Program PWSCF v.5.3.0 (svn rev. 11974) starts on 30Jan2017 at 23:36:34 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./BaxGe3Ptx4.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 91 34 9 4661 1079 161 Max 93 35 10 4665 1111 167 Sum 6563 2475 709 335731 78469 11849 bravais-lattice index = 14 lattice parameter (alat) = 14.2115 a.u. unit-cell volume = 2209.5099 (a.u.)^3 number of atoms/cell = 17 number of atomic types = 3 number of electrons = 98.00 number of Kohn-Sham states= 118 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.211479 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.333333 celldm(5)= -0.333333 celldm(6)= -0.333333 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.333333 0.942809 0.000000 ) a(3) = ( -0.333333 -0.471405 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.353553 0.612372 ) b(2) = ( 0.000000 1.060660 0.612372 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 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 Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 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 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc 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 1277 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 Ge 4.00 72.64000 Ge( 1.00) Ba 10.00 137.32700 Ba( 1.00) Pt 10.00 195.08400 Pt( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 178 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 2) = ( 0.0135135 -0.0095555 0.0165506), wk = 0.0056180 k( 3) = ( 0.0270270 -0.0191110 0.0331012), wk = 0.0056180 k( 4) = ( 0.0405405 -0.0286665 0.0496518), wk = 0.0056180 k( 5) = ( 0.0540540 -0.0382220 0.0662024), wk = 0.0056180 k( 6) = ( 0.0675676 -0.0477775 0.0827530), wk = 0.0056180 k( 7) = ( 0.0810811 -0.0573330 0.0993036), wk = 0.0056180 k( 8) = ( 0.0945946 -0.0668885 0.1158542), wk = 0.0056180 k( 9) = ( 0.1081081 -0.0764440 0.1324049), wk = 0.0056180 k( 10) = ( 0.1216216 -0.0859995 0.1489555), wk = 0.0056180 k( 11) = ( 0.1351351 -0.0955550 0.1655061), wk = 0.0056180 k( 12) = ( 0.1486486 -0.1051105 0.1820567), wk = 0.0056180 k( 13) = ( 0.1621622 -0.1146660 0.1986073), wk = 0.0056180 k( 14) = ( 0.1756757 -0.1242215 0.2151579), wk = 0.0056180 k( 15) = ( 0.1891892 -0.1337770 0.2317085), wk = 0.0056180 k( 16) = ( 0.2027027 -0.1433325 0.2482591), wk = 0.0056180 k( 17) = ( 0.2162162 -0.1528880 0.2648097), wk = 0.0056180 k( 18) = ( 0.2297297 -0.1624434 0.2813603), wk = 0.0056180 k( 19) = ( 0.2432432 -0.1719989 0.2979109), wk = 0.0056180 k( 20) = ( 0.2567568 -0.1815544 0.3144615), wk = 0.0056180 k( 21) = ( 0.2702703 -0.1911099 0.3310121), wk = 0.0056180 k( 22) = ( 0.2837838 -0.2006654 0.3475627), wk = 0.0056180 k( 23) = ( 0.2972973 -0.2102209 0.3641133), wk = 0.0056180 k( 24) = ( 0.3108108 -0.2197764 0.3806639), wk = 0.0056180 k( 25) = ( 0.3243243 -0.2293319 0.3972145), wk = 0.0056180 k( 26) = ( 0.3378378 -0.2388874 0.4137652), wk = 0.0056180 k( 27) = ( 0.3513514 -0.2484429 0.4303158), wk = 0.0056180 k( 28) = ( 0.3648649 -0.2579984 0.4468664), wk = 0.0056180 k( 29) = ( 0.3783784 -0.2675539 0.4634170), wk = 0.0056180 k( 30) = ( 0.3918919 -0.2771094 0.4799676), wk = 0.0056180 k( 31) = ( 0.4054054 -0.2866649 0.4965182), wk = 0.0056180 k( 32) = ( 0.4189189 -0.2962204 0.5130688), wk = 0.0056180 k( 33) = ( 0.4324324 -0.3057759 0.5296194), wk = 0.0056180 k( 34) = ( 0.4459459 -0.3153314 0.5461700), wk = 0.0056180 k( 35) = ( 0.4594595 -0.3248869 0.5627206), wk = 0.0056180 k( 36) = ( 0.4729730 -0.3344424 0.5792712), wk = 0.0056180 k( 37) = ( 0.4864865 -0.3439979 0.5958218), wk = 0.0056180 k( 38) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0056180 k( 39) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0056180 k( 40) = ( 0.4807692 -0.3399552 0.6123724), wk = 0.0056180 k( 41) = ( 0.4615385 -0.3263570 0.6123724), wk = 0.0056180 k( 42) = ( 0.4423077 -0.3127588 0.6123724), wk = 0.0056180 k( 43) = ( 0.4230769 -0.2991606 0.6123724), wk = 0.0056180 k( 44) = ( 0.4038462 -0.2855624 0.6123724), wk = 0.0056180 k( 45) = ( 0.3846154 -0.2719641 0.6123724), wk = 0.0056180 k( 46) = ( 0.3653846 -0.2583659 0.6123724), wk = 0.0056180 k( 47) = ( 0.3461538 -0.2447677 0.6123724), wk = 0.0056180 k( 48) = ( 0.3269231 -0.2311695 0.6123724), wk = 0.0056180 k( 49) = ( 0.3076923 -0.2175713 0.6123724), wk = 0.0056180 k( 50) = ( 0.2884615 -0.2039731 0.6123724), wk = 0.0056180 k( 51) = ( 0.2692308 -0.1903749 0.6123724), wk = 0.0056180 k( 52) = ( 0.2500000 -0.1767767 0.6123724), wk = 0.0056180 k( 53) = ( 0.2307692 -0.1631785 0.6123724), wk = 0.0056180 k( 54) = ( 0.2115385 -0.1495803 0.6123724), wk = 0.0056180 k( 55) = ( 0.1923077 -0.1359821 0.6123724), wk = 0.0056180 k( 56) = ( 0.1730769 -0.1223839 0.6123724), wk = 0.0056180 k( 57) = ( 0.1538461 -0.1087857 0.6123724), wk = 0.0056180 k( 58) = ( 0.1346154 -0.0951874 0.6123724), wk = 0.0056180 k( 59) = ( 0.1153846 -0.0815892 0.6123724), wk = 0.0056180 k( 60) = ( 0.0961538 -0.0679910 0.6123724), wk = 0.0056180 k( 61) = ( 0.0769231 -0.0543928 0.6123724), wk = 0.0056180 k( 62) = ( 0.0576923 -0.0407946 0.6123724), wk = 0.0056180 k( 63) = ( 0.0384615 -0.0271964 0.6123724), wk = 0.0056180 k( 64) = ( 0.0192308 -0.0135982 0.6123724), wk = 0.0056180 k( 65) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0056180 k( 66) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0056180 k( 67) = ( 0.0000000 0.0000000 0.5888196), wk = 0.0056180 k( 68) = ( 0.0000000 0.0000000 0.5652669), wk = 0.0056180 k( 69) = ( 0.0000000 0.0000000 0.5417141), wk = 0.0056180 k( 70) = ( 0.0000000 0.0000000 0.5181613), wk = 0.0056180 k( 71) = ( 0.0000000 0.0000000 0.4946085), wk = 0.0056180 k( 72) = ( 0.0000000 0.0000000 0.4710557), wk = 0.0056180 k( 73) = ( 0.0000000 0.0000000 0.4475029), wk = 0.0056180 k( 74) = ( 0.0000000 0.0000000 0.4239502), wk = 0.0056180 k( 75) = ( 0.0000000 0.0000000 0.4003974), wk = 0.0056180 k( 76) = ( 0.0000000 0.0000000 0.3768446), wk = 0.0056180 k( 77) = ( 0.0000000 0.0000000 0.3532918), wk = 0.0056180 k( 78) = ( 0.0000000 0.0000000 0.3297390), wk = 0.0056180 k( 79) = ( 0.0000000 0.0000000 0.3061862), wk = 0.0056180 k( 80) = ( 0.0000000 0.0000000 0.2826334), wk = 0.0056180 k( 81) = ( 0.0000000 0.0000000 0.2590806), wk = 0.0056180 k( 82) = ( 0.0000000 0.0000000 0.2355279), wk = 0.0056180 k( 83) = ( 0.0000000 0.0000000 0.2119751), wk = 0.0056180 k( 84) = ( 0.0000000 0.0000000 0.1884223), wk = 0.0056180 k( 85) = ( 0.0000000 0.0000000 0.1648695), wk = 0.0056180 k( 86) = ( 0.0000000 0.0000000 0.1413167), wk = 0.0056180 k( 87) = ( 0.0000000 0.0000000 0.1177639), wk = 0.0056180 k( 88) = ( 0.0000000 0.0000000 0.0942111), wk = 0.0056180 k( 89) = ( 0.0000000 0.0000000 0.0706584), wk = 0.0056180 k( 90) = ( 0.0000000 0.0000000 0.0471056), wk = 0.0056180 k( 91) = ( 0.0000000 0.0000000 0.0235528), wk = 0.0056180 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 94) = ( 0.0078125 0.0110485 0.0191366), wk = 0.0056180 k( 95) = ( 0.0156250 0.0220971 0.0382733), wk = 0.0056180 k( 96) = ( 0.0234375 0.0331456 0.0574099), wk = 0.0056180 k( 97) = ( 0.0312500 0.0441942 0.0765466), wk = 0.0056180 k( 98) = ( 0.0390625 0.0552427 0.0956832), wk = 0.0056180 k( 99) = ( 0.0468750 0.0662913 0.1148198), wk = 0.0056180 k( 100) = ( 0.0546875 0.0773398 0.1339565), wk = 0.0056180 k( 101) = ( 0.0625000 0.0883883 0.1530931), wk = 0.0056180 k( 102) = ( 0.0703125 0.0994369 0.1722297), wk = 0.0056180 k( 103) = ( 0.0781250 0.1104854 0.1913664), wk = 0.0056180 k( 104) = ( 0.0859375 0.1215340 0.2105030), wk = 0.0056180 k( 105) = ( 0.0937500 0.1325825 0.2296397), wk = 0.0056180 k( 106) = ( 0.1015625 0.1436311 0.2487763), wk = 0.0056180 k( 107) = ( 0.1093750 0.1546796 0.2679129), wk = 0.0056180 k( 108) = ( 0.1171875 0.1657282 0.2870496), wk = 0.0056180 k( 109) = ( 0.1250000 0.1767767 0.3061862), wk = 0.0056180 k( 110) = ( 0.1328125 0.1878252 0.3253229), wk = 0.0056180 k( 111) = ( 0.1406250 0.1988738 0.3444595), wk = 0.0056180 k( 112) = ( 0.1484375 0.2099223 0.3635961), wk = 0.0056180 k( 113) = ( 0.1562500 0.2209709 0.3827328), wk = 0.0056180 k( 114) = ( 0.1640625 0.2320194 0.4018694), wk = 0.0056180 k( 115) = ( 0.1718750 0.2430680 0.4210060), wk = 0.0056180 k( 116) = ( 0.1796875 0.2541165 0.4401427), wk = 0.0056180 k( 117) = ( 0.1875000 0.2651650 0.4592793), wk = 0.0056180 k( 118) = ( 0.1953125 0.2762136 0.4784160), wk = 0.0056180 k( 119) = ( 0.2031250 0.2872621 0.4975526), wk = 0.0056180 k( 120) = ( 0.2109375 0.2983107 0.5166892), wk = 0.0056180 k( 121) = ( 0.2187500 0.3093592 0.5358259), wk = 0.0056180 k( 122) = ( 0.2265625 0.3204078 0.5549625), wk = 0.0056180 k( 123) = ( 0.2343750 0.3314563 0.5740992), wk = 0.0056180 k( 124) = ( 0.2421875 0.3425048 0.5932358), wk = 0.0056180 k( 125) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0056180 k( 126) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0056180 k( 127) = ( 0.2578125 0.3314563 0.6123724), wk = 0.0056180 k( 128) = ( 0.2656250 0.3093592 0.6123724), wk = 0.0056180 k( 129) = ( 0.2734375 0.2872621 0.6123724), wk = 0.0056180 k( 130) = ( 0.2812500 0.2651650 0.6123724), wk = 0.0056180 k( 131) = ( 0.2890625 0.2430680 0.6123724), wk = 0.0056180 k( 132) = ( 0.2968750 0.2209709 0.6123724), wk = 0.0056180 k( 133) = ( 0.3046875 0.1988738 0.6123724), wk = 0.0056180 k( 134) = ( 0.3125000 0.1767767 0.6123724), wk = 0.0056180 k( 135) = ( 0.3203125 0.1546796 0.6123724), wk = 0.0056180 k( 136) = ( 0.3281250 0.1325825 0.6123724), wk = 0.0056180 k( 137) = ( 0.3359375 0.1104854 0.6123724), wk = 0.0056180 k( 138) = ( 0.3437500 0.0883883 0.6123724), wk = 0.0056180 k( 139) = ( 0.3515625 0.0662913 0.6123724), wk = 0.0056180 k( 140) = ( 0.3593750 0.0441942 0.6123724), wk = 0.0056180 k( 141) = ( 0.3671875 0.0220971 0.6123724), wk = 0.0056180 k( 142) = ( 0.3750000 -0.0000000 0.6123724), wk = 0.0056180 k( 143) = ( 0.3828125 -0.0220971 0.6123724), wk = 0.0056180 k( 144) = ( 0.3906250 -0.0441942 0.6123724), wk = 0.0056180 k( 145) = ( 0.3984375 -0.0662913 0.6123724), wk = 0.0056180 k( 146) = ( 0.4062500 -0.0883883 0.6123724), wk = 0.0056180 k( 147) = ( 0.4140625 -0.1104854 0.6123724), wk = 0.0056180 k( 148) = ( 0.4218750 -0.1325825 0.6123724), wk = 0.0056180 k( 149) = ( 0.4296875 -0.1546796 0.6123724), wk = 0.0056180 k( 150) = ( 0.4375000 -0.1767767 0.6123724), wk = 0.0056180 k( 151) = ( 0.4453125 -0.1988738 0.6123724), wk = 0.0056180 k( 152) = ( 0.4531250 -0.2209709 0.6123724), wk = 0.0056180 k( 153) = ( 0.4609375 -0.2430680 0.6123724), wk = 0.0056180 k( 154) = ( 0.4687500 -0.2651650 0.6123724), wk = 0.0056180 k( 155) = ( 0.4765625 -0.2872621 0.6123724), wk = 0.0056180 k( 156) = ( 0.4843750 -0.3093592 0.6123724), wk = 0.0056180 k( 157) = ( 0.4921875 -0.3314563 0.6123724), wk = 0.0056180 k( 158) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0056180 k( 159) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0056180 k( 160) = ( 0.2368421 0.3349453 0.6123724), wk = 0.0056180 k( 161) = ( 0.2236842 0.3163372 0.6123724), wk = 0.0056180 k( 162) = ( 0.2105263 0.2977292 0.6123724), wk = 0.0056180 k( 163) = ( 0.1973684 0.2791211 0.6123724), wk = 0.0056180 k( 164) = ( 0.1842105 0.2605130 0.6123724), wk = 0.0056180 k( 165) = ( 0.1710526 0.2419049 0.6123724), wk = 0.0056180 k( 166) = ( 0.1578947 0.2232969 0.6123724), wk = 0.0056180 k( 167) = ( 0.1447368 0.2046888 0.6123724), wk = 0.0056180 k( 168) = ( 0.1315790 0.1860807 0.6123724), wk = 0.0056180 k( 169) = ( 0.1184210 0.1674727 0.6123724), wk = 0.0056180 k( 170) = ( 0.1052632 0.1488646 0.6123724), wk = 0.0056180 k( 171) = ( 0.0921053 0.1302565 0.6123724), wk = 0.0056180 k( 172) = ( 0.0789474 0.1116484 0.6123724), wk = 0.0056180 k( 173) = ( 0.0657895 0.0930404 0.6123724), wk = 0.0056180 k( 174) = ( 0.0526316 0.0744323 0.6123724), wk = 0.0056180 k( 175) = ( 0.0394737 0.0558242 0.6123724), wk = 0.0056180 k( 176) = ( 0.0263158 0.0372161 0.6123724), wk = 