.1138 -2.9701 -2.9685 1.4723 1.4725 3.6897 3.6902 6.4821 6.4832 6.6791 6.6808 7.0569 7.0587 7.5110 7.5111 8.2682 8.2751 8.5925 8.6029 9.4971 9.5061 9.9647 9.9708 10.4063 10.4080 11.1104 11.1146 11.5741 11.5786 k = 0.5267 0.1231-0.1317 ( 5180 PWs) bands (ev): -26.7817 -26.7817 -13.4038 -13.4038 -13.3913 -13.3913 -13.3863 -13.3863 -13.3633 -13.3632 -12.3846 -12.3840 -12.3779 -12.3778 -12.3736 -12.3731 -12.3299 -12.3296 -12.3179 -12.3176 -12.3118 -12.3118 -9.6048 -9.6046 -8.5268 -8.5264 -8.3970 -8.3970 -3.1304 -3.1291 -2.9877 -2.9862 1.4711 1.4713 3.6919 3.6923 6.6070 6.6075 6.7797 6.7827 7.0968 7.0991 7.5331 7.5331 8.2965 8.3079 8.5204 8.5348 9.4562 9.4638 9.9885 9.9936 10.4259 10.4277 11.0745 11.0792 11.4872 11.4922 k = 0.5229 0.1222-0.1029 ( 5182 PWs) bands (ev): -26.7819 -26.7819 -13.4039 -13.4039 -13.3910 -13.3910 -13.3867 -13.3867 -13.3632 -13.3632 -12.3845 -12.3840 -12.3778 -12.3778 -12.3740 -12.3736 -12.3297 -12.3295 -12.3176 -12.3173 -12.3120 -12.3119 -9.6040 -9.6038 -8.5265 -8.5262 -8.3944 -8.3944 -3.1436 -3.1425 -3.0030 -3.0018 1.4700 1.4702 3.6928 3.6931 6.7319 6.7328 6.8736 6.8789 7.1363 7.1393 7.5521 7.5523 8.2991 8.3174 8.4503 8.4712 9.4003 9.4063 10.0439 10.0478 10.4502 10.4521 11.0400 11.0451 11.4032 11.4087 k = 0.5191 0.1214-0.0741 ( 5191 PWs) bands (ev): -26.7821 -26.7821 -13.4039 -13.4039 -13.3907 -13.3907 -13.3871 -13.3871 -13.3632 -13.3631 -12.3845 -12.3840 -12.3778 -12.3777 -12.3744 -12.3740 -12.3296 -12.3294 -12.3173 -12.3171 -12.3121 -12.3121 -9.6033 -9.6032 -8.5263 -8.5261 -8.3921 -8.3921 -3.1548 -3.1538 -3.0161 -3.0150 1.4689 1.4690 3.6928 3.6931 6.8505 6.8538 6.9621 6.9710 7.1763 7.1801 7.5682 7.5687 8.2530 8.2703 8.4178 8.4371 9.3419 9.3465 10.1164 10.1194 10.4797 10.4816 11.0060 11.0115 11.3230 11.3289 k = 0.5153 0.1205-0.0453 ( 5194 PWs) bands (ev): -26.7823 -26.7823 -13.4040 -13.4040 -13.3904 -13.3904 -13.3875 -13.3875 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3747 -12.3744 -12.3295 -12.3293 -12.3171 -12.3169 -12.3122 -12.3122 -9.6028 -9.6026 -8.5262 -8.5260 -8.3902 -8.3902 -3.1640 -3.1632 -3.0267 -3.0258 1.4679 1.4680 3.6923 3.6925 6.9498 6.9553 7.0542 7.0667 7.2181 7.2224 7.5817 7.5829 8.1634 8.1745 8.4174 8.4299 9.2889 9.2924 10.1949 10.1974 10.5149 10.5170 10.9713 10.9771 11.2472 11.2533 k = 0.5115 0.1196-0.0165 ( 5193 PWs) bands (ev): -26.7824 -26.7824 -13.4041 -13.4041 -13.3901 -13.3901 -13.3878 -13.3878 -13.3631 -13.3631 -12.3844 -12.3841 -12.3777 -12.3777 -12.3749 -12.3747 -12.3294 -12.3292 -12.3169 -12.3167 -12.3123 -12.3123 -9.6023 -9.6022 -8.5260 -8.5259 -8.3888 -8.3888 -3.1711 -3.1705 -3.0350 -3.0343 1.4671 1.4672 3.6915 3.6917 7.0177 7.0221 7.1575 7.1691 7.2647 7.2682 7.5939 7.5962 8.0544 8.0616 8.4213 8.4293 9.2457 9.2482 10.2699 10.2720 10.5575 10.5594 10.9340 10.9397 11.1775 11.1835 k = 0.5076 0.1187 0.0123 ( 5191 