0.0056180 k( 177) = ( 0.0131579 0.0186081 0.6123724), wk = 0.0056180 k( 178) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0056180 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 2) = ( 0.0135135 -0.0135135 0.0135135), wk = 0.0056180 k( 3) = ( 0.0270270 -0.0270270 0.0270270), wk = 0.0056180 k( 4) = ( 0.0405405 -0.0405405 0.0405405), wk = 0.0056180 k( 5) = ( 0.0540540 -0.0540540 0.0540540), wk = 0.0056180 k( 6) = ( 0.0675676 -0.0675676 0.0675676), wk = 0.0056180 k( 7) = ( 0.0810811 -0.0810811 0.0810811), wk = 0.0056180 k( 8) = ( 0.0945946 -0.0945946 0.0945946), wk = 0.0056180 k( 9) = ( 0.1081081 -0.1081081 0.1081081), wk = 0.0056180 k( 10) = ( 0.1216216 -0.1216216 0.1216216), wk = 0.0056180 k( 11) = ( 0.1351351 -0.1351351 0.1351351), wk = 0.0056180 k( 12) = ( 0.1486486 -0.1486486 0.1486486), wk = 0.0056180 k( 13) = ( 0.1621622 -0.1621622 0.1621622), wk = 0.0056180 k( 14) = ( 0.1756757 -0.1756757 0.1756757), wk = 0.0056180 k( 15) = ( 0.1891892 -0.1891892 0.1891892), wk = 0.0056180 k( 16) = ( 0.2027027 -0.2027027 0.2027027), wk = 0.0056180 k( 17) = ( 0.2162162 -0.2162162 0.2162162), wk = 0.0056180 k( 18) = ( 0.2297297 -0.2297297 0.2297297), wk = 0.0056180 k( 19) = ( 0.2432432 -0.2432432 0.2432432), wk = 0.0056180 k( 20) = ( 0.2567568 -0.2567568 0.2567568), wk = 0.0056180 k( 21) = ( 0.2702703 -0.2702703 0.2702703), wk = 0.0056180 k( 22) = ( 0.2837838 -0.2837838 0.2837838), wk = 0.0056180 k( 23) = ( 0.2972973 -0.2972973 0.2972973), wk = 0.0056180 k( 24) = ( 0.3108108 -0.3108108 0.3108108), wk = 0.0056180 k( 25) = ( 0.3243243 -0.3243243 0.3243243), wk = 0.0056180 k( 26) = ( 0.3378378 -0.3378378 0.3378378), wk = 0.0056180 k( 27) = ( 0.3513514 -0.3513514 0.3513514), wk = 0.0056180 k( 28) = ( 0.3648649 -0.3648649 0.3648649), wk = 0.0056180 k( 29) = ( 0.3783784 -0.3783784 0.3783784), wk = 0.0056180 k( 30) = ( 0.3918919 -0.3918919 0.3918919), wk = 0.0056180 k( 31) = ( 0.4054054 -0.4054054 0.4054054), wk = 0.0056180 k( 32) = ( 0.4189189 -0.4189189 0.4189189), wk = 0.0056180 k( 33) = ( 0.4324324 -0.4324324 0.4324324), wk = 0.0056180 k( 34) = ( 0.4459459 -0.4459459 0.4459459), wk = 0.0056180 k( 35) = ( 0.4594595 -0.4594595 0.4594595), wk = 0.0056180 k( 36) = ( 0.4729730 -0.4729730 0.4729730), wk = 0.0056180 k( 37) = ( 0.4864865 -0.4864865 0.4864865), wk = 0.0056180 k( 38) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0056180 k( 39) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0056180 k( 40) = ( 0.4807692 -0.4807692 0.5000000), wk = 0.0056180 k( 41) = ( 0.4615385 -0.4615385 0.5000000), wk = 0.0056180 k( 42) = ( 0.4423077 -0.4423077 0.5000000), wk = 0.0056180 k( 43) = ( 0.4230769 -0.4230769 0.5000000), wk = 0.0056180 k( 44) = ( 0.4038462 -0.4038462 0.5000000), wk = 0.0056180 k( 45) = ( 0.3846154 -0.3846154 0.5000000), wk = 0.0056180 k( 46) = ( 0.3653846 -0.3653846 0.5000000), wk = 0.0056180 k( 47) = ( 0.3461538 -0.3461538 0.5000000), wk = 0.0056180 k( 48) = ( 0.3269231 -0.3269231 0.5000000), wk = 0.0056180 k( 49) = ( 0.3076923 -0.3076923 0.5000000), wk = 0.0056180 k( 50) = ( 0.2884615 -0.2884615 0.5000000), wk = 0.0056180 k( 51) = ( 0.2692308 -0.2692308 0.5000000), wk = 0.0056180 k( 52) = ( 0.2500000 -0.2500000 0.5000000), wk = 0.0056180 k( 53) = ( 0.2307692 -0.2307692 0.5000000), wk = 0.0056180 k( 54) = ( 0.2115385 -0.2115385 0.5000000), wk = 0.0056180 k( 55) = ( 0.1923077 -0.1923077 0.5000000), wk = 0.0056180 k( 56) = ( 0.1730769 -0.1730769 0.5000000), wk = 0.0056180 k( 57) = ( 0.1538461 -0.1538461 0.5000000), wk = 0.0056180 k( 58) = ( 0.1346154 -0.1346154 0.5000000), wk = 0.0056180 k( 59) = ( 0.1153846 -0.1153846 0.5000000), wk = 0.0056180 k( 60) = ( 0.0961538 -0.0961538 0.5000000), wk = 0.0056180 k( 61) = ( 0.0769231 -0.0769231 0.5000000), wk = 0.0056180 k( 62) = ( 0.0576923 -0.0576923 0.5000000), wk = 0.0056180 k( 63) = ( 0.0384615 -0.0384615 0.5000000), wk = 0.0056180 k( 64) = ( 0.0192308 -0.0192308 0.5000000), wk = 0.0056180 k( 65) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0056180 k( 66) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0056180 k( 67) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0056180 k( 68) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0056180 k( 69) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0056180 k( 70) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0056180 k( 71) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0056180 k( 72) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0056180 k( 73) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0056180 k( 74) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0056180 k( 75) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0056180 k( 76) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0056180 k( 77) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0056180 k( 78) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0056180 k( 79) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0056180 k( 80) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0056180 k( 81) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0056180 k( 82) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0056180 k( 83) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0056180 k( 84) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0056180 k( 85) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0056180 k( 86) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0056180 k( 87) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0056180 k( 88) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0056180 k( 89) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0056180 k( 90) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0056180 k( 91) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0056180 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0056180 k( 94) = ( 0.0078125 0.0078125 0.0078125), wk = 0.0056180 k( 95) = ( 0.0156250 0.0156250 0.0156250), wk = 0.0056180 k( 96) = ( 0.0234375 0.0234375 0.0234375), wk = 0.0056180 k( 97) = ( 0.0312500 0.0312500 0.0312500), wk = 0.0056180 k( 98) = ( 0.0390625 0.0390625 0.0390625), wk = 0.0056180 k( 99) = ( 0.0468750 0.0468750 0.0468750), wk = 0.0056180 k( 100) = ( 0.0546875 0.0546875 0.0546875), wk = 0.0056180 k( 101) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0056180 k( 102) = ( 0.0703125 0.0703125 0.0703125), wk = 0.0056180 k( 103) = ( 0.0781250 0.0781250 0.0781250), wk = 0.0056180 k( 104) = ( 0.0859375 0.0859375 0.0859375), wk = 0.0056180 k( 105) = ( 0.0937500 0.0937500 0.0937500), wk = 0.0056180 k( 106) = ( 0.1015625 0.1015625 0.1015625), wk = 0.0056180 k( 107) = ( 0.1093750 0.1093750 0.1093750), wk = 0.0056180 k( 108) = ( 0.1171875 0.1171875 0.1171875), wk = 0.0056180 k( 109) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0056180 k( 110) = ( 0.1328125 0.1328125 0.1328125), wk = 0.0056180 k( 111) = ( 0.1406250 0.1406250 0.1406250), wk = 0.0056180 k( 112) = ( 0.1484375 0.1484375 0.1484375), wk = 0.0056180 k( 113) = ( 0.1562500 0.1562500 0.1562500), wk = 0.0056180 k( 114) = ( 0.1640625 0.1640625 0.1640625), wk = 0.0056180 k( 115) = ( 0.1718750 0.1718750 0.1718750), wk = 0.0056180 k( 116) = ( 0.1796875 0.1796875 0.1796875), wk = 0.0056180 k( 117) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0056180 k( 118) = ( 0.1953125 0.1953125 0.1953125), wk = 0.0056180 k( 119) = ( 0.2031250 0.2031250 0.2031250), wk = 0.0056180 k( 120) = ( 0.2109375 0.2109375 0.2109375), wk = 0.0056180 k( 121) = ( 0.2187500 0.2187500 0.2187500), wk = 0.0056180 k( 122) = ( 0.2265625 0.2265625 0.2265625), wk = 0.0056180 k( 123) = ( 0.2343750 0.2343750 0.2343750), wk = 0.0056180 k( 124) = ( 0.2421875 0.2421875 0.2421875), wk = 0.0056180 k( 125) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0056180 k( 126) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0056180 k( 127) = ( 0.2578125 0.2265625 0.2578125), wk = 0.0056180 k( 128) = ( 0.2656250 0.2031250 0.2656250), wk = 0.0056180 k( 129) = ( 0.2734375 0.1796875 0.2734375), wk = 0.0056180 k( 130) = ( 0.2812500 0.1562500 0.2812500), wk = 0.0056180 k( 131) = ( 0.2890625 0.1328125 0.2890625), wk = 0.0056180 k( 132) = ( 0.2968750 0.1093750 0.2968750), wk = 0.0056180 k( 133) = ( 0.3046875 0.0859375 0.3046875), wk = 0.0056180 k( 134) = ( 0.3125000 0.0625000 0.3125000), wk = 0.0056180 k( 135) = ( 0.3203125 0.0390625 0.3203125), wk = 0.0056180 k( 136) = ( 0.3281250 0.0156250 0.3281250), wk = 0.0056180 k( 137) = ( 0.3359375 -0.0078125 0.3359375), wk = 0.0056180 k( 138) = ( 0.3437500 -0.0312500 0.3437500), wk = 0.0056180 k( 139) = ( 0.3515625 -0.0546875 0.3515625), wk = 0.0056180 k( 140) = ( 0.3593750 -0.0781250 0.3593750), wk = 0.0056180 k( 141) = ( 0.3671875 -0.1015625 0.3671875), wk = 0.0056180 k( 142) = ( 0.3750000 -0.1250000 0.3750000), wk = 0.0056180 k( 143) = ( 0.3828125 -0.1484375 0.3828125), wk = 0.0056180 k( 144) = ( 0.3906250 -0.1718750 0.3906250), wk = 0.0056180 k( 145) = ( 0.3984375 -0.1953125 0.3984375), wk = 0.0056180 k( 146) = ( 0.4062500 -0.2187500 0.4062500), wk = 0.0056180 k( 147) = ( 0.4140625 -0.2421875 0.4140625), wk = 0.0056180 k( 148) = ( 0.4218750 -0.2656250 0.4218750), wk = 0.0056180 k( 149) = ( 0.4296875 -0.2890625 0.4296875), wk = 0.0056180 k( 150) = ( 0.4375000 -0.3125000 0.4375000), wk = 0.0056180 k( 151) = ( 0.4453125 -0.3359375 0.4453125), wk = 0.0056180 k( 152) = ( 0.4531250 -0.3593750 0.4531250), wk = 0.0056180 k( 153) = ( 0.4609375 -0.3828125 0.4609375), wk = 0.0056180 k( 154) = ( 0.4687500 -0.4062500 0.4687500), wk = 0.0056180 k( 155) = ( 0.4765625 -0.4296875 0.4765625), wk = 0.0056180 k( 156) = ( 0.4843750 -0.4531250 0.4843750), wk = 0.0056180 k( 157) = ( 0.4921875 -0.4765625 0.4921875), wk = 0.0056180 k( 158) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0056180 k( 159) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0056180 k( 160) = ( 0.2368421 0.2368421 0.2631579), wk = 0.0056180 k( 161) = ( 0.2236842 0.2236842 0.2763158), wk = 0.0056180 k( 162) = ( 0.2105263 0.2105263 0.2894737), wk = 0.0056180 k( 163) = ( 0.1973684 0.1973684 0.3026316), wk = 0.0056180 k( 164) = ( 0.1842105 0.1842105 0.3157895), wk = 0.0056180 k( 165) = ( 0.1710526 0.1710526 0.3289474), wk = 0.0056180 k( 166) = ( 0.1578947 0.1578947 0.3421053), wk = 0.0056180 k( 167) = ( 0.1447368 0.1447368 0.3552632), wk = 0.0056180 k( 168) = ( 0.1315790 0.1315790 0.3684210), wk = 0.0056180 k( 169) = ( 0.1184210 0.1184210 0.3815789), wk = 0.0056180 k( 170) = ( 0.1052632 0.1052632 0.3947368), wk = 0.0056180 k( 171) = ( 0.0921053 0.0921053 0.4078947), wk = 0.0056180 k( 172) = ( 0.0789474 0.0789474 0.4210526), wk = 0.0056180 k( 173) = ( 0.0657895 0.0657895 0.4342105), wk = 0.0056180 k( 174) = ( 0.0526316 0.0526316 0.4473684), wk = 0.0056180 k( 175) = ( 0.0394737 0.0394737 0.4605263), wk = 0.0056180 k( 176) = ( 0.0263158 0.0263158 0.4736842), wk = 0.0056180 k( 177) = ( 0.0131579 0.0131579 0.4868421), wk = 0.0056180 k( 178) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0056180 Dense grid: 335731 G-vectors FFT dimensions: ( 96, 96, 96) Smooth grid: 78469 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.51 Mb ( 282, 118) NL pseudopotentials 0.73 Mb ( 141, 339) Each V/rho on FFT grid 0.28 Mb ( 18432) Each G-vector array 0.04 Mb ( 4665) G-vector shells 0.01 Mb ( 998) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.03 Mb ( 282, 472) Each subspace H/S matrix 0.09 Mb ( 78, 78) Each matrix 1.22 Mb ( 339, 2, 118) The potential is recalculated from file : ./BaxGe3Ptx4.save/charge-density.dat Starting wfc are 178 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 8.0 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 17.0 secs Computing kpt #: 3 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 25.8 secs Computing kpt #: 4 total cpu time spent up to now is 30.7 secs Computing kpt #: 5 total cpu time spent up to now is 35.5 secs Computing kpt #: 6 total cpu time spent up to now is 39.8 secs Computing kpt #: 7 total cpu time spent up to now is 44.4 secs Computing kpt #: 8 total cpu time spent up to now is 48.7 secs Computing kpt #: 9 total cpu time spent up to now is 52.6 secs Computing kpt #: 10 total cpu time spent up to now is 56.7 secs Computing kpt #: 11 total cpu time spent up to now is 60.7 secs Computing kpt #: 12 total cpu time spent up to now is 64.6 secs Computing kpt #: 13 total cpu time spent up to now is 68.5 secs Computing kpt #: 14 total cpu time spent up to now is 72.6 secs Computing kpt #: 15 total cpu time spent up to now is 76.6 secs Computing kpt #: 16 total cpu time spent up to now is 80.5 secs Computing kpt #: 17 total cpu time spent up to now is 84.0 secs Computing kpt #: 18 total cpu time spent up to now is 88.1 secs Computing kpt #: 19 total cpu time spent up to now is 92.1 secs Computing kpt #: 20 total cpu time spent up to now is 95.9 secs Computing kpt #: 21 total cpu time spent up to now is 99.6 secs Computing kpt #: 22 total cpu time spent up to now is 103.3 secs Computing kpt #: 23 total cpu time spent up to now is 107.1 secs Computing kpt #: 24 total cpu time spent up to now is 110.8 secs Computing kpt #: 25 total cpu time spent up to now is 114.4 secs Computing kpt #: 26 total cpu time spent up to now is 118.3 secs Computing kpt #: 27 total cpu time spent up to now is 121.7 secs Computing kpt #: 28 total cpu time spent up to now is 125.3 secs Computing kpt #: 29 total cpu time spent up to now is 128.9 secs Computing kpt #: 30 total cpu time spent up to now is 132.9 secs Computing kpt #: 31 total cpu time spent up to now is 137.6 secs Computing kpt #: 32 total cpu time spent up to now is 144.3 secs Computing kpt #: 33 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 153.2 secs Computing kpt #: 34 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 162.2 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 171.0 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 179.7 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 188.2 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 197.0 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 205.7 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 214.3 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 223.0 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 231.6 secs Computing kpt #: 43 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 240.3 secs Computing kpt #: 44 total cpu time spent up to now is 248.0 secs Computing kpt #: 45 total cpu time spent up to now is 254.0 secs Computing kpt #: 46 total cpu time spent up to now is 259.2 secs Computing kpt #: 47 total cpu time spent up to now is 264.3 secs Computing kpt #: 48 total cpu time spent up to now is 269.1 secs Computing kpt #: 49 total cpu time spent up to now is 273.3 secs Computing kpt #: 50 total cpu time spent up to now is 277.8 secs Computing kpt #: 51 total cpu time spent up to now is 282.0 secs Computing kpt #: 52 total cpu time spent up to now is 286.1 secs Computing kpt #: 53 total cpu time spent up to now is 290.0 secs Computing kpt #: 54 total cpu time spent up to now is 294.0 secs Computing kpt #: 55 total cpu time spent up to now is 298.1 secs Computing kpt #: 56 total cpu time spent up to now is 302.2 secs Computing kpt #: 57 total cpu time spent up to now is 306.2 secs Computing kpt #: 58 total cpu time spent up to now is 310.3 secs Computing kpt #: 59 total cpu time spent up to now is 314.4 secs Computing kpt #: 60 total cpu time spent up to now is 318.4 secs Computing kpt #: 61 total cpu time spent up to now is 322.6 secs Computing kpt #: 62 total cpu time spent up to now is 326.9 secs Computing kpt #: 63 total cpu time spent up to now is 331.0 secs Computing kpt #: 64 total cpu time spent up to now is 335.2 secs Computing kpt #: 65 total cpu time spent up to now is 339.4 secs Computing kpt #: 66 total cpu time spent up to now is 343.4 secs Computing kpt #: 67 total cpu time spent up to now is 347.6 secs Computing kpt #: 68 total cpu time spent up to now is 351.3 secs Computing kpt #: 69 total cpu time spent up to now is 355.5 secs Computing kpt #: 70 total cpu time spent up to now is 359.6 secs Computing kpt #: 71 total cpu time spent up to now is 363.5 secs Computing kpt #: 72 total cpu time spent up to now is 367.4 secs Computing kpt #: 73 total cpu time spent up to now is 371.3 secs Computing kpt #: 74 total cpu time spent up to now is 375.4 secs Computing kpt #: 75 total cpu time spent up to now is 379.4 secs Computing kpt #: 76 total cpu time spent up to now is 383.9 secs Computing kpt #: 77 total cpu time spent up to now is 388.5 secs Computing kpt #: 78 total cpu time spent up to now is 392.8 secs Computing kpt #: 79 total cpu time spent up to now is 396.9 secs Computing kpt #: 80 total cpu time spent up to now is 400.8 secs Computing kpt #: 81 total cpu time spent up to now is 405.1 secs Computing kpt #: 82 total cpu time spent up to now is 409.2 secs Computing kpt #: 83 total cpu time spent up to now is 413.1 secs Computing kpt #: 84 total cpu time spent up to now is 417.4 secs Computing kpt #: 85 total cpu time spent up to now is 421.5 secs Computing kpt #: 86 total cpu time spent up to now is 425.5 secs Computing kpt #: 87 total cpu time spent up to now is 429.9 secs Computing kpt #: 88 total cpu time spent up to now is 434.5 secs Computing kpt #: 89 total cpu time spent up to now is 439.2 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 447.6 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 456.6 secs Computing kpt #: 92 total cpu time spent up to now is 461.9 secs Computing kpt #: 93 total cpu time spent up to now is 466.9 secs Computing kpt #: 94 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 475.8 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 484.6 secs Computing kpt #: 96 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 493.2 secs Computing kpt #: 97 total cpu time spent up to now is 498.2 secs Computing kpt #: 98 total cpu time spent up to now is 503.1 secs Computing kpt #: 99 total cpu time spent up to now is 507.9 secs Computing kpt #: 100 total cpu time spent up to now is 512.4 secs Computing kpt #: 101 total cpu time spent up to now is 516.6 secs Computing kpt #: 102 total cpu time spent up to now is 520.9 secs Computing kpt #: 103 total cpu time spent up to now is 525.1 secs Computing kpt #: 104 total cpu time spent up to now is 529.3 secs Computing kpt #: 105 total cpu time spent up to now is 533.6 secs Computing kpt #: 106 total cpu time spent up to now is 537.8 secs Computing kpt #: 107 total cpu time spent up to now is 541.9 secs Computing kpt #: 108 total cpu time spent up to now is 546.2 secs Computing kpt #: 109 total cpu time spent up to now is 550.5 secs Computing kpt #: 110 total cpu time spent up to now is 555.3 secs Computing kpt #: 111 total cpu time spent up to now is 559.7 secs Computing kpt #: 112 total cpu time spent up to now is 564.6 secs Computing kpt #: 113 total cpu time spent up to now is 569.2 secs Computing kpt #: 114 total cpu time spent up to now is 573.9 secs Computing kpt #: 115 total cpu time spent up to now is 579.1 secs Computing kpt #: 116 total cpu time spent up to now is 585.4 secs Computing kpt #: 117 total cpu time spent up to now is 591.6 secs Computing kpt #: 118 total cpu time spent up to now is 597.9 secs Computing kpt #: 119 total cpu time spent up to now is 602.4 secs Computing kpt #: 120 total cpu time spent up to now is 606.6 secs Computing kpt #: 121 total cpu time spent up to now is 610.9 secs Computing kpt #: 122 total cpu time spent up to now is 615.1 secs Computing kpt #: 123 total cpu time spent up to now is 619.4 secs Computing kpt #: 124 total cpu time spent up to now is 623.6 secs Computing kpt #: 125 total cpu time spent up to now is 627.6 secs Computing kpt #: 126 total cpu time spent up to now is 631.7 secs Computing kpt #: 127 total cpu time spent up to now is 635.8 secs Computing kpt #: 128 total cpu time spent up to now is 639.8 secs Computing kpt #: 129 total cpu time spent up to now is 643.8 secs Computing kpt #: 130 total cpu time spent up to now is 648.0 secs Computing kpt #: 131 total cpu time spent up to now is 652.0 secs Computing kpt #: 132 total cpu time spent up to now is 655.9 secs Computing kpt #: 133 total cpu time spent up to now is 659.9 secs Computing kpt #: 134 total cpu time spent up to now is 663.6 secs Computing kpt #: 135 total cpu time spent up to now is 667.4 secs Computing kpt #: 136 total cpu time spent up to now is 671.1 secs Computing kpt #: 137 total cpu time spent up to now is 674.9 secs Computing kpt #: 138 total cpu time spent up to now is 678.8 secs Computing kpt #: 139 total cpu time spent up to now is 682.7 secs Computing kpt #: 140 total cpu time spent up to now is 686.5 secs Computing kpt #: 141 total cpu time spent up to now is 690.6 secs Computing kpt #: 142 total cpu time spent up to now is 694.9 secs Computing kpt #: 143 total cpu time spent up to now is 699.0 secs Computing kpt #: 144 total cpu time spent up to now is 703.6 secs Computing kpt #: 145 total cpu time spent up to now is 708.3 secs Computing kpt #: 146 total cpu time spent up to now is 713.0 secs Computing kpt #: 147 total cpu time spent up to now is 717.7 secs Computing kpt #: 148 total cpu time spent up to now is 724.0 secs Computing kpt #: 149 total cpu time spent up to now is 730.5 secs Computing kpt #: 150 total cpu time spent up to now is 738.5 secs Computing kpt #: 151 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 747.0 secs Computing kpt #: 152 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 755.8 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 764.4 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 773.0 secs Computing kpt #: 155 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 781.4 secs Computing kpt #: 156 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 790.0 secs Computing kpt #: 157 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 798.6 secs Computing kpt #: 158 total cpu time spent up to now is 807.1 secs Computing kpt #: 159 total cpu time spent up to now is 811.2 secs Computing kpt #: 160 total cpu time spent up to now is 815.3 secs Computing kpt #: 161 total cpu time spent up to now is 819.7 secs Computing kpt #: 162 total cpu time spent up to now is 823.9 secs Computing kpt #: 163 total cpu time spent up to now is 827.9 secs Computing kpt #: 164 total cpu time spent up to now is 831.8 secs Computing kpt #: 165 total cpu time spent up to now is 835.8 secs Computing kpt #: 166 total cpu time spent up to now is 839.7 secs Computing kpt #: 167 total cpu time spent up to now is 843.6 secs Computing kpt #: 168 total cpu time spent up to now is 847.3 secs Computing kpt #: 169 total cpu time spent up to now is 851.4 secs Computing kpt #: 170 total cpu time spent up to now is 855.8 secs Computing kpt #: 171 total cpu time spent up to now is 859.7 secs Computing kpt #: 172 total cpu time spent up to now is 863.8 secs Computing kpt #: 173 total cpu time spent up to now is 868.0 secs Computing kpt #: 174 total cpu time spent up to now is 871.9 secs Computing kpt #: 175 total cpu time spent up to now is 876.3 secs Computing kpt #: 176 total cpu time spent up to now is 880.4 secs Computing kpt #: 177 total cpu time spent up to now is 884.8 secs Computing kpt #: 178 total cpu time spent up to now is 889.2 secs ethr = 1.02E-08, avg # of iterations = 47.3 total cpu time spent up to now is 889.