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3897 -13.3897 -13.3882 -13.3882 -13.3631 -13.3631 -12.3843 -12.3841 -12.3776 -12.3776 -12.3751 -12.3749 -12.3293 -12.3292 -12.3167 -12.3166 -12.3124 -12.3124 -9.6020 -9.6019 -8.5259 -8.5258 -8.3877 -8.3877 -3.1762 -3.1757 -3.0409 -3.0404 1.4665 1.4665 3.6909 3.6910 7.0589 7.0613 7.2441 7.2491 7.3286 7.3310 7.6082 7.6120 7.9386 7.9432 8.4236 8.4284 9.2142 9.2159 10.3317 10.3333 10.6089 10.6103 10.8915 10.8965 11.1188 11.1238 k = 0.5038 0.1178 0.0411 ( 5219 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3894 -13.3894 -13.3886 -13.3886 -13.3631 -13.3631 -12.3843 -12.3842 -12.3776 -12.3776 -12.3752 -12.3751 -12.3293 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6018 -9.6018 -8.5259 -8.5258 -8.3870 -8.3870 -3.1792 -3.1789 -3.0444 -3.0442 1.4661 1.4661 3.6904 3.6905 7.0810 7.0820 7.2853 7.2858 7.4043 7.4095 7.6353 7.6396 7.8266 7.8286 8.4245 8.4268 9.1955 9.1963 10.3719 10.3728 10.6653 10.6659 10.8442 10.8473 11.0797 11.0825 k = 0.5000 0.1169 0.0699 ( 5210 PWs) bands (ev): -26.7825 -26.7825 -13.4041 -13.4041 -13.3892 -13.3892 -13.3888 -13.3888 -13.3631 -13.3631 -12.3842 -12.3842 -12.3776 -12.3776 -12.3752 -12.3752 -12.3292 -12.3292 -12.3166 -12.3166 -12.3124 -12.3124 -9.6017 -9.6017 -8.5258 -8.5258 -8.3868 -8.3868 -3.1801 -3.1801 -3.0455 -3.0455 1.4660 1.4660 3.6903 3.6903 7.0883 7.0883 7.2965 7.2965 7.4418 7.4418 7.6734 7.6734 7.7562 7.7562 8.4254 8.4254 9.1895 9.1895 10.3860 10.3860 10.6991 10.6991 10.8153 10.8153 11.0670 11.0670 k = 0.5000-1.0110-0.6050 ( 5166 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3785 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6619 -8.5925 -8.5925 -8.4717 -8.4717 -1.9244 -1.9244 -1.8720 -1.8720 0.7776 0.7776 1.9783 1.9783 4.5543 4.5543 5.6885 5.6885 5.9400 5.9400 6.1070 6.1070 6.6300 6.6300 7.9945 7.9945 9.1906 9.1906 10.3985 10.3985 10.4503 10.4503 10.6656 10.6656 11.4649 11.4649 k = 0.5267-1.0012-0.5991 ( 5164 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6619 -8.5925 -8.5925 -8.4717 -8.4717 -1.9274 -1.9274 -1.8690 -1.8690 0.7781 0.7781 1.9773 1.9773 4.5533 4.5533 5.6913 5.6914 5.9415 5.9415 6.1079 6.1079 6.6286 6.6286 7.9908 7.9908 9.1918 9.1918 10.3891 10.3915 10.4527 10.4542 10.6624 10.6635 11.4783 11.4786 k = 0.5535-0.9915-0.5933 ( 5171 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6619 -8.5925 -8.5925 -8.4717 -8.4717 -1.9351 -1.9351 -1.8614 -1.8613 0.7797 0.7797 1.9741 1.9741 4.5506 4.5507 5.6997 5.6998 5.9459 5.9461 6.1105 6.1106 6.6243 6.6243 7.9795 7.9796 9.1956 9.1957 10.3650 10.3687 10.4609 10.4632 10.6552 10.6570 11.5170 11.5173 k = 0.5802-0.9817-0.5875 ( 5171 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6619 -9.6618 -8.5925 -8.5925 -8.4717 -8.4717 -1.9450 -1.9450 -1.8515 -1.8515 0.7824 0.7824 1.9689 1.9689 4.5462 4.5463 5.7133 5.7134 5.9535 5.9537 6.1148 6.1148 6.6172 6.6172 7.9607 7.9609 9.2023 9.2024 10.3285 10.3328 10.4740 10.4768 10.6462 10.6482 11.5765 11.5769 k = 0.6070-0.9720-0.5816 ( 5179 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3948 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6618 -9.6618 -8.5925 -8.5925 -8.4717 -8.4717 -1.9558 -1.9558 -1.8408 -1.8408 0.7860 0.7860 1.9617 1.9618 4.5404 4.5405 5.7317 5.7318 5.9645 5.9647 6.1204 6.1205 6.6074 6.6075 7.9345 7.9347 9.2123 9.2125 10.2825 10.2868 10.4912 10.4945 10.6370 10.6384 11.6517 11.6522 k = 0.6337-0.9623-0.5758 ( 5181 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3561 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6618 -9.6618 -8.5925 -8.5924 -8.4717 -8.4717 -1.9669 -1.9668 -1.8299 -1.8298 0.7906 0.7906 1.9529 1.9530 4.5334 4.5335 5.7542 5.7544 5.9791 5.9794 6.1272 6.1274 6.5952 6.5954 7.9009 7.9012 9.2263 9.2265 10.2302 10.2344 10.5111 10.5153 10.6284 10.6288 11.7381 11.7385 k = 0.6605-0.9525-0.5700 ( 5184 PWs) bands (ev): -26.7689 -26.7689 -13.3987 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3562 -12.3561 -12.3492 -12.3492 -12.3204 -12.3204 -12.3092 -12.3092 -9.6618 -9.6618 -8.5924 -8.5924 -8.4717 -8.4717 -1.9778 -1.9778 -1.8191 -1.8191 0.7960 0.7960 1.9427 1.9427 4.5256 4.5258 5.7799 5.7801 5.9978 5.9981 6.1350 6.1352 6.5808 6.5810 7.8603 7.8607 9.2445 9.2447 10.1748 10.1786 10.5305 10.5362 10.6213 10.6228 11.8321 11.8325 k = 0.6872-0.9428-0.5642 ( 5184 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3562 -12.3561 -12.3491 -12.3491 -12.3204 -12.3204 -12.3092 -12.3092 -9.6618 -9.6618 -8.5924 -8.5923 -8.4717 -8.4717 -1.9885 -1.9885 -1.8088 -1.8087 0.8021 0.8022 1.9313 1.9313 4.5173 4.5175 5.8077 5.8078 6.0210 6.0214 6.1436 6.1437 6.5644 6.5646 7.8131 7.8135 9.2673 9.2675 10.1185 10.1221 10.5413 10.5485 10.6235 10.6268 11.9309 11.9313 k = 0.7140-0.9330-0.5583 ( 5183 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3785 -12.3784 -12.3749 -12.3749 -12.3562 -12.3561 -12.3491 -12.3491 -12.3204 -12.3204 -12.3092 -12.3091 -9.6618 -9.6617 -8.5924 -8.5923 -8.4717 -8.4717 -1.9988 -1.9987 -1.7989 -1.7989 0.8089 0.8090 1.9190 1.9190 4.5089 4.5091 5.8363 5.8364 6.0490 6.0494 6.1530 6.1531 6.5463 6.5465 7.7598 7.7602 9.2947 9.2950 10.0632 10.0665 10.5362 10.5428 10.6439 10.6469 12.0324 12.0327 k = 0.7407-0.9233-0.5525 ( 5179 PWs) bands (ev): -26.7689 -26.7689 -13.3988 -13.3987 -13.3948 -13.3947 -13.3761 -13.3761 -13.3672 -13.3672 -12.3786 -12.3784 -12.3749 -12.3749 -12.3562 -12.3561 -12.3491 -12.3491 -12.3205 -12.3204 -12.3092 -12.3091 -9.6617 -9.6617 -8.5923 -8.5922 -8.4717 -8.4717 -2.0085 -2.0085 -1.7898 -1.7897 0.8162 0.8163 1.9062 1.9062 4.5007 4.5009 5.8646 5.8648 6.0812 6.0816 6.1639 6.1640 6.5269 6.5272 7.7013 7.7017 9.3267 9.3270 10.0102 10.0133 10.5184 10.5238 10.6768 10.6789 12.1349 12.1352 k = 0.7675-0.9136-0.5467 ( 5185 