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6805 -4.6805 -2.8139 -2.8139 -2.8139 -2.8139 -2.7848 -2.7848 -0.6300 -0.6300 -0.6299 -0.6299 0.5565 0.5565 0.6576 0.6576 0.6577 0.6577 1.1727 1.1727 1.1728 1.1728 1.2048 1.2048 1.7311 1.7311 1.7965 1.7965 1.7966 1.7966 3.7576 3.7576 3.7576 3.7576 4.1276 4.1276 4.1799 4.1799 4.1799 4.1799 4.2831 4.2831 4.5961 4.5961 4.5962 4.5962 4.6806 4.6806 5.4871 5.4871 5.4871 5.4871 5.7279 5.7279 5.7599 5.7599 5.8840 5.8840 5.8840 5.8840 6.1590 6.1590 6.1590 6.1590 6.2692 6.2692 6.4802 6.4802 6.4803 6.4803 6.6371 6.6371 6.6896 6.6896 7.0087 7.0087 7.0087 7.0087 8.4862 8.4862 8.4963 8.4963 8.4963 8.4963 8.5343 8.5343 8.5343 8.5343 8.7987 8.7987 9.3942 9.3942 9.4202 9.4202 9.4202 9.4202 9.7915 9.7915 9.7915 9.7915 10.7601 10.7601 10.7602 10.7602 11.0041 11.0041 11.0042 11.0042 11.1035 11.1035 11.4092 11.4092 12.5956 12.5956 12.6752 12.6752 k = 0.0135-0.0096 0.0166 ( 9877 PWs) bands (ev): -17.8370 -17.8370 -4.6806 -4.6806 -2.8234 -2.8234 -2.8141 -2.8141 -2.7739 -2.7739 -0.6325 -0.6325 -0.6289 -0.6289 0.5531 0.5531 0.6497 0.6497 0.6569 0.6569 1.1718 1.1718 1.1791 1.1791 1.2083 1.2083 1.7327 1.7327 1.7938 1.7938 1.8016 1.8016 3.7586 3.7586 3.7600 3.7600 4.1300 4.1300 4.1804 4.1804 4.1813 4.1813 4.2846 4.2846 4.5962 4.5962 4.5972 4.5972 4.6816 4.6816 5.4846 5.4846 5.4872 5.4872 5.7265 5.7265 5.7543 5.7543 5.8818 5.8818 5.8840 5.8840 6.1576 6.1576 6.1585 6.1585 6.2654 6.2654 6.4751 6.4751 6.4794 6.4794 6.6351 6.6351 6.6991 6.6991 7.0123 7.0123 7.0185 7.0185 8.4705 8.4705 8.4949 8.4949 8.5023 8.5023 8.5323 8.5323 8.5409 8.5409 8.8018 8.8018 9.3897 9.3897 9.4132 9.4132 9.4192 9.4192 9.7723 9.7723 9.7872 9.7872 10.7612 10.7612 10.7669 10.7669 11.0068 11.0068 11.0118 11.0118 11.1000 11.1000 11.4275 11.4275 12.5995 12.5995 12.6795 12.6808 k = 0.0270-0.0191 0.0331 ( 9885 PWs) bands (ev): -17.8370 -17.8370 -4.6809 -4.6809 -2.8392 -2.8392 -2.8145 -2.8145 -2.7538 -2.7538 -0.6401 -0.6401 -0.6257 -0.6257 0.5416 0.5416 0.6281 0.6281 0.6555 0.6555 1.1671 1.1671 1.1901 1.1901 1.2274 1.2274 1.7332 1.7332 1.7863 1.7863 1.8194 1.8194 3.7615 3.7615 3.7669 3.7669 4.1371 4.1371 4.1820 4.1820 4.1856 4.1856 4.2888 4.2888 4.5963 4.5963 4.6003 4.6003 4.6849 4.6849 5.4763 5.4763 5.4875 5.4875 5.7198 5.7198 5.7403 5.7403 5.8760 5.8760 5.8840 5.8840 6.1534 6.1534 6.1569 6.1569 6.2555 6.2555 6.4628 6.4628 6.4772 6.4772 6.6301 6.6301 6.7228 6.7228 7.0230 7.0230 7.0463 7.0463 8.4434 8.4434 8.4897 8.4897 8.5011 8.5011 8.5325 8.5325 8.5552 8.5552 8.8113 8.8113 9.3704 9.3704 9.3965 9.3965 9.4181 9.4181 9.7183 9.7183 9.7744 9.7744 10.7644 10.7644 10.7867 10.7867 11.0037 11.0037 11.0332 11.0332 11.1018 11.1018 11.4798 11.4798 12.6089 12.6089 12.6795 12.6797 k = 0.0405-0.0287 0.0497 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6813 -4.6813 -2.8549 -2.8549 -2.8152 -2.8152 -2.7308 -2.7308 -0.6525 -0.6525 -0.6204 -0.6204 0.5189 0.5189 0.5975 0.5975 0.6561 0.6561 1.1579 1.1579 1.2005 1.2005 1.2657 1.2657 1.7260 1.7260 1.7763 1.7763 1.8525 1.8525 3.7662 3.7662 3.7781 3.7781 4.1482 4.1482 4.1846 4.1846 4.1927 4.1927 4.2960 4.2960 4.5965 4.5965 4.6055 4.6055 4.6908 4.6908 5.4600 5.4600 5.4880 5.4880 5.6982 5.6982 5.7298 5.7298 5.8680 5.8680 5.8841 5.8841 6.1463 6.1463 6.1545 6.1545 6.2433 6.2433 6.4484 6.4484 6.4739 6.4739 6.6235 6.6235 6.7538 6.7538 7.0402 7.0402 7.0877 7.0877 8.4098 8.4098 8.4743 8.4743 8.4917 8.4917 8.5429 8.5429 8.5708 8.5708 8.8275 8.8275 9.3301 9.3301 9.3755 9.3755 9.4185 9.4185 9.6382 9.6382 9.7539 9.7539 10.7691 10.7691 10.8188 10.8188 10.9752 10.9752 11.0654 11.0654 11.1297 11.1297 11.5599 11.5599 12.6195 12.6195 12.6850 12.6850 k = 0.0541-0.0382 0.0662 ( 9853 PWs) bands (ev): -17.8370 -17.8370 -4.6819 -4.6819 -2.8697 -2.8697 -2.8162 -2.8162 -2.7059 -2.7059 -0.6693 -0.6693 -0.6132 -0.6132 0.4844 0.4844 0.5617 0.5617 0.6601 0.6601 1.1469 1.1469 1.2134 1.2134 1.3151 1.3151 1.7090 1.7090 1.7666 1.7666 1.8984 1.8984 3.7726 3.7726 3.7933 3.7933 4.1626 4.1626 4.1882 4.1882 4.2026 4.2026 4.3063 4.3063 4.5970 4.5970 4.6130 4.6130 4.6996 4.6996 5.4315 5.4315 5.4887 5.4887 5.6662 5.6662 5.7234 5.7234 5.8589 5.8589 5.8845 5.8845 6.1363 6.1363 6.1513 6.1513 6.2324 6.2324 6.4341 6.4341 6.4701 6.4701 6.6159 6.6159 6.7886 6.7886 7.0633 7.0633 7.1374 7.1374 8.3708 8.3708 8.4451 8.4451 8.4814 8.4814 8.5606 8.5606 8.5847 8.5847 8.8512 8.8512 9.2725 9.2725 9.3478 9.3478 9.4178 9.4178 9.5460 9.5460 9.7267 9.7267 10.7743 10.7743 10.8610 10.8610 10.9260 10.9260 11.1055 11.1055 11.1802 11.1802 11.6615 11.6615 12.6283 12.6283 12.6925 12.6925 k = 0.0676-0.0478 0.0828 ( 9829 PWs) bands (ev): -17.8370 -17.8370 -4.6826 -4.6826 -2.8833 -2.8833 -2.8175 -2.8175 -2.6792 -2.6792 -0.6901 -0.6901 -0.6041 -0.6041 0.4404 0.4404 0.5219 0.5219 0.6670 0.6670 1.1364 1.1364 1.2299 1.2299 1.3701 1.3701 1.6839 1.6839 1.7585 1.7585 1.9533 1.9533 3.7805 3.7805 3.8120 3.8120 4.1788 4.1788 4.1929 4.1929 4.2148 4.2148 4.3201 4.3201 4.5980 4.5980 4.6228 4.6228 4.7119 4.7119 5.3866 5.3866 5.4895 5.4895 5.6358 5.6358 5.7169 5.7169 5.8489 5.8489 5.8850 5.8850 6.1243 6.1243 6.1475 6.1475 6.2244 6.2244 6.4206 6.4206 6.4663 6.4663 6.6081 6.6081 6.8257 6.8257 7.0914 7.0914 7.1901 7.1901 8.3269 8.3269 8.4064 8.4064 8.4685 8.4685 8.5825 8.5825 8.5950 8.5950 8.8826 8.8826 9.1990 9.1990 9.3078 9.3078 9.4005 9.4005 9.4723 9.4723 9.6945 9.6945 10.7788 10.7788 10.8586 10.8586 10.9189 10.9189 11.1513 11.1513 11.2444 11.2444 11.7785 11.7785 12.6344 12.6344 12.7000 12.7000 k = 0.0811-0.0573 0.0993 ( 9833 PWs) bands (ev): -17.8370 -17.8370 -4.6834 -4.6834 -2.8958 -2.8958 -2.8191 -2.8191 -2.6509 -2.6509 -0.7144 -0.7144 -0.5933 -0.5933 0.3907 0.3907 0.4782 0.4782 0.6755 0.6755 1.1278 1.1278 1.2500 1.2500 1.4263 1.4263 1.6534 1.6534 1.7529 1.7529 2.0139 2.0139 3.7897 3.7897 3.8336 3.8336 4.1948 4.1948 4.1994 4.1994 4.2289 4.2289 4.3377 4.3377 4.5996 4.5996 4.6350 4.6350 4.7284 4.7284 5.3247 5.3247 5.4906 5.4906 5.6127 5.6127 5.7090 5.7090 5.8378 5.8378 5.8858 5.8858 6.1112 6.1112 6.1435 6.1435 6.2193 6.2193 6.4079 6.4079 6.4628 6.4628 6.6005 6.6005 6.8648 6.8648 7.1239 7.1239 7.2418 7.2418 8.2787 8.2787 8.3605 8.3605 8.4520 8.4520 8.5954 8.5954 8.6112 8.6112 8.9193 8.9193 9.1089 9.1089 9.2452 9.2452 9.3539 9.3539 9.4519 9.4519 9.6603 9.6603 10.7694 10.7694 10.8020 10.8020 10.9791 10.9791 11.2011 11.2011 11.3175 11.3175 11.9060 11.9060 12.6364 12.6364 12.7024 12.7024 k = 0.0946-0.0669 0.1159 ( 9833 PWs) bands (ev): -17.8370 -17.8370 -4.6844 -4.6844 -2.9071 -2.9071 -2.8210 -2.8210 -2.6209 -2.6209 -0.7415 -0.7415 -0.5810 -0.5810 0.3380 0.3380 0.4309 0.4309 0.6843 0.6843 1.1215 1.1215 1.2738 1.2738 1.4788 1.4788 1.6208 1.6208 1.7519 1.7519 2.0781 2.0781 3.8002 3.8002 3.8576 3.8576 4.2037 4.2037 4.2137 4.2137 4.2437 4.2437 4.3597 4.3597 4.6022 4.6022 4.6499 4.6499 4.7495 4.7495 5.2499 5.2499 5.4917 5.4917 5.5967 5.5967 5.6994 5.6994 5.8255 5.8255 5.8869 5.8869 6.0977 6.0977 6.1395 6.1395 6.2165 6.2165 6.3960 6.3960 6.4598 6.4598 6.5936 6.5936 6.9059 6.9059 7.1599 7.1599 7.2896 7.2896 8.2271 8.2271 8.3087 8.3087 8.4318 8.4318 8.5905 8.5905 8.6387 8.6387 8.9407 8.9407 9.0165 9.0165 9.1694 9.1694 9.3184 9.3184 9.4443 9.4443 9.6296 9.6296 10.7007 10.7007 10.7968 10.7968 11.0475 11.0475 11.2536 11.2536 11.3961 11.3961 12.0402 12.0402 12.6313 12.6313 12.6891 12.6891 k = 0.1081-0.0764 0.1324 ( 9841 PWs) bands (ev): -17.8370 -17.8370 -4.6855 -4.6855 -2.9173 -2.9173 -2.8231 -2.8231 -2.5892 -2.5892 -0.7710 -0.7710 -0.5674 -0.5674 0.2840 0.2840 0.3807 0.3807 0.6917 0.6917 1.1177 1.1177 1.3012 1.3012 1.5181 1.5181 1.5914 1.5914 1.7601 1.7601 2.1441 2.1441 3.8116 3.8116 3.8834 3.8834 4.2112 4.2112 4.2299 4.2299 4.2579 4.2579 4.3861 4.3861 4.6062 4.6062 4.6679 4.6679 4.7751 4.7751 5.1684 5.1684 5.4928 5.4928 5.5856 5.5856 5.6878 5.6878 5.8122 5.8122 5.8881 5.8881 6.0844 6.0844 6.1357 6.1357 6.2156 6.2156 6.3851 6.3851 6.4573 6.4573 6.5876 6.5876 6.9488 6.9488 7.1989 7.1989 7.3318 7.3318 8.1724 8.1724 8.2519 8.2519 8.4077 8.4077 8.5750 8.5750 8.6652 8.6652 8.8538 8.8538 9.0021 9.0021 9.1113 9.1113 9.2988 9.2988 9.4265 9.4265 9.6104 9.6104 10.6174 10.6174 10.8021 10.8021 11.1213 11.1213 11.3075 11.3075 11.4780 11.4780 12.1783 12.1783 12.6093 12.6093 12.6561 12.6561 k = 0.1216-0.0860 0.1490 ( 9829 PWs) bands (ev): -17.8370 -17.8370 -4.6867 -4.6867 -2.9263 -2.9263 -2.8255 -2.8255 -2.5558 -2.5558 -0.8024 -0.8024 -0.5529 -0.5529 0.2297 0.2297 0.3285 0.3285 0.6965 0.6965 1.1161 1.1161 1.3322 1.3322 1.5229 1.5229 1.5814 1.5814 1.7838 1.7838 2.2107 2.2107 3.8237 3.8237 3.9101 3.9101 4.2195 4.2195 4.2454 4.2454 4.2705 4.2705 4.4168 4.4168 4.6118 4.6118 4.6893 4.6893 4.8040 4.8040 5.0863 5.0863 5.4938 5.4938 5.5775 5.5775 5.6743 5.6743 5.7979 5.7979 5.8896 5.8896 6.0716 6.0716 6.1324 6.1324 6.2161 6.2161 6.3755 6.3755 6.4553 6.4553 6.5828 6.5828 6.9933 6.9933 7.2401 7.2401 7.3677 7.3677 8.1152 8.1152 8.1912 8.1912 8.3798 8.3798 8.5457 8.5457 8.6717 8.6717 8.7455 8.7455 8.9701 8.9701 9.1019 9.1019 9.2983 9.2983 9.3918 9.3918 9.6074 9.6074 10.5301 10.5301 10.8107 10.8107 11.1988 11.1988 11.3614 11.3614 11.5610 11.5610 12.3176 12.3176 12.5665 12.5665 12.6182 12.6182 k = 0.1351-0.0956 0.1655 ( 9825 PWs) bands (ev): -17.8369 -17.8369 -4.6879 -4.6879 -2.9342 -2.9342 -2.8282 -2.8282 -2.5207 -2.5207 -0.8352 -0.8352 -0.5378 -0.5378 0.1758 0.1758 0.2751 0.2751 0.6976 0.6976 1.1166 1.1166 1.3666 1.3666 1.4980 1.4980 1.5847 1.5847 1.8253 1.8253 2.2766 2.2766 3.8365 3.8365 3.9370 3.9370 4.2289 4.2289 4.2598 4.2598 4.2811 4.2811 4.4512 4.4512 4.6190 4.6190 4.7143 4.7143 4.8317 4.8317 5.0124 5.0124 5.4943 5.4943 5.5710 5.5710 5.6590 5.6590 5.7830 5.7830 5.8913 5.8913 6.0596 6.0596 6.1297 6.1297 6.2179 6.2179 6.3673 6.3673 6.4539 6.4539 6.5793 6.5793 7.0392 7.0392 7.2826 7.2826 7.3970 7.3970 8.0551 8.0551 8.1272 8.1272 8.3483 8.3483 8.4879 8.4879 8.5936 8.5936 8.7260 8.7260 8.9201 8.9201 9.1053 9.1053 9.3186 9.3186 9.3466 9.3466 9.6176 9.6176 10.4404 10.4404 10.8245 10.8245 11.2776 11.2776 11.4143 11.4143 11.6431 11.6431 12.4536 12.4536 12.5191 12.5191 12.5725 12.5725 k = 0.1486-0.1051 0.1821 ( 9825 PWs) bands (ev): -17.8369 -17.8369 -4.6893 -4.6893 -2.9411 -2.9411 -2.8311 -2.8311 -2.4841 -2.4841 -0.8690 -0.8690 -0.5224 -0.5224 0.1229 0.1229 0.2213 0.2213 0.6940 0.6940 1.1188 1.1188 1.4040 1.4040 1.4691 1.4691 1.5814 1.5814 1.8799 1.8799 2.3411 2.3411 3.8495 3.8495 3.9628 3.9628 4.2395 4.2395 4.2726 4.2726 4.2895 4.2895 4.4893 4.4893 4.6279 4.6279 4.7407 4.7407 4.8411 4.8411 4.9691 4.9691 5.4939 5.4939 5.5652 5.5652 5.6423 5.6423 5.7678 5.7678 5.8933 5.8933 6.0488 6.0488 6.1275 6.1275 6.2209 6.2209 6.3609 6.3609 6.4531 6.4531 6.5772 6.5772 7.0860 7.0860 7.3248 7.3248 7.4206 7.4206 7.9905 7.9905 8.0615 8.0615 8.3133 8.3133 8.3821 8.3821 8.5261 8.5261 8.7138 8.7138 8.8893 8.8893 9.0960 9.0960 9.2802 9.2802 9.3700 9.3700 9.6355 9.6355 10.3496 10.3496 10.8464 10.8464 11.3551 11.3551 11.4651 11.4651 11.7223 11.7223 12.4635 12.4635 12.5206 12.5206 12.5951 12.5951 k = 0.1622-0.1147 0.1986 ( 9809 PWs) bands (ev): -17.8369 -17.8369 -4.6906 -4.6906 -2.9469 -2.9469 -2.8342 -2.8342 -2.4457 -2.4457 -0.9034 -0.9034 -0.5071 -0.5071 0.0712 0.0712 0.1676 0.1676 0.6851 0.6851 1.1225 1.1225 1.4333 1.4333 1.4535 1.4535 1.5717 1.5717 1.9419 1.9419 2.4034 2.4034 3.8625 3.8625 3.9866 3.9866 4.2509 4.2509 4.2832 4.2832 4.2968 4.2968 4.5306 4.5306 4.6384 4.6384 4.7521 4.7521 4.8262 4.8262 4.9809 4.9809 5.4918 5.4918 5.5592 5.5592 5.6256 5.6256 5.7529 5.7529 5.8956 5.8956 6.0393 6.0393 6.1260 6.1260 6.2247 6.2247 6.3565 6.3565 6.4528 6.4528 6.5764 6.5764 7.1332 7.1332 7.3632 7.3632 7.4411 7.4411 7.9171 7.9171 7.9967 7.9967 8.2594 8.2594 8.2750 8.2750 8.4747 8.4747 8.6733 8.6733 8.8869 8.8869 9.0781 9.0781 9.2167 9.2167 9.4194 9.4194 9.6568 9.6568 10.2583 10.2583 10.8796 10.8796 11.4272 11.4272 11.5130 11.5130 11.7959 11.7959 12.4219 12.4219 12.4693 12.4693 12.6175 12.6175 k = 0.1757-0.1242 0.2152 ( 9825 PWs) bands (ev): -17.8369 -17.8369 -4.6920 -4.6920 -2.9518 -2.9518 -2.8376 -2.8376 -2.4058 -2.4058 -0.9381 -0.9381 -0.4926 -0.4926 0.0209 