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3562 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3092 -12.3091 -9.6617 -9.6617 -8.5922 -8.5922 -8.4717 -8.4717 -2.0175 -2.0175 -1.7815 -1.7814 0.8238 0.8239 1.8932 1.8932 4.4930 4.4932 5.8918 5.8920 6.1142 6.1146 6.1795 6.1795 6.5065 6.5069 7.6384 7.6388 9.3628 9.3631 9.9603 9.9632 10.4935 10.4980 10.7155 10.7170 12.2369 12.2372 k = 0.7942-0.9038-0.5408 ( 5178 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3490 -12.3205 -12.3205 -12.3092 -12.3091 -9.6617 -9.6616 -8.5922 -8.5921 -8.4717 -8.4717 -2.0259 -2.0259 -1.7741 -1.7740 0.8315 0.8317 1.8804 1.8804 4.4862 4.4864 5.9174 5.9175 6.1396 6.1400 6.2071 6.2072 6.4857 6.4861 7.5722 7.5726 9.4023 9.4026 9.9143 9.9170 10.4644 10.4682 10.7570 10.7581 12.3364 12.3368 k = 0.8210-0.8941-0.5350 ( 5181 PWs) bands (ev): -26.7690 -26.7690 -13.3988 -13.3987 -13.3948 -13.3947 -13.3762 -13.3762 -13.3672 -13.3672 -12.3786 -12.3785 -12.3749 -12.3749 -12.3563 -12.3562 -12.3490 -12.3489 -12.3205 -12.3205 -12.3092 -12.3091 -9.6616 -9.6616 -8.5921 -8.5920 -8.4717 -8.4717 -2.0335 -2.0335 -1.7677 -1.7676 0.8393 0.8394 1.8682 1.8682 4.4804 4.4806 5.9413 5.9413 6.1532 6.1535 6.2500 6.2502 6.4649 6.4655 7.5038 7.5043 9.4441 9.4445 9.8724 9.8750 10.4333 10.4365 10.7996 10.8004 12.4304 12.4309 Writing output data file SrxSnAsx2.save init_run : 3.45s CPU 12.14s WALL ( 1 calls) electrons : 1078.69s CPU 1086.89s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.50s CPU 1.61s WALL ( 1 calls) Called by electrons: c_bands : 1078.66s CPU 1086.24s WALL ( 1 calls) v_of_rho : 0.25s CPU 0.97s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.23s CPU 0.64s WALL ( 1 calls) newd : 0.35s CPU 0.57s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.08s WALL ( 282 calls) cegterg : 1009.98s CPU 1014.69s WALL ( 572 calls) Called by sum_band: Called by *egterg: h_psi : 717.32s CPU 724.64s WALL ( 8662 calls) s_psi : 25.09s CPU 25.51s WALL ( 8662 calls) g_psi : 0.67s CPU 0.73s WALL ( 7808 calls) cdiaghg : 217.87s CPU 216.26s WALL ( 8090 calls) cegterg:over : 53.50s CPU 51.45s WALL ( 7808 calls) cegterg:upda : 13.59s CPU 15.85s WALL ( 7808 calls) cegterg:last : 11.05s CPU 11.63s WALL ( 1529 calls) Called by h_psi: h_psi:vloc : 666.05s CPU 671.89s WALL ( 8662 calls) h_psi:vnl : 50.96s CPU 51.91s WALL ( 8662 calls) add_vuspsi : 17.40s CPU 20.20s WALL ( 8662 calls) General routines calbec : 33.52s CPU 31.55s WALL ( 8662 calls) fft : 0.40s CPU 1.06s WALL ( 19 calls) ffts : 0.01s CPU 0.04s WALL ( 4 calls) fftw : 612.09s CPU 614.87s WALL ( 1051164 calls) interpolate : 0.02s CPU 0.07s WALL ( 4 calls) davcio : 0.04s CPU 1.58s WALL ( 564 calls) Parallel routines fft_scatter : 277.84s CPU 291.96s WALL ( 1051187 calls) PWSCF : 18m55.02s CPU 21m 8.24s WALL This run was terminated on: 3:29:41 11Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=