0.0209 0.1146 0.1146 0.6708 0.6708 1.1275 1.1275 1.4141 1.4141 1.4928 1.4928 1.5584 1.5584 2.0075 2.0075 2.4630 2.4630 3.8752 3.8752 4.0071 4.0071 4.2614 4.2614 4.2911 4.2911 4.3044 4.3044 4.5738 4.5738 4.6512 4.6512 4.7190 4.7190 4.8455 4.8455 5.0215 5.0215 5.4872 5.4872 5.5521 5.5521 5.6106 5.6106 5.7390 5.7390 5.8985 5.8985 6.0313 6.0313 6.1251 6.1251 6.2293 6.2293 6.3544 6.3544 6.4530 6.4530 6.5769 6.5769 7.1799 7.1799 7.3889 7.3889 7.4659 7.4659 7.8292 7.8292 7.9369 7.9369 8.1450 8.1450 8.2336 8.2336 8.4239 8.4239 8.6169 8.6169 8.8944 8.8944 9.0592 9.0592 9.1493 9.1493 9.4663 9.4663 9.6789 9.6789 10.1673 10.1673 10.9264 10.9264 11.4882 11.4882 11.5581 11.5581 11.8600 11.8600 12.3921 12.3921 12.4225 12.4225 12.5876 12.5876 k = 0.1892-0.1338 0.2317 ( 9837 PWs) bands (ev): -17.8369 -17.8369 -4.6934 -4.6934 -2.9557 -2.9557 -2.8412 -2.8412 -2.3643 -2.3643 -0.9728 -0.9728 -0.4791 -0.4791 -0.0278 -0.0278 0.0626 0.0626 0.6514 0.6514 1.1334 1.1334 1.3935 1.3935 1.5341 1.5341 1.5492 1.5492 2.0747 2.0747 2.5194 2.5194 3.8870 3.8870 4.0236 4.0236 4.2667 4.2667 4.2992 4.2992 4.3124 4.3124 4.6122 4.6122 4.6631 4.6631 4.6862 4.6862 4.8850 4.8850 5.0711 5.0711 5.4795 5.4795 5.5428 5.5428 5.6004 5.6004 5.7267 5.7267 5.9021 5.9021 6.0249 6.0249 6.1248 6.1248 6.2343 6.2343 6.3547 6.3547 6.4539 6.4539 6.5787 6.5787 7.2248 7.2248 7.3926 7.3926 7.5012 7.5012 7.7275 7.7275 7.8838 7.8838 8.0473 8.0473 8.1893 8.1893 8.3710 8.3710 8.5562 8.5562 8.8909 8.8909 9.0492 9.0492 9.0800 9.0800 9.5051 9.5051 9.6994 9.6994 10.0771 10.0771 10.9879 10.9879 11.5316 11.5316 11.6009 11.6009 11.9082 11.9082 12.3809 12.3809 12.3875 12.3875 12.5497 12.5497 k = 0.2027-0.1433 0.2483 ( 9825 PWs) bands (ev): -17.8368 -17.8368 -4.6949 -4.6949 -2.9586 -2.9586 -2.8449 -2.8449 -2.3212 -2.3212 -1.0072 -1.0072 -0.4673 -0.4673 -0.0748 -0.0748 0.0119 0.0119 0.6275 0.6275 1.1402 1.1402 1.3756 1.3756 1.5236 1.5236 1.5942 1.5942 2.1421 2.1421 2.5725 2.5725 3.8975 3.8975 4.0362 4.0362 4.2639 4.2639 4.3087 4.3087 4.3193 4.3193 4.6222 4.6222 4.6573 4.6573 4.7166 4.7166 4.9298 4.9298 5.1231 5.1231 5.4684 5.4684 5.5316 5.5316 5.5966 5.5966 5.7167 5.7167 5.9066 5.9066 6.0200 6.0200 6.1250 6.1250 6.2393 6.2393 6.3576 6.3576 6.4554 6.4554 6.5816 6.5816 7.2639 7.2639 7.3723 7.3723 7.5425 7.5425 7.6247 7.6247 7.8374 7.8374 7.9665 7.9665 8.1425 8.1425 8.3164 8.3164 8.4962 8.4962 8.8651 8.8651 9.0096 9.0096 9.0550 9.0550 9.5327 9.5327 9.7166 9.7166 9.9886 9.9886 11.0630 11.0630 11.5559 11.5559 11.6390 11.6390 11.9325 11.9325 12.3711 12.3711 12.3950 12.3950 12.5076 12.5076 k = 0.2162-0.1529 0.2648 ( 9813 PWs) bands (ev): -17.8368 -17.8368 -4.6962 -4.6962 -2.9607 -2.9607 -2.8489 -2.8489 -2.2767 -2.2767 -1.0411 -1.0411 -0.4577 -0.4577 -0.1199 -0.1199 -0.0370 -0.0370 0.6001 0.6001 1.1476 1.1476 1.3601 1.3601 1.5061 1.5061 1.6489 1.6489 2.2092 2.2092 2.6220 2.6220 3.9058 3.9058 4.0452 4.0452 4.2547 4.2547 4.3130 4.3130 4.3272 4.3272 4.6147 4.6147 4.6692 4.6692 4.7707 4.7707 4.9756 4.9756 5.1730 5.1730 5.4544 5.4544 5.5224 5.5224 5.5992 5.5992 5.7094 5.7094 5.9125 5.9125 6.0163 6.0163 6.1260 6.1260 6.2439 6.2439 6.3631 6.3631 6.4577 6.4577 6.5856 6.5856 7.2734 7.2734 7.3373 7.3373 7.5457 7.5457 7.5840 7.5840 7.7980 7.7980 7.8998 7.8998 8.0935 8.0935 8.2607 8.2607 8.4389 8.4389 8.8199 8.8199 8.9387 8.9387 9.0714 9.0714 9.5472 9.5472 9.7295 9.7295 9.9021 9.9021 11.1479 11.1479 11.5663 11.5663 11.6682 11.6682 11.9282 11.9282 12.3793 12.3793 12.4276 12.4276 12.4718 12.4718 k = 0.2297-0.1624 0.2814 ( 9797 PWs) bands (ev): -17.8368 -17.8368 -4.6976 -4.6976 -2.9619 -2.9619 -2.8529 -2.8529 -2.2308 -2.2308 -1.0744 -1.0744 -0.4507 -0.4507 -0.1633 -0.1633 -0.0841 -0.0841 0.5703 0.5703 1.1556 1.1556 1.3464 1.3464 1.4881 1.4881 1.7070 1.7070 2.2752 2.2752 2.6681 2.6681 3.9115 3.9115 4.0512 4.0512 4.2411 4.2411 4.3086 4.3086 4.3377 4.3377 4.6220 4.6220 4.6829 4.6829 4.8325 4.8325 5.0198 5.0198 5.2156 5.2156 5.4394 5.4394 5.5200 5.5200 5.6081 5.6081 5.7053 5.7053 5.9198 5.9198 6.0136 6.0136 6.1278 6.1278 6.2480 6.2480 6.3708 6.3708 6.4610 6.4610 6.5905 6.5905 7.1905 7.1905 7.3399 7.3399 7.5083 7.5083 7.6195 7.6195 7.7656 7.7656 7.8468 7.8468 8.0428 8.0428 8.2050 8.2050 8.3855 8.3855 8.7628 8.7628 8.8672 8.8672 9.0910 9.0910 9.5471 9.5471 9.7374 9.7374 9.8184 9.8184 11.2347 11.2347 11.5724 11.5724 11.6875 11.6875 11.8995 11.8995 12.3941 12.3941 12.4318 12.4318 12.5011 12.5011 k = 0.2432-0.1720 0.2979 ( 9781 PWs) bands (ev): -17.8368 -17.8368 -4.6989 -4.6989 -2.9623 -2.9623 -2.8571 -2.8571 -2.1836 -2.1836 -1.1068 -1.1068 -0.4467 -0.4467 -0.2048 -0.2048 -0.1291 -0.1291 0.5391 0.5391 1.1640 1.1640 1.3337 1.3337 1.4701 1.4701 1.7684 1.7684 2.3399 2.3399 2.7109 2.7109 3.9142 3.9142 4.0546 4.0546 4.2258 4.2258 4.2999 4.2999 4.3483 4.3483 4.6432 4.6432 4.6987 4.6987 4.8972 4.8972 5.0593 5.0593 5.2447 5.2447 5.4278 5.4278 5.5272 5.5272 5.6251 5.6251 5.7043 5.7043 5.9291 5.9291 6.0117 6.0117 6.1307 6.1307 6.2510 6.2510 6.3803 6.3803 6.4655 6.4655 6.5963 6.5963 7.0686 7.0686 7.3391 7.3391 7.5047 7.5047 7.6409 7.6409 7.7383 7.7383 7.8140 7.8140 7.9911 7.9911 8.1506 8.1506 8.3370 8.3370 8.6987 8.6987 8.7950 8.7950 9.1089 9.1089 9.5313 9.5313 9.7372 9.7372 9.7407 9.7407 11.3093 11.3093 11.5845 11.5845 11.7031 11.7031 11.8557 11.8557 12.3722 12.3722 12.4637 12.4637 12.5595 12.5595 k = 0.2568-0.1816 0.3145 ( 9781 PWs) bands (ev): -17.8368 -17.8368 -4.7002 -4.7002 -2.9620 -2.9620 -2.8614 -2.8614 -2.1353 -2.1353 -1.1382 -1.1382 -0.4461 -0.4461 -0.2445 -0.2445 -0.1718 -0.1718 0.5070 0.5070 1.1726 1.1726 1.3216 1.3216 1.4522 1.4522 1.8327 1.8327 2.4029 2.4029 2.7507 2.7507 3.9139 3.9139 4.0552 4.0552 4.2118 4.2118 4.2902 4.2902 4.3583 4.3583 4.6683 4.6683 4.7217 4.7217 4.9610 4.9610 5.0908 5.0908 5.2561 5.2561 5.4269 5.4269 5.5409 5.5409 5.6536 5.6536 5.7065 5.7065 5.9407 5.9407 6.0100 6.0100 6.1351 6.1351 6.2526 6.2526 6.3906 6.3906 6.4712 6.4712 6.6032 6.6032 6.9394 6.9394 7.3235 7.3235 7.5173 7.5173 7.6418 7.6418 7.7095 7.7095 7.8118 7.8118 7.9397 7.9397 8.0988 8.0988 8.2941 8.2941 8.6306 8.6306 8.7224 8.7224 9.1222 9.1222 9.5001 9.5001 9.6615 9.6615 9.7357 9.7357 11.3572 11.3572 11.5970 11.5970 11.7361 11.7361 11.8073 11.8073 12.3459 12.3459 12.5059 12.5059 12.5849 12.5849 k = 0.2703-0.1911 0.3310 ( 9793 PWs) bands (ev): -17.8367 -17.8367 -4.7015 -4.7015 -2.9609 -2.9609 -2.8657 -2.8657 -2.0859 -2.0859 -1.1685 -1.1685 -0.4489 -0.4489 -0.2825 -0.2825 -0.2122 -0.2122 0.4747 0.4747 1.1814 1.1814 1.3099 1.3099 1.4348 1.4348 1.8999 1.8999 2.4639 2.4639 2.7877 2.7877 3.9112 3.9112 4.0527 4.0527 4.2016 4.2016 4.2810 4.2810 4.3675 4.3675 4.6872 4.6872 4.7580 4.7580 5.0190 5.0190 5.1136 5.1136 5.2502 5.2502 5.4434 5.4434 5.5550 5.5550 5.6947 5.6947 5.7123 5.7123 5.9552 5.9552 6.0081 6.0081 6.1417 6.1417 6.2521 6.2521 6.4009 6.4009 6.4778 6.4778 6.6113 6.6113 6.8147 6.8147 7.3002 7.3002 7.5284 7.5284 7.6270 7.6270 7.6832 7.6832 7.8276 7.8276 7.8932 7.8932 8.0518 8.0518 8.2580 8.2580 8.5607 8.5607 8.6498 8.6498 9.1282 9.1282 9.4558 9.4558 9.5880 9.5880 9.7243 9.7243 11.3791 11.3791 11.5880 11.5880 11.7403 11.7403 11.8297 11.8297 12.3234 12.3234 12.5112 12.5112 12.5672 12.5672 k = 0.2838-0.2007 0.3476 ( 9813 PWs) bands (ev): -17.8367 -17.8367 -4.7026 -4.7026 -2.9593 -2.9593 -2.8701 -2.8701 -2.0357 -2.0357 -1.1976 -1.1976 -0.4550 -0.4550 -0.3187 -0.3187 -0.2501 -0.2501 0.4423 0.4423 1.1903 1.1903 1.2986 1.2986 1.4179 1.4179 1.9698 1.9698 2.5227 2.5227 2.8224 2.8224 3.9070 3.9070 4.0470 4.0470 4.1964 4.1964 4.2734 4.2734 4.3757 4.3757 4.6990 4.6990 4.8049 4.8049 5.0590 5.0590 5.1368 5.1368 5.2329 5.2329 5.4770 5.4770 5.5663 5.5663 5.7210 5.7210 5.7440 5.7440 5.9730 5.9730 6.0053 6.0053 6.1505 6.1505 6.2489 6.2489 6.4103 6.4103 6.4842 6.4842 6.6209 6.6209 6.7047 6.7047 7.2750 7.2750 7.5266 7.5266 7.6019 7.6019 7.6682 7.6682 7.8228 7.8228 7.8748 7.8748 8.0131 8.0131 8.2300 8.2300 8.4903 8.4903 8.5781 8.5781 9.1244 9.1244 9.4028 9.4028 9.5159 9.5159 9.7044 9.7044 11.3870 11.3870 11.5614 11.5614 11.6889 11.6889 11.9402 11.9402 12.3019 12.3019 12.4149 12.4149 12.5881 12.5881 k = 0.2973-0.2102 0.3641 ( 9805 PWs) bands (ev): -17.8367 -17.8367 -4.7037 -4.7037 -2.9571 -2.9571 -2.8744 -2.8744 -1.9848 -1.9848 -1.2252 -1.2252 -0.4640 -0.4640 -0.3534 -0.3534 -0.2854 -0.2854 0.4096 0.4096 1.1991 1.1991 1.2879 1.2879 1.4017 1.4017 2.0422 2.0422 2.5789 2.5789 2.8552 2.8552 3.9024 3.9024 4.0385 4.0385 4.1951 4.1951 4.2681 4.2681 4.3826 4.3826 4.7068 4.7068 4.8570 4.8570 5.0686 5.0686 5.1712 5.1712 5.2135 5.2135 5.5201 5.5201 5.5757 5.5757 5.7352 5.7352 5.7908 5.7908 5.9899 5.9899 6.0041 6.0041 6.1583 6.1583 6.2467 6.2467 6.4186 6.4186 6.4872 6.4872 6.6136 6.6136 6.6412 6.6412 7.2511 7.2511 7.5109 7.5109 7.5700 7.5700 7.6573 7.6573 7.7920 7.7920 7.8814 7.8814 7.9904 7.9904 8.2113 8.2113 8.4206 8.4206 8.5084 8.5084 9.1073 9.1073 9.3464 9.3464 9.4445 9.4445 9.6752 9.6752 11.3867 11.3867 11.5287 11.5287 11.6386 11.6386 12.0677 12.0677 12.2723 12.2723 12.2979 12.2979 12.5978 12.5978 k = 0.3108-0.2198 0.3807 ( 9797 PWs) bands (ev): -17.8367 -17.8367 -4.7047 -4.7047 -2.9544 -2.9544 -2.8787 -2.8787 -1.9335 -1.9335 -1.2515 -1.2515 -0.4755 -0.4755 -0.3865 -0.3865 -0.3182 -0.3182 0.3764 0.3764 1.2078 1.2078 1.2781 1.2781 1.3862 1.3862 2.1167 2.1167 2.6325 2.6325 2.8864 2.8864 3.8984 3.8984 4.0282 4.0282 4.1955 4.1955 4.2661 4.2661 4.3883 4.3883 4.7114 4.7114 4.9108 4.9108 5.0589 5.0589 5.1750 5.1750 5.2301 5.2301 5.5592 5.5592 5.5867 5.5867 5.7551 5.7551 5.8267 5.8267 5.9829 5.9829 6.0242 6.0242 6.1544 6.1544 6.2609 6.2609 6.4263 6.4263 6.4838 6.4838 6.5709 6.5709 6.6554 6.6554 7.2304 7.2304 7.4866 7.4866 7.5350 7.5350 7.6352 7.6352 7.7691 7.7691 7.8752 7.8752 7.9904 7.9904 8.2023 8.2023 8.3526 8.3526 8.4422 8.4422 9.0733 9.0733 9.2904 9.2904 9.3751 9.3751 9.6361 9.6361 11.3763 11.3763 11.4950 11.4950 11.5982 11.5982 12.1466 12.1466 12.2054 12.2054 12.2620 12.2620 12.5821 12.5821 k = 0.3243-0.2293 0.3972 ( 9797 PWs) bands (ev): -17.8367 -17.8367 -4.7057 -4.7057 -2.9512 -2.9512 -2.8830 -2.8830 -1.8821 -1.8821 -1.2762 -1.2762 -0.4887 -0.4887 -0.4181 -0.4181 -0.3483 -0.3483 0.3420 0.3420 1.2162 1.2162 1.2696 1.2696 1.3716 1.3716 2.1931 2.1931 2.6833 2.6833 2.9165 2.9165 3.8955 3.8955 4.0170 4.0170 4.1955 4.1955 4.2679 4.2679 4.3924 4.3924 4.7129 4.7129 4.9627 4.9627 5.0428 5.0428 5.1530 5.1530 5.2721 5.2721 5.5764 5.5764 5.6063 5.6063 5.7784 5.7784 5.8432 5.8432 5.9674 5.9674 6.0506 6.0506 6.1425 6.1425 6.2990 6.2990 6.4363 6.4363 6.4805 6.4805 6.5574 6.5574 6.6782 6.6782 7.2145 7.2145 7.4571 7.4571 7.4992 7.4992 7.5997 7.5997 7.7537 7.7537 7.8592 7.8592 8.0055 8.0055 8.1996 8.1996 8.2882 8.2882 8.3825 8.3825 9.0206 9.0206 9.2342 9.2342 9.3118 9.3118 9.5870 9.5870 11.3532 11.3532 11.4572 11.4572 11.5779 11.5779 12.0216 12.0216 12.2044 12.2044 12.3604 12.3604 12.5378 12.5378 k = 0.3378-0.2389 0.4138 ( 9801 PWs) bands (ev): -17.8366 -17.8366 -4.7065 -4.7065 -2.9478 -2.9478 -2.8871 -2.8871 -1.8309 -1.8309 -1.2994 -1.2994 -0.5031 -0.5031 -0.4479 -0.4479 -0.3759 -0.3759 0.3062 0.3062 1.2244 1.2244 1.2628 1.2628 1.3579 1.3579 2.2709 2.2709 2.7311 2.7311 2.9457 2.9457 3.8940 3.8940 4.0055 4.0055 4.1940 4.1940 4.2736 4.2736 4.3950 4.3950 4.7111 4.7111 4.9941 4.9941 5.0415 5.0415 5.1318 5.1318 5.3122 5.3122 5.5796 5.5796 5.6172 5.6172 5.7844 5.7844 5.8498 5.8498 5.9602 5.9602 6.0743 6.0743 6.1455 6.1455 6.3445 6.3445 6.4514 6.4514 6.4940 6.4940 6.5599 6.5599 6.7068 6.7068 7.2041 7.2041 7.4219 7.4219 7.4664 7.4664 7.5580 7.5580 7.7383 7.7383 7.8412 7.8412 8.0265 8.0265 8.1886 8.1886 8.2339 8.2339 8.3364 8.3364 8.9510 8.9510 9.1750 9.1750 9.2581 9.2581 9.5283 9.5283 11.3205 11.3205 11.4120 11.4120 11.5788 11.5788 11.8932 11.8932 12.1615 12.1615 12.4635 12.4635 12.5091 12.5091 k = 0.3514-0.2484 0.4303 ( 9805 PWs) bands (ev): -17.8366 -17.8366 -4.7073 -4.7073 -2.9441 -2.9441 -2.8910 -2.8910 -1.7803 -1.7803 -1.3209 -1.3209 -0.5183 -0.5183 -0.4753 -0.4753 -0.4009 -0.4009 0.2686 0.2686 1.2322 1.2322 1.2579 1.2579 1.3452 1.3452 2.3494 2.3494 2.7760 2.7760 2.9744 2.9744 3.8941 3.8941 3.9942 3.9942 4.1912 4.1912 4.2820 4.2820 4.3959 4.3959 4.7056 4.7056 4.9781 4.9781 5.0799 5.0799 5.1165 5.1165 5.3464 5.3464 5.5688 5.5688 5.6118 5.6118 5.7623 5.7623 5.8714 5.8714 5.9625 5.9625 6.0869 6.0869 6.1768 6.1768 6.3780 6.3780 6.4626 6.4626 6.5432 6.5432 6.5751 6.5751 6.7412 6.7412 7.1994 7.1994 7.3805 7.3805 7.4391 7.4391 7.5157 7.5157 7.7212 7.7212 7.8223 7.8223 8.0491 8.0491 8.1472 8.1472 8.1960 8.1960 8.3172 8.3172 8.8683 8.8683 9.1136 9.1136 9.2114 9.2114 9.4607 9.4607 11.2828 11.2828 11.3627 11.3627 11.5907 11.5907 11.7715 11.7715 12.1124 12.1124 12.3825 12.3825 12.6538 12.6538 k = 0.3649-0.2580 0.4469 ( 9788 PWs) bands (ev): -17.8366 -17.8366 -4.7080 -4.7080 -2.9402 -2.9402 -2.8947 -2.8947 -1.7308 -1.7308 -1.3406 -1.3406 -0.5346 -0.5346 -0.4992 -0.4992 -0.4235 -0.4235 0.2290 0.2290 1.2395 1.2395 1.2550 1.2550 1.3335 1.3335 2.4279 2.4279 2.8182 2.8182 3.0025 3.0025 3.8955 3.8955 3.9832 3.9832 4.1877 4.1877 4.2918 4.2918 4.3952 4.3952 4.6963 4.6963 4.9493 4.9493 5.0938 5.0938 5.1372 5.1372 5.3682 5.3682 5.5325 5.5325 5.6075 5.6075 5.7451 5.7451 5.8953 5.8953 5.9664 5.9664 6.0927 6.0927 6.2255 6.2255 6.3983 6.3983 6.4674 6.4674 6.5957 6.5957 6.6309 6.6309 6.7821 6.7821 7.2000 7.2000 7.3356 7.3356 7.4169 7.4169 7.4754 7.4754 7.7039 7.7039 7.8016 7.8016 8.0640 8.0640 8.1012 8.1012 8.1545 8.1545 8.3231 8.3231 8.7765 8.7765 9.0536 9.0536 9.1668 9.1668 9.3855 9.3855 11.2431 11.2431 11.3125 11.3125 11.5899 11.5899 11.6751 11.6751 12.0611 12.0611 12.2925 12.2925 12.8042 12.8042 k = 0.3784-0.2676 0.4634 ( 9796 PWs) bands (ev): -17.8366 -17.8366 -4.7087 -4.7087 -2.9363 -2.9363 -2.8983 -2.8983 -1.6829 -1.6829 -1.3587 -1.3587 -0.5527 -0.5527 -0.5180 -0.5180 -0.4438 -0.4438 0.1876 0.1876 1.2464 1.2464 1.2540 1.2540 1.3229 1.3229 2.5051 2.5051 2.8584 2.8584 3.0301 3.0301 3.8979 3.8979 3.9728 3.9728 4.1840 4.1840 4.3020 4.3020 4.3930 4.3930 4.6833 4.6833 4.9149 4.9149 5.0865 5.0865 5.1822 5.1822 5.3595 5.3595 5.5021 5.5021 5.6084 5.6084 5.7363 5.7363 5.9155 5.9155 5.9693 5.9693 6.0973 6.0973 6.2760 6.2760 6.4123 6.4123 6.4684 6.4684 6.6441 6.6441 6.7179 6.7179 6.8338 6.8338 7.2035 7.2035 7.2917 7.2917 7.3981 7.3981 7.4402 7.4402 7.6881 7.6881 7.7793 7.7793 8.0309 8.0309 8.0921 8.0921 8.1189 8.1189 8.3379 8.3379 8.6792 8.6792 8.9972 8.9972 9.1213 9.1213 9.3048 9.3048 11.2027 11.2027 11.2632 11.2632 11.5154 11.5154 11.6625 11.6625 12.0107 12.0107 12.2035 12.2035 12.9568 12.9568 k = 0.3919-0.2771 0.4800 ( 9788 PWs) bands (ev): -17.8366 -17.8366 -4.7093 -4.7093 -2.9325 -2.9325 -2.9015 -2.9015 -1.6374 -1.6374 -1.3749 -1.3749 -0.5724 -0.5724 -0.5309 -0.5309 -0.4618 -0.4618 0.1449 0.1449 1.2525 1.2525 1.2550 1.2550 1.3134 1.3134 2.5795 2.5795 2.8974 2.8974 3.0569 3.0569 3.9010 3.9010 3.9629 3.9629 4.1803 4.1803 4.3117 4.3117 4.3895 4.3895 4.6668 4.6668 4.8748 4.8748 5.0819 5.0819 5.2258 5.2258 5.3131 5.3131 5.5048 5.5048 5.6108 5.6108 5.7293 5.7293 5.9321 5.9321 5.9713 5.9713 6.1021 6.1021 6.3200 6.3200 6.4232 6.4232 6.4670 6.4670 6.7102 6.7102 6.7954 6.7954 6.9071 6.9071 7.2004 7.2004 7.2586 7.2586 7.3800 7.3800 7.4148 7.4148 7.6751 7.6751 7.7557 7.7557 7.9823 7.9823 8.0558 8.0558 8.1256 8.1256 8.3511 8.3511 8.5791 8.5791 8.9455 8.9455 9.0743 9.0743 9.2210 9.2210 11.1622 11.1622 11.2154 11.2154 11.4179 11.4179 11.6819 11.6819 11.9634 11.9634 12.1204 12.1204 13.1113 13.1113 k = 0.4054-0.2867 0.4965 ( 9780 PWs) bands (ev): -17.8366 -17.8366 -4.7097 -4.7097 -2.9288 -2.9288 -2.9045 -2.9045 -1.5947 -1.5947 -1.3893 -1.3893 -0.5921 -0.5921 -0.5390 -0.5390 -0.4775 -0.4775 0.1014 0.1014 1.2561 1.2561 1.2591 1.2591 1.3051 1.3051 2.6487 2.6487 2.9366 2.9366 3.0824 3.0824 3.9044 3.9044 3.9538 3.9538 4.1768 4.1768 4.3203 4.3203 4.3849 4.3849 4.6466 4.6466 4.8295 4.8295 5.0807 5.0807 5.2561 5.2561 5.2673 5.2673 5.5227 5.5227 5.6137 5.6137 5.7204 5.7204 5.9458 5.9458 5.9732 5.9732 6.1074 6.1074 6.3556 6.3556 6.4321 6.4321 6.4644 6.4644 6.7880 6.7880 6.8566 6.8566 7.0044 7.0044 7.1742 7.1742 7.2514 7.2514 7.3617 7.3617 7.4047 7.4047 7.6657 7.6657 7.7318 7.7318 7.9356 7.9356 8.0139 8.0139 8.1358 8.1358 8.3562 8.3562 8.4793 8.4793 8.8994 8.8994 9.0258 9.0258 9.1381 9.1381 11.1225 11.1225 11.1695 11.1695 11.3267 11.3267 11.7039 11.7039 11.9209 11.9209 12.0462 12.0462 13.2667 13.2667 k = 0.4189-0.2962 0.5131 ( 9756 PWs) bands (ev): -17.8365 -17.8365 -4.7102 -4.7102 -2.9254 -2.9254 -2.9071 -2.9071 -1.5557 -1.5557 -1.4019 -1.4019 -0.6103 -0.6103 -0.5431 -0.5431 -0.4910 -0.4910 0.0583 0.0583 1.2588 1.2588 1.2643 1.2643 1.2980 1.2980 2.7102 2.7102 2.9776 2.9776 3.1061 3.1061 3.9079 3.9079 3.9455 3.9455 4.1734 4.1734 4.3277 4.3277 4.3794 4.3794 4.6214 4.6214 4.7818 4.7818 5.0821 5.0821 5.2074 5.2074 5.3042 5.3042 5.5431 5.5431 5.6167 5.6167 5.7084 5.7084 5.9571 5.9571 5.9755 5.9755 6.1130 6.1130 6.3842 6.3842 6.4397 6.4397 6.4616 6.4616 6.8598 6.8598 6.9198 6.9198 7.1103 7.1103 7.1383 7.1383 7.2553 7.2553 7.3504 7.3504 7.4098 7.4098 7.6607 7.6607 7.7081 7.7081 7.8926 7.8926 7.9754 7.9754 8.1374 8.1374 8.3430 8.3430 8.3867 8.3867 8.8599 8.8599 8.9760 8.9760 9.0616 9.0616 11.0845 11.0845 11.1255 11.1255 11.2463 11.2463 11.7243 11.7243 11.8837 11.8837 11.9828 11.9828 13.4204 13.4204 k = 0.4324-0.3058 0.5296 ( 9768 PWs) bands (ev): -17.8365 -17.8365 -4.7105 -4.7105 -2.9223 -2.9223 -2.9093 -2.9093 -1.5212 -1.5212 -1.4125 -1.4125 -0.6265 -0.6265 -0.5437 -0.5437 -0.5024 -0.5024 0.0167 0.0167 1.2617 1.2617 1.2690 1.2690 1.2921 1.2921 2.7615 2.7615 3.0212 3.0212 3.1275 3.1275 3.9111 3.9111 3.9381 3.9381 4.1701 4.1701 4.3335 4.3335 4.3733 4.3733 4.5893 4.5893 4.7379 4.7379 5.0854 5.0854 5.1692 5.1692 5.3383 5.3383 5.5618 5.5618 5.6196 5.6196 5.6932 5.6932 5.9665 5.9665 5.9782 5.9782 6.1188 6.1188 6.4076 6.4076 6.4463 6.4463 6.4592 6.4592 6.9084 6.9084 6.9969 6.9969 7.1027 7.1027 7.2037 7.2037 7.2703 7.2703 7.3538 7.3538 7.4297 7.4297 7.6617 7.6617 7.6852 7.6852 7.8540 7.8540 7.9420 7.9420 8.1268 8.1268 8.2746 8.2746 8.3358 8.3358 8.8282 8.8282 8.9239 8.9239 8.9990 8.9990 11.0495 11.0495 11.0836 11.0836 11.1789 11.1789 11.7416 11.7416 11.8518 11.8518 11.9317 11.9317 13.5328 13.5328 k = 0.4459-0.3153 0.5462 ( 9748 PWs) bands (ev): -17.8365 -17.8365 -4.7108 -4.7108 -2.9197 -2.9197 -2.9112 -2.9112 -1.4918 -1.4918 -1.4213 -1.4213 -0.6400 -0.6400 -0.5416 -0.5416 -0.5117 -0.5117 -0.0217 -0.0217 1.2642 1.2642 1.2732 1.2732 1.2876 1.2876 2.8012 2.8012 3.0666 3.0666 3.1460 3.1460 3.9139 3.9139 3.9317 3.9317 4.1667 4.1667 4.3379 4.3379 4.3667 4.3667 4.5501 4.5501 4.7041 4.7041 5.0896 5.0896 5.1414 5.1414 5.3690 5.3690 5.5773 5.5773 5.6225 5.6225 5.6759 5.6759 5.9741 5.9741 5.9812 5.9812 6.1243 6.1243 6.4265 6.4265 6.4522 6.4522 6.4574 6.4574 6.9418 6.9418 7.0456 7.0456 7.1011 7.1011 7.2244 7.2244 7.3331 7.3331 7.3858 7.3858 7.4628 7.4628 7.6613 7.6613 7.6738 7.6738 7.8215 7.8215 7.9149 7.9149 8.1011 8.1011 8.1876 8.1876 8.2897 8.2897 8.8046 8.8046 8.8720 8.8720 8.9543 8.9543 11.0187 11.0187 11.0443 11.0443 11.1257 11.1257 11.7549 11.7549 11.8247 11.8247 11.8938 11.8938 13.5836 13.5837 k = 0.4595-0.3249 0.5627 ( 9752 PWs) bands (ev): -17.8365 -17.8365 -4.7110 -4.7110 -2.9175 -2.9175 -2.9127 -2.9127 -1.4682 -1.4682 -1.4281 -1.4281 -0.6508 -0.6508 -0.5377 -0.5377 -0.5189 -0.5189 -0.0551 -0.0551 1.2660 1.2660 1.2767 1.2767 1.2844 1.2844 2.8299 2.8299 3.1103 3.1103 3.1610 3.1610 3.9161 3.9161 3.9264 3.9264 4.1632 4.1632 4.3409 4.3409 4.3598 4.3598 4.5091 4.5091 4.6816 4.6816 5.0938 5.0938 5.1222 5.1222 5.3960 5.3960 5.5886 5.5886 5.6253 5.6253 5.6582 5.6582 5.9801 5.9801 5.9840 5.9840 6.1293 6.1293 6.4407 6.4407 6.4560 6.4560 6.4583 6.4583 6.9655 6.9655 7.0290 7.0290 7.1536 7.1536 7.2213 7.2213 7.3785 7.3785 7.4605 7.4605 7.5052 7.5052 7.6406 7.6406 7.6993 7.6993 7.7977 7.7977 7.8955 7.8955 8.0589 8.0589 8.1090 8.1090 8.2252 8.2252 8.7884 8.7884 8.8274 8.8274 8.9246 8.9246 10.9932 10.9932 11.0095 11.0095 11.0865 11.0865 11.7637 11.7637 11.8020 11.8020 11.8688 11.8688 13.6218 13.6221 k = 0.4730-0.3344 0.5793 ( 9716 PWs) bands (ev): -17.8365 -17.8365 -4.7112 -4.7112 -2.9159 -2.9159 -2.9138 -2.9138 -1.4510 -1.4510 -1.4330 -1.4330 -0.6585 -0.6585 -0.5331 -0.5331 -0.5240 -0.5240 -0.0813 -0.0813 1.2669 1.2669 1.2793 1.2793 1.2826 1.2826 2.8490 2.8490 3.1473 3.1473 3.1720 3.1720 3.9177 3.9177 3.9224 3.9224 4.1598 4.1598 4.3429 4.3429 4.3527 4.3527 4.4747 4.4747 4.6678 4.6678 5.0974 5.0974 5.1098 5.1098 5.4183 5.4183 5.5949 5.5949 5.6278 5.6278 5.6430 5.6430 5.9845 5.9845 5.9862 5.9862 6.1333 6.1333 6.4495 6.4495 6.4553 6.4553 6.4644 6.4644 6.9812 6.9812 7.0097 7.0097 7.1916 7.1916 7.2179 7.2179 7.4235 7.4235 7.5235 7.5235 7.5481 7.5481 7.6195 7.6195 7.7478 7.7478 7.7911 7.7911 7.8865 7.8865 8.0055 8.0055 8.0427 8.0427 8.1434 8.1434 8.7781 8.7781 8.7953 8.7953 8.9060 8.9060 10.9743 10.9743 10.9821 10.9821 11.0599 11.0599 11.7681 11.7681 11.7846 11.7846 11.8548 11.8548 13.6485 13.6494 k = 0.4865-0.3440 0.5958 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9150 -2.9150 -2.9144 -2.9144 -1.4405 -1.4405 -1.4359 -1.4359 -0.6631 -0.6631 -0.5295 -0.5295 -0.5271 -0.5271 -0.0982 -0.0982 1.2673 1.2673 1.2810 1.2810 1.2818 1.2818 2.8598 2.8598 3.1722 3.1722 3.1788 3.1788 3.9186 3.9186 3.9198 3.9198 4.1571 4.1571 4.3439 4.3439 4.3467 4.3467 4.4529 4.4529 4.6604 4.6604 5.0998 5.0998 5.1029 5.1029 5.4337 5.4337 5.5964 5.5964 5.6297 5.6297 5.6334 5.6334 5.9872 5.9872 5.9876 5.9876 6.1358 6.1358 6.4536 6.4536 6.4549 6.4549 6.4696 6.4696 6.9899 6.9899 6.9970 6.9970 7.2104 7.2104 7.2163 7.2163 7.4670 7.4670 7.5601 7.5601 7.5725 7.5725 7.6035 7.6035 7.7723 7.7723 7.8488 7.8488 7.8919 7.8919 7.9600 7.9600 7.9863 7.9863 8.0491 8.0491 8.7723 8.7723 8.7766 8.7766 8.8959 8.8959 10.9626 10.9626 10.9646 10.9646 11.0445 11.0445 11.7697 11.7697 11.7737 11.7737 11.8485 11.8485 13.6636 13.6646 k = 0.5000-0.3536 0.6124 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9147 -2.9147 -2.9146 -2.9146 -1.4370 -1.4370 -1.4369 -1.4369 -0.6647 -0.6647 -0.5281 -0.5281 -0.5281 -0.5281 -0.1041 -0.1041 1.2673 1.2673 1.2816 1.2816 1.2816 1.2816 2.8633 2.8633 3.1811 3.1811 3.1811 3.1811 3.9189 3.9189 3.9190 3.9190 4.1561 4.1561 4.3442 4.3442 4.3442 4.3442 4.4456 4.4456 4.6580 4.6580 5.1006 5.1006 5.1006 5.1006 5.4393 5.4393 5.5960 5.5960 5.6304 5.6304 5.6304 5.6304 5.9881 5.9881 5.9881 5.9881 6.1367 6.1367 6.4548 6.4548 6.4548 6.4548 6.4716 6.4716 6.9926 6.9926 6.9926 6.9926 7.2159 7.2159 7.2159 7.2159 7.4878 7.4878 7.5719 7.5719 7.5719 7.5719 7.6027 7.6027 7.7757 7.7757 7.8995 7.8995 7.9432 7.9432 7.9433 7.9433 7.9546 7.9546 7.9546 7.9546 8.7705 8.7705 8.7705 8.7705 8.8927 8.8927 10.9586 10.9586 10.9587 10.9587 11.0394 11.0394 11.7699 11.7699 11.7700 11.7700 11.8468 11.8468 13.6678 13.6678 k = 0.5000-0.3536 0.6124 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9147 -2.9147 -2.9146 -2.9146 -1.4370 -1.4370 -1.4369 -1.4369 -0.6647 -0.6647 -0.5281 -0.5281 -0.5281 -0.5281 -0.1041 -0.1041 1.2673 1.2673 1.2816 1.2816 1.2816 1.2816 2.8633 2.8633 3.1811 3.1811 3.1811 3.1811 3.9189 3.9189 3.9190 3.9190 4.1561 4.1561 4.3442 4.3442 4.3442 4.3442 4.4456 4.4456 4.6580 4.6580 5.1006 5.1006 5.1006 5.1006 5.4393 5.4393 5.5960 5.5960 5.6304 5.6304 5.6304 5.6304 5.9881 5.9881 5.9881 5.9881 6.1367 6.1367 6.4548 6.4548 6.4548 6.4548 6.4716 6.4716 6.9926 6.9926 6.9926 6.9926 7.2159 7.2159 7.2159 7.2159 7.4878 7.4878 7.5719 7.5719 7.5719 7.5719 7.6027 7.6027 7.7757 7.7757 7.8995 7.8995 7.9432 7.9432 7.9433 7.9433 7.9546 7.9546 7.9546 7.9546 8.7705 8.7705 8.7705 8.7705 8.8927 8.8927 10.9586 10.9586 10.9587 10.9587 11.0394 11.0394 11.7699 11.7699 11.7700 11.7700 11.8468 11.8468 13.6678 13.6679 k = 0.4808-0.3400 0.6124 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9150 -2.9150 -2.9145 -2.9145 -1.4394 -1.4394 -1.4370 -1.4370 -0.6632 -0.6632 -0.5311 -0.5311 -0.5253 -0.5253 -0.0982 -0.0982 1.2673 1.2673 1.2811 1.2811 1.2817 1.2817 2.8598 2.8598 3.1721 3.1721 3.1788 3.1788 3.9189 3.9189 3.9196 3.9196 4.1571 4.1571 4.3446 4.3446 4.3461 4.3461 4.4529 4.4529 4.6604 4.6604 5.1005 5.1005 5.1021 5.1021 5.4336 5.4336 5.5965 5.5965 5.6294 5.6294 5.6336 5.6336 5.9867 5.9867 5.9880 5.9880 6.1358 6.1358 6.4530 6.4530 6.4556 6.4556 6.4696 6.4696 6.9913 6.9913 6.9955 6.9955 7.2119 7.2119 7.2150 7.2150 7.4661 7.4661 7.5599 7.5599 7.5737 7.5737 7.6026 7.6026 7.7730 7.7730 7.8593 7.8593 7.8877 7.8877 7.9327 7.9327 8.0104 8.0104 8.0462 8.0462 8.7712 8.7712 8.7776 8.7776 8.8960 8.8960 10.9631 10.9631 10.9643 10.9643 11.0445 11.0445 11.7704 11.7704 11.7730 11.7730 11.8484 11.8484 13.6641 13.6650 k = 0.4615-0.3264 0.6124 ( 9720 PWs) bands (ev): -17.8365 -17.8365 -4.7112 -4.7112 -2.9158 -2.9158 -2.9139 -2.9139 -1.4467 -1.4467 -1.4373 -1.4373 -0.6599 -0.6599 -0.5388 -0.5388 -0.5166 -0.5166 -0.0813 -0.0813 1.2670 1.2670 1.2799 1.2799 1.2819 1.2819 2.8488 2.8488 3.1469 3.1469 3.1721 3.1721 3.9187 3.9187 3.9213 3.9213 4.1598 4.1598 4.3454 4.3454 4.3510 4.3510 4.4739 4.4739 4.6685 4.6685 5.1003 5.1003 5.1067 5.1067 5.4184 5.4184 5.5953 5.5953 5.6265 5.6265 5.6437 5.6437 5.9826 5.9826 5.9879 5.9879 6.1332 6.1332 6.4474 6.4474 6.4571 6.4571 6.4644 6.4644 6.9859 6.9859 7.0036 7.0036 7.2002 7.2002 7.2126 7.2126 7.4156 7.4156 7.5216 7.5216 7.5599 7.5599 7.6119 7.6119 7.7659 7.7659 7.8014 7.8014 7.8764 7.8764 7.9397 7.9397 8.0895 8.0895 8.1495 8.1495 8.7729 8.7729 8.7982 8.7982 8.9076 8.9076 10.9762 10.9762 10.9809 10.9809 11.0600 11.0600 11.7718 11.7718 11.7822 11.7822 11.8538 11.8538 13.6517 13.6530 k = 0.4423-0.3128 0.6124 ( 9752 PWs) bands (ev): -17.8365 -17.8365 -4.7110 -4.7110 -2.9173 -2.9173 -2.9130 -2.9130 -1.4583 -1.4583 -1.4379 -1.4379 -0.6581 -0.6581 -0.5468 -0.5468 -0.5012 -0.5012 -0.0559 -0.0559 1.2663 1.2663 1.2781 1.2781 1.2822 1.2822 2.8295 2.8295 3.1099 3.1099 3.1609 3.1609 3.9185 3.9185 3.9239 3.9239 4.1632 4.1632 4.3462 4.3462 4.3581 4.3581 4.5045 4.5045 4.6849 4.6849 5.1002 5.1002 5.1146 5.1146 5.3973 5.3973 5.5903 5.5903 5.6218 5.6218 5.6589 5.6589 5.9755 5.9755 5.9876 5.9876 6.1293 6.1293 6.4377 6.4377 6.4527 6.4527 6.4642 6.4642 6.9724 6.9724 7.0150 7.0150 7.1814 7.1814 7.2094 7.2094 7.3520 7.3520 7.4687 7.4687 7.5275 7.5275 7.6185 7.6185 7.7389 7.7389 7.8053 7.8053 7.8789 7.8789 7.9531 7.9531 8.1693 8.1693 8.2562 8.2562 8.7739 8.7739 8.8292 8.8292 8.9327 8.9327 10.9976 10.9976 11.0075 11.0075 11.0858 11.0858 11.7738 11.7738 11.7970 11.7970 11.8639 11.8639 13.6258 13.6262 k = 0.4231-0.2992 0.6124 ( 9752 PWs) bands (ev): -17.8365 -17.8365 -4.7108 -4.7108 -2.9193 -2.9193 -2.9117 -2.9117 -1.4733 -1.4733 -1.4391 -1.4391 -0.6620 -0.6620 -0.5500 -0.5500 -0.4783 -0.4783 -0.0242 -0.0242 1.2645 1.2645 1.2763 1.2763 1.2825 1.2825 2.8007 2.8007 3.0669 3.0669 3.1457 3.1457 3.9182 3.9182 3.9273 3.9273 4.1665 4.1665 4.3468 4.3468 4.3669 4.3669 4.5366 4.5366 4.7141 4.7141 5.1006 5.1006 5.1262 5.1262 5.3729 5.3729 5.5815 5.5815 5.6154 5.6154 5.6756 5.6756 5.9654 5.9654 5.9872 5.9872 6.1245 6.1245 6.4228 6.4228 6.4427 6.4427 6.4697 6.4697 6.9446 6.9446 7.0259 7.0259 7.1546 7.1546 7.2068 7.2068 7.2900 7.2900 7.4142 7.4142 7.4831 7.4831 7.6145 7.6145 7.7321 7.7321 7.8312 7.8312 7.8916 7.8916 7.9703 7.9703 8.2416 8.2416 8.3638 8.3638 8.7731 8.7731 8.8647 8.8647 8.9787 8.9787 11.0269 11.0269 11.0426 11.0426 11.1218 11.1218 11.7762 11.7762 11.8169 11.8169 11.8800 11.8800 13.5847 13.5847 k = 0.4038-0.2856 0.6124 ( 9766 PWs) bands (ev): -17.8365 -17.8365 -4.7105 -4.7105 -2.9219 -2.9219 -2.9100 -2.9100 -1.4909 -1.4909 -1.4411 -1.4411 -0.6732 -0.6732 -0.5459 -0.5459 -0.4473 -0.4473 0.0112 0.0112 1.2611 1.2611 1.2751 1.2751 1.2827 1.2827 2.7610 2.7610 3.0233 3.0233 3.1266 3.1266 3.9178 3.9178 3.9311 3.9311 4.1694 4.1694 4.3471 4.3471 4.3775 4.3775 4.5627 4.5627 4.7582 4.7582 5.1024 5.1024 5.1421 5.1421 5.3470 5.3470 5.5694 5.5694 5.6076 5.6076 5.6911 5.6911 5.9521 5.9521 5.9864 5.9864 6.1194 6.1194 6.4028 6.4028 6.4313 6.4313 6.4771 6.4771 6.8984 6.8984 7.0300 7.0300 7.1154 7.1154 7.2056 7.2056 7.2447 7.2447 7.3672 7.3672 7.4370 7.4370 7.6045 7.6045 7.7454 7.7454 7.8590 7.8590 7.9162 7.9162 7.9906 7.9906 8.3034 8.3034 8.4692 8.4692 8.7713 8.7713 8.9008 8.9008 9.0488 9.0488 11.0633 11.0633 11.0847 11.0847 11.1672 11.1672 11.7794 11.7794 11.8415 11.8415 11.9033 11.9033 13.5246 13.5246 k = 0.3846-0.2720 0.6124 ( 9774 PWs) bands (ev): -17.8365 -17.8365 -4.7102 -4.7102 -2.9249 -2.9249 -2.9080 -2.9080 -1.5104 -1.5104 -1.4443 -1.4443 -0.6891 -0.6891 -0.5358 -0.5358 -0.4088 -0.4088 0.0485 0.0485 1.2562 1.2562 1.2742 1.2742 1.2829 1.2829 2.7109 2.7109 2.9827 2.9827 3.1040 3.1040 3.9175 3.9175 3.9354 3.9354 4.1719 4.1719 4.3473 4.3473 4.3898 4.3898 4.5811 4.5811 4.8124 4.8124 5.1065 5.1065 5.1637 5.1637 5.3204 5.3204 5.5545 5.5545 5.5982 5.5982 5.7035 5.7035 5.9356 5.9356 5.9850 5.9850 6.1145 6.1145 6.3776 6.3776 6.4189 6.4189 6.4852 6.4852 6.8362 6.8362 7.0157 7.0157 7.0700 7.0700 7.1940 7.1940 7.2298 7.2298 7.3370 7.3370 7.3966 7.3966 7.5952 7.5952 7.7680 7.7680 7.8819 7.8819 7.9530 7.9530 8.0154 8.0154 8.3546 8.3546 8.5679 8.5679 8.7715 8.7715 8.9387 8.9387 9.1392 9.1392 11.1058 11.1058 11.1322 11.1322 11.2200 11.2200 11.7841 11.7841 11.8710 11.8710 11.9344 11.9344 13.4465 13.4465 k = 0.3654-0.2584 0.6124 ( 9774 PWs) bands (ev): -17.8366 -17.8366 -4.7099 -4.7099 -2.9284 -2.9284 -2.9057 -2.9057 -1.5309 -1.5309 -1.4491 -1.4491 -0.7062 -0.7062 -0.5218 -0.5218 -0.3636 -0.3636 0.0863 0.0863 1.2503 1.2503 1.2728 1.2728 1.2830 1.2830 2.6524 2.6524 2.9461 2.9461 3.0783 3.0783 3.9174 3.9174 3.9402 3.9402 4.1739 4.1739 4.3476 4.3476 4.4038 4.4038 4.5944 4.5944 4.8672 4.8672 5.1144 5.1144 5.1926 5.1926 5.2940 5.2940 5.5375 5.5375 5.5874 5.5874 5.7117 5.7117 5.9161 5.9161 5.9829 5.9829 6.1100 6.1100 6.3473 6.3473 6.4046 6.4046 6.4919 6.4919 6.7674 6.7674 6.9712 6.9712 7.0341 7.0341 7.1659 7.1659 7.2428 7.2428 7.3220 7.3220 7.3695 7.3695 7.5901 7.5901 7.7947 7.7947 7.9018 7.9018 7.9926 7.9926 8.0493 8.0493 8.3965 8.3965 8.6498 8.6498 8.7830 8.7830 8.9808 8.9808 9.2444 9.2444 11.1534 11.1534 11.1837 11.1837 11.2772 11.2772 11.7920 11.7920 11.9062 11.9062 11.9729 11.9729 13.3556 13.3556 k = 0.3462-0.2448 0.6124 ( 9786 PWs) bands (ev): -17.8366 -17.8366 -4.7094 -4.7094 -2.9323 -2.9323 -2.9030 -2.9030 -1.5519 -1.5519 -1.4557 -1.4557 -0.7219 -0.7219 -0.5049 -0.5049 -0.3129 -0.3129 0.1234 0.1234 1.2436 1.2436 1.2701 1.2701 1.2833 1.2833 2.5888 2.5888 2.9127 2.9127 3.0499 3.0499 3.9174 3.9174 3.9453 3.9453 4.1755 4.1755 4.3481 4.3481 4.4192 4.4192 4.6052 4.6052 4.9130 4.9130 5.1269 5.1269 5.2280 5.2280 5.2707 5.2707 5.5188 5.5188 5.5752 5.5752 5.7149 5.7149 5.8943 5.8943 5.9799 5.9799 6.1058 6.1058 6.3116 6.3116 6.3871 6.3871 6.4935 6.4935 6.7045 6.7045 6.9134 6.9134 6.9955 6.9955 7.1414 7.1414 7.2567 7.2567 7.3123 7.3123 7.3656 7.3656 7.5914 7.5914 7.8233 7.8233 7.9218 7.9218 8.0249 8.0249 8.0981 8.0981 8.4302 8.4302 8.6965 8.6965 8.8236 8.8236 9.0293 9.0293 9.3594 9.3594 11.2050 11.2050 11.2375 11.2375 11.3347 11.3347 11.8050 11.8050 11.9483 11.9483 12.0178 12.0178 13.2585 13.2585 k = 0.3269-0.2312 0.6124 ( 9782 PWs) bands (ev): -17.8366 -17.8366 -4.7090 -4.7090 -2.9364 -2.9364 -2.9001 -2.9001 -1.5727 -1.5727 -1.4645 -1.4645 -0.7346 -0.7346 -0.4857 -0.4857 -0.2576 -0.2576 0.1587 0.1587 1.2364 1.2364 1.2652 1.2652 1.2840 1.2840 2.5235 2.5235 2.8815 2.8815 3.0192 3.0192 3.9178 3.9178 3.9508 3.9508 4.1768 4.1768 4.3490 4.3490 4.4359 4.4359 4.6151 4.6151 4.9448 4.9448 5.1436 5.1436 5.2313 5.2313 5.2883 5.2883 5.4999 5.4999 5.5618 5.5618 5.7127 5.7127 5.8713 5.8713 5.9761 5.9761 6.1016 6.1016 6.2705 6.2705 6.3634 6.3634 6.4846 6.4846 6.6604 6.6604 6.8564 6.8564 6.9478 6.9478 7.1255 7.1255 7.2469 7.2469 7.3238 7.3238 7.3790 7.3790 7.6008 7.6008 7.8521 7.8521 7.9433 7.9433 8.0507 8.0507 8.1583 8.1583 8.4567 8.4567 8.7140 8.7140 8.8870 8.8870 9.0858 9.0858 9.4806 9.4806 11.2591 11.2591 11.2914 11.2914 11.3887 11.3887 11.8254 11.8254 11.9984 11.9984 12.0684 12.0684 13.1612 13.1612 k = 0.3077-0.2176 0.6124 ( 9782 PWs) bands (ev): -17.8366 -17.8366 -4.7085 -4.7085 -2.9409 -2.9409 -2.8969 -2.8969 -1.5931 -1.5931 -1.4756 -1.4756 -0.7434 -0.7434 -0.4645 -0.4645 -0.1989 -0.1989 0.1916 0.1916 1.2287 1.2287 1.2577 1.2577 1.2850 1.2850 2.4596 2.4596 2.8514 2.8514 2.9865 2.9865 3.9188 3.9188 3.9567 3.9567 4.1777 4.1777 4.3504 4.3504 4.4537 4.4537 4.6249 4.6249 4.9636 4.9636 5.1620 5.1620 5.2063 5.2063 5.3363 5.3363 5.4834 5.4834 5.5485 5.5485 5.7051 5.7051 5.8487 5.8487 5.9714 5.9714 6.0965 6.0965 6.2246 6.2246 6.3306 6.3306 6.4663 6.4663 6.6399 6.6399 6.8041 6.8041 6.8964 6.8964 7.1168 7.1168 7.2213 7.2213 7.3491 7.3491 7.4009 7.4009 7.6193 7.6193 7.8803 7.8803 7.9670 7.9670 8.0738 8.0738 8.2244 8.2244 8.4769 8.4769 8.7253 8.7253 8.9514 8.9514 9.1505 9.1505 9.6048 9.6048 11.3133 11.3133 11.3431 11.3431 11.4367 11.4367 11.8542 11.8542 12.0561 12.0561 12.1235 12.1235 13.0687 13.0687 k = 0.2885-0.2040 0.6124 ( 9794 PWs) bands (ev): -17.8366 -17.8366 -4.7080 -4.7080 -2.9456 -2.9456 -2.8934 -2.8934 -1.6127 -1.6127 -1.4889 -1.4889 -0.7479 -0.7479 -0.4413 -0.4413 -0.1373 -0.1373 0.2213 0.2213 1.2204 1.2204 1.2473 1.2473 1.2862 1.2862 2.3994 2.3994 2.8219 2.8219 2.9524 2.9524 3.9204 3.9204 3.9630 3.9630 4.1782 4.1782 4.3523 4.3523 4.4726 4.4726 4.6351 4.6351 4.9734 4.9734 5.1714 5.1714 5.1876 5.1876 5.3723 5.3723 5.4744 5.4744 5.5391 5.5391 5.6928 5.6928 5.8286 5.8286 5.9662 5.9662 6.0886 6.0886 6.1770 6.1770 6.2896 6.2896 6.4476 6.4476 6.6333 6.6333 6.7569 6.7569 6.8483 6.8483 7.1130 7.1130 7.1923 7.1923 7.3736 7.3736 7.4298 7.4298 7.6468 7.6468 7.9071 7.9071 7.9931 7.9931 8.0958 8.0958 8.2931 8.2931 8.4925 8.4925 8.7393 8.7393 9.0105 9.0105 9.2212 9.2212 9.7291 9.7291 11.3625 11.3625 11.3919 11.3919 11.4795 11.4795 11.8902 11.8902 12.1197 12.1197 12.1824 12.1824 12.9858 12.9858 k = 0.2692-0.1904 0.6124 ( 9782 PWs) bands (ev): -17.8366 -17.8366 -4.7075 -4.7075 -2.9504 -2.9504 -2.8898 -2.8898 -1.6313 -1.6313 -1.5043 -1.5043 -0.7479 -0.7479 -0.4163 -0.4163 -0.0739 -0.0739 0.2474 0.2474 1.2104 1.2104 1.2344 1.2344 1.2876 1.2876 2.3448 2.3448 2.7926 2.7926 2.9171 2.9171 3.9228 3.9228 3.9696 3.9696 4.1784 4.1784 4.3548 4.3548 4.4924 4.4924 4.6459 4.6459 4.9777 4.9777 5.1463 5.1463 5.1995 5.1995 5.3796 5.3796 5.4700 5.4700 5.5425 5.5425 5.6792 5.6792 5.8129 5.8129 5.9601 5.9601 6.0732 6.0732 6.1355 6.1355 6.2458 6.2458 6.4330 6.4330 6.6293 6.6293 6.7125 6.7125 6.8102 6.8102 7.1127 7.1127 7.1630 7.1630 7.3949 7.3949 7.4638 7.4638 7.6818 7.6818 7.9323 7.9323 8.0211 8.0211 8.1173 8.1173 8.3612 8.3612 8.5070 8.5070 8.7583 8.7583 9.0654 9.0654 9.2946 9.2946 9.8509 9.8509 11.3977 11.3977 11.4415 11.4415 11.5204 11.5204 11.9294 11.9294 12.1846 12.1846 12.2441 12.2441 12.9177 12.9177 k = 0.2500-0.1768 0.6124 ( 9786 PWs) bands (ev): -17.8366 -17.8366 -4.7070 -4.7070 -2.9552 -2.9552 -2.8860 -2.8860 -1.6487 -1.6487 -1.5215 -1.5215 -0.7436 -0.7436 -0.3897 -0.3897 -0.0094 -0.0094 0.2699 0.2699 1.1959 1.1959 1.2216 1.2216 1.2891 1.2891 2.2973 2.2973 2.7636 2.7636 2.8810 2.8810 3.9261 3.9261 3.9765 3.9765 4.1782 4.1782 4.3578 4.3578 4.5129 4.5129 4.6573 4.6573 4.9784 4.9784 5.1170 5.1170 5.2094 5.2094 5.3687 5.3687 5.4561 5.4561 5.5521 5.5521 5.6706 5.6706 5.8038 5.8038 5.9523 5.9523 6.0449 6.0449 6.1102 6.1102 6.2050 6.2050 6.4218 6.4218 6.6215 6.6215 6.6692 6.6692 6.7867 6.7867 7.1133 7.1133 7.1360 7.1360 7.4151 7.4151 7.5004 7.5004 7.7224 7.7224 7.9556 7.9556 8.0498 8.0498 8.1388 8.1388 8.4227 8.4227 8.5279 8.5279 8.7823 8.7823 9.1180 9.1180 9.3675 9.3675 9.9672 9.9672 11.4172 11.4172 11.4920 11.4920 11.5613 11.5613 11.9659 11.9659 12.2448 12.2448 12.3056 12.3056 12.8701 12.8701 k = 0.2308-0.1632 0.6124 ( 9782 PWs) bands (ev): -17.8367 -17.8367 -4.7065 -4.7065 -2.9601 -2.9601 -2.8821 -2.8821 -1.6647 -1.6647 -1.5400 -1.5400 -0.7354 -0.7354 -0.3614 -0.3614 0.0551 0.0551 0.2890 0.2890 1.1737 1.1737 1.2114 1.2114 1.2907 1.2907 2.2578 2.2578 2.7349 2.7349 2.8444 2.8444 3.9305 3.9305 3.9838 3.9838 4.1777 4.1777 4.3612 4.3612 4.5342 4.5342 4.6692 4.6692 4.9763 4.9763 5.0874 5.0874 5.2101 5.2101 5.3538 5.3538 5.4352 5.4352 5.5473 5.5473 5.6686 5.6686 5.8034 5.8034 5.9399 5.9399 6.0140 6.0140 6.0973 6.0973 6.1711 6.1711 6.4122 6.4122 6.6032 6.6032 6.6342 6.6342 6.7756 6.7756 7.0994 7.0994 7.1263 7.1263 7.4369 7.4369 7.5372 7.5372 7.7666 7.7666 7.9768 7.9768 8.0781 8.0781 8.1607 8.1607 8.4681 8.4681 8.5668 8.5668 8.8110 8.8110 9.1701 9.1701 9.4376 9.4376 10.0743 10.0743 11.4259 11.4259 11.5403 11.5403 11.6015 11.6015 11.9938 11.9938 12.2945 12.2945 12.3610 12.3610 12.8425 12.8425 k = 0.2115-0.1496 0.6124 ( 9758 PWs) bands (ev): -17.8367 -17.8367 -4.7060 -4.7060 -2.9648 -2.9648 -2.8782 -2.8782 -1.6794 -1.6794 -1.5594 -1.5594 -0.7238 -0.7238 -0.3318 -0.3318 0.1179 0.1179 0.3057 0.3057 1.1447 1.1447 1.2031 1.2031 1.2923 1.2923 2.2268 2.2268 2.7066 2.7066 2.8077 2.8077 3.9361 3.9361 3.9916 3.9916 4.1768 4.1768 4.3650 4.3650 4.5561 4.5561 4.6812 4.6812 4.9706 4.9706 5.0594 5.0594 5.1989 5.1989 5.3386 5.3386 5.4130 5.4130 5.5294 5.5294 5.6653 5.6653 5.8103 5.8103 5.9203 5.9203 5.9918 5.9918 6.0897 6.0897 6.1463 6.1463 6.4027 6.4027 6.5672 6.5672 6.6195 6.6195 6.7715 6.7715 7.0736 7.0736 7.1306 7.1306 7.4616 7.4616 7.5729 7.5729 7.8125 7.8125 7.9954 7.9954 8.1043 8.1043 8.1831 8.1831 8.4992 8.4992 8.6234 8.6234 8.8441 8.8441 9.2226 9.2226 9.5034 9.5034 10.1682 10.1682 11.4284 11.4284 11.5851 11.5851 11.6400 11.6400 12.0093 12.0093 12.3276 12.3276 12.4049 12.4049 12.7793 12.7793 k = 0.1923-0.1360 0.6124 ( 9774 PWs) bands (ev): -17.8367 -17.8367 -4.7055 -4.7055 -2.9694 -2.9694 -2.8743 -2.8743 -1.6926 -1.6926 -1.5792 -1.5792 -0.7095 -0.7095 -0.3011 -0.3011 0.1758 0.1758 0.3230 0.3230 1.1103 1.1103 1.1952 1.1952 1.2940 1.2940 2.2044 2.2044 2.6787 2.6787 2.7714 2.7714 3.9429 3.9429 3.9998 3.9998 4.1756 4.1756 4.3689 4.3689 4.5787 4.5787 4.6933 4.6933 4.9588 4.9588 5.0363 5.0363 5.1765 5.1765 5.3203 5.3203 5.3934 5.3934 5.5060 5.5060 5.6587 5.6587 5.8190 5.8190 5.8975 5.8975 5.9760 5.9760 6.0860 6.0860 6.1312 6.1312 6.3918 6.3918 6.5281 6.5281 6.6147 6.6147 6.7705 6.7705 7.0480 7.0480 7.1364 7.1364 7.4899 7.4899 7.6068 7.6068 7.8580 7.8580 8.0113 8.0113 8.1269 8.1269 8.2063 8.2063 8.5297 8.5297 8.6852 8.6852 8.8821 8.8821 9.2759 9.2759 9.5637 9.5637 10.2441 10.2441 11.4276 11.4276 11.6255 11.6255 11.6776 11.6776 12.0123 12.0123 12.3384 12.3384 12.4377 12.4377 12.6812 12.6812 k = 0.1731-0.1224 0.6124 ( 9772 PWs) bands (ev): -17.8367 -17.8367 -4.7050 -4.7050 -2.9738 -2.9738 -2.8704 -2.8704 -1.7044 -1.7044 -1.5989 -1.5989 -0.6931 -0.6931 -0.2696 -0.2696 0.2223 0.2223 0.3471 0.3471 1.0719 1.0719 1.1868 1.1868 1.2956 1.2956 2.1902 2.1902 2.6513 2.6513 2.7359 2.7359 3.9507 3.9507 4.0084 4.0084 4.1742 4.1742 4.3726 4.3726 4.6018 4.6018 4.7050 4.7050 4.9382 4.9382 5.0214 5.0214 5.1464 5.1464 5.2966 5.2966 5.3763 5.3763 5.4803 5.4803 5.6544 5.6544 5.8252 5.8252 5.8767 5.8767 5.9611 5.9611 6.0830 6.0830 6.1260 6.1260 6.3785 6.3785 6.4926 6.4926 6.6157 6.6157 6.7701 6.7701 7.0241 7.0241 7.1420 7.1420 7.5219 7.5219 7.6382 7.6382 7.9007 7.9007 8.0250 8.0250 8.1446 8.1446 8.2304 8.2304 8.5670 8.5670 8.7446 8.7446 8.9253 8.9253 9.3300 9.3300 9.6178 9.6178 10.2971 10.2971 11.4254 11.4254 11.6604 11.6604 11.7176 11.7176 12.0058 12.0058 12.3271 12.3271 12.4622 12.4622 12.5860 12.5860 k = 0.1538-0.1088 0.6124 ( 9768 PWs) bands (ev): -17.8367 -17.8367 -4.7046 -4.7046 -2.9779 -2.9779 -2.8667 -2.8667 -1.7146 -1.7146 -1.6180 -1.6180 -0.6754 -0.6754 -0.2377 -0.2377 0.2500 0.2500 0.3851 0.3851 1.0308 1.0308 1.1774 1.1774 1.2971 1.2971 2.1835 2.1835 2.6244 2.6244 2.7020 2.7020 3.9595 3.9595 4.0176 4.0176 4.1727 4.1727 4.3757 4.3757 4.6253 4.6253 4.7160 4.7160 4.9111 4.9111 5.0131 5.0131 5.1122 5.1122 5.2697 5.2697 5.3588 5.3588 5.4528 5.4528 5.6571 5.6571 5.8280 5.8280 5.8601 5.8601 5.9461 5.9461 6.0772 6.0772 6.1287 6.1287 6.3624 6.3624 6.4623 6.4623 6.6214 6.6214 6.7696 6.7696 7.0025 7.0025 7.1468 7.1468 7.5569 7.5569 7.6669 7.6669 7.9367 7.9367 8.0389 8.0389 8.1564 8.1564 8.2559 8.2559 8.6132 8.6132 8.7987 8.7987 8.9740 8.9740 9.3846 9.3846 9.6653 9.6653 10.3232 10.3232 11.4228 11.4228 11.6874 11.6874 11.7654 11.7654 11.9945 11.9945 12.2985 12.2985 12.4802 12.4802 12.5022 12.5022 k = 0.1346-0.0952 0.6124 ( 9774 PWs) bands (ev): -17.8367 -17.8367 -4.7042 -4.7042 -2.9817 -2.9817 -2.8632 -2.8632 -1.7233 -1.7233 -1.6361 -1.6361 -0.6572 -0.6572 -0.2060 -0.2060 0.2610 0.2610 0.4351 0.4351 0.9885 0.9885 1.1664 1.1664 1.2986 1.2986 2.1834 2.1834 2.5977 2.5977 2.6703 2.6703 3.9690 3.9690 4.0270 4.0270 4.1713 4.1713 4.3780 4.3780 4.6491 4.6491 4.7261 4.7261 4.8822 4.8822 5.0067 5.0067 5.0770 5.0770 5.2428 5.2428 5.3392 5.3392 5.4243 5.4243 5.6677 5.6677 5.8277 5.8277 5.8481 5.8481 5.9320 5.9320 6.0693 6.0693 6.1339 6.1339 6.3441 6.3441 6.4374 6.4374 6.6304 6.6304 6.7685 6.7685 6.9835 6.9835 7.1507 7.1507 7.5942 7.5942 7.6925 7.6925 7.9610 7.9610 8.0570 8.0570 8.1626 8.1626 8.2823 8.2823 8.6662 8.6662 8.8482 8.8482 9.0270 9.0270 9.4388 9.4388 9.7059 9.7059 10.3205 10.3205 11.4204 11.4204 11.7045 11.7045 11.8240 11.8240 11.9835 11.9835 12.2583 12.2583 12.4350 12.4350 12.4935 12.4935 k = 0.1154-0.0816 0.6124 ( 9770 PWs) bands (ev): -17.8367 -17.8367 -4.7038 -4.7038 -2.9851 -2.9851 -2.8600 -2.8600 -1.7305 -1.7305 -1.6528 -1.6528 -0.6391 -0.6391 -0.1751 -0.1751 0.2626 0.2626 0.4896 0.4896 0.9467 0.9467 1.1535 1.1535 1.3000 1.3000 2.1887 2.1887 2.5708 2.5708 2.6421 2.6421 3.9789 3.9789 4.0366 4.0366 4.1704 4.1704 4.3787 4.3787 4.6727 4.6727 4.7348 4.7348 4.8556 4.8556 4.9958 4.9958 5.0459 5.0459 5.2185 5.2185 5.3182 5.3182 5.3960 5.3960 5.6844 5.6844 5.8245 5.8245 5.8413 5.8413 5.9196 5.9196 6.0608 6.0608 6.1375 6.1375 6.3249 6.3249 6.4174 6.4174 6.6413 6.6413 6.7669 6.7669 6.9674 6.9674 7.1536 7.1536 7.6327 7.6327 7.7149 7.7149 7.9707 7.9707 8.0811 8.0811 8.1645 8.1645 8.3091 8.3091 8.7214 8.7214 8.8960 8.8960 9.0822 9.0822 9.4917 9.4917 9.7399 9.7399 10.2905 10.2905 11.4184 11.4184 11.7091 11.7091 11.8916 11.8916 11.9799 11.9799 12.2136 12.2136 12.3862 12.3862 12.5043 12.5043 k = 0.0962-0.0680 0.6124 ( 9766 PWs) bands (ev): -17.8367 -17.8367 -4.7035 -4.7035 -2.9880 -2.9880 -2.8571 -2.8571 -1.7362 -1.7362 -1.6678 -1.6678 -0.6220 -0.6220 -0.1459 -0.1459 0.2596 0.2596 0.5434 0.5434 0.9070 0.9070 1.1389 1.1389 1.3012 1.3012 2.1985 2.1985 2.5437 2.5437 2.6181 2.6181 3.9887 3.9887 4.0456 4.0456 4.1704 4.1704 4.3776 4.3776 4.6953 4.6953 4.7420 4.7420 4.8344 4.8344 4.9736 4.9736 5.0250 5.0250 5.1985 5.1985 5.2975 5.2975 5.3693 5.3693 5.7041 5.7041 5.8195 5.8195 5.8389 5.8389 5.9091 5.9091 6.0529 6.0529 6.1376 6.1376 6.3064 6.3064 6.4015 6.4015 6.6527 6.6527 6.7649 6.7649 6.9541 6.9541 7.1558 7.1558 7.6714 7.6714 7.7341 7.7341 7.9690 7.9690 8.1073 8.1073 8.1638 8.1638 8.3353 8.3353 8.7720 8.7720 8.9458 8.9458 9.1385 9.1385 9.5416 9.5416 9.7676 9.7676 10.2375 10.2375 11.4172 11.4172 11.6980 11.6980 11.9512 11.9512 12.0030 12.0030 12.1729 12.1729 12.3536 12.3536 12.5148 12.5148 k = 0.0769-0.0544 0.6124 ( 9782 PWs) bands (ev): -17.8368 -17.8368 -4.7032 -4.7032 -2.9905 -2.9905 -2.8547 -2.8547 -1.7405 -1.7405 -1.6809 -1.6809 -0.6066 -0.6066 -0.1194 -0.1194 0.2547 0.2547 0.5935 0.5935 0.8712 0.8712 1.1229 1.1229 1.3023 1.3023 2.2112 2.2112 2.5168 2.5168 2.5988 2.5988 3.9980 3.9980 4.0534 4.0534 4.1718 4.1718 4.3745 4.3745 4.7157 4.7157 4.7474 4.7474 4.8213 4.8213 4.9440 4.9440 5.0100 5.0100 5.1841 5.1841 5.2792 5.2792 5.3450 5.3450 5.7241 5.7241 5.8143 5.8143 5.8393 5.8393 5.9009 5.9009 6.0464 6.0464 6.1336 6.1336 6.2904 6.2904 6.3890 6.3890 6.6634 6.6634 6.7626 6.7626 6.9437 6.9437 7.1573 7.1573 7.7091 7.7091 7.7503 7.7503 7.9596 7.9596 8.1308 8.1308 8.1623 8.1623 8.3595 8.3595 8.8127 8.8127 8.9978 8.9978 9.1960 9.1960 9.5868 9.5868 9.7897 9.7897 10.1680 10.1680 11.4174 11.4174 11.6719 11.6719 11.9802 11.9802 12.0656 12.0656 12.1494 12.1494 12.3327 12.3327 12.5276 12.5276 k = 0.0577-0.0408 0.6124 ( 9774 PWs) bands (ev): -17.8368 -17.8368 -4.7030 -4.7030 -2.9925 -2.9925 -2.8527 -2.8527 -1.7434 -1.7434 -1.6916 -1.6916 -0.5937 -0.5937 -0.0969 -0.0969 0.2494 0.2494 0.6371 0.6371 0.8413 0.8413 1.1066 1.1066 1.3032 1.3032 2.2254 2.2254 2.4916 2.4916 2.5841 2.5841 4.0064 4.0064 4.0591 4.0591 4.1748 4.1748 4.3697 4.3697 4.7308 4.7308 4.7530 4.7530 4.8165 4.8165 4.9159 4.9159 4.9941 4.9941 5.1755 5.1755 5.2651 5.2651 5.3236 5.3236 5.7421 5.7421 5.8092 5.8092 5.8417 5.8417 5.8949 5.8949 6.0420 6.0420 6.1259 6.1259 6.2778 6.2778 6.3797 6.3797 6.6725 6.6725 6.7603 6.7603 6.9360 6.9360 7.1583 7.1583 7.7434 7.7434 7.7647 7.7647 7.9451 7.9451 8.1462 8.1462 8.1642 8.1642 8.3805 8.3805 8.8418 8.8418 9.0463 9.0463 9.2561 9.2561 9.6251 9.6251 9.8067 9.8067 10.0900 10.0900 11.4198 11.4198 11.6366 11.6366 12.0022 12.0022 12.0950 12.0950 12.1847 12.1847 12.3178 12.3178 12.5474 12.5474 k = 0.0385-0.0272 0.6124 ( 9784 PWs) bands (ev): -17.8368 -17.8368 -4.7029 -4.7029 -2.9939 -2.9939 -2.8513 -2.8513 -1.7452 -1.7452 -1.6997 -1.6997 -0.5839 -0.5839 -0.0795 -0.0795 0.2448 0.2448 0.6712 0.6712 0.8191 0.8191 1.0919 1.0919 1.3038 1.3038 2.2390 2.2390 2.4700 2.4700 2.5738 2.5738 4.0133 4.0133 4.0625 4.0625 4.1787 4.1787 4.3644 4.3644 4.7372 4.7372 4.7635 4.7635 4.8148 4.8148 4.8964 4.8964 4.9763 4.9763 5.1715 5.1715 5.2561 5.2561 5.3058 5.3058 5.7567 5.7567 5.8040 5.8040 5.8454 5.8454 5.8912 5.8912 6.0402 6.0402 6.1163 6.1163 6.2691 6.2691 6.3731 6.3731 6.6795 6.6795 6.7582 6.7582 6.9306 6.9306 7.1589 7.1589 7.7646 7.7646 7.7856 7.7856 7.9274 7.9274 8.1494 8.1494 8.1732 8.1732 8.3968 8.3968 8.8610 8.8610 9.0840 9.0840 9.3163 9.3163 9.6542 9.6542 9.8190 9.8190 10.0139 10.0139 11.4247 11.4247 11.6009 11.6009 12.0123 12.0123 12.1096 12.1096 12.2488 12.2488 12.3037 12.3037 12.5813 12.5813 k = 0.0192-0.0136 0.6124 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7028 -4.7028 -2.9947 -2.9947 -2.8504 -2.8504 -1.7461 -1.7461 -1.7047 -1.7047 -0.5779 -0.5779 -0.0685 -0.0685 0.2417 0.2417 0.6929 0.6929 0.8059 0.8059 1.0812 1.0812 1.3042 1.3042 2.2492 2.2492 2.4551 2.4551 2.5678 2.5678 4.0179 4.0179 4.0641 4.0641 4.1821 4.1821 4.3600 4.3600 4.7385 4.7385 4.7777 4.7777 4.8073 4.8073 4.8902 4.8902 4.9599 4.9599 5.1702 5.1702 5.2522 5.2522 5.2932 5.2932 5.7669 5.7669 5.7992 5.7992 5.8487 5.8487 5.8893 5.8893 6.0403 6.0403 6.1079 6.1079 6.2640 6.2640 6.3692 6.3692 6.6839 6.6839 6.7568 6.7568 6.9275 6.9275 7.1592 7.1592 7.7721 7.7721 7.8102 7.8102 7.9099 7.9099 8.1489 8.1489 8.1810 8.1810 8.4071 8.4071 8.8718 8.8718 9.1067 9.1067 9.3659 9.3659 9.6722 9.6722 9.8268 9.8268 9.9545 9.9545 11.4307 11.4307 11.5734 11.5734 12.0108 12.0108 12.1363 12.1363 12.2761 12.2761 12.3050 12.3050 12.6337 12.6337 k = 0.0000 0.0000 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7027 -4.7027 -2.9950 -2.9950 -2.8501 -2.8501 -1.7463 -1.7463 -1.7065 -1.7065 -0.5758 -0.5758 -0.0647 -0.0647 0.2406 0.2406 0.7003 0.7003 0.8017 0.8017 1.0773 1.0773 1.3043 1.3043 2.2531 2.2531 2.4496 2.4496 2.5657 2.5657 4.0195 4.0195 4.0644 4.0644 4.1835 4.1835 4.3583 4.3583 4.7387 4.7387 4.7922 4.7922 4.7944 4.7944 4.8910 4.8910 4.9524 4.9524 5.1699 5.1699 5.2514 5.2514 5.2885 5.2885 5.7709 5.7709 5.7969 5.7969 5.8500 5.8500 5.8888 5.8888 6.0407 6.0407 6.1044 6.1044 6.2624 6.2624 6.3680 6.3680 6.6854 6.6854 6.7563 6.7563 6.9265 6.9265 7.1594 7.1594 7.7742 7.7742 7.8217 7.8217 7.9012 7.9012 8.1485 8.1485 8.1838 8.1838 8.4107 8.4107 8.8753 8.8753 9.1142 9.1142 9.3861 9.3861 9.6781 9.6781 9.8297 9.8297 9.9310 9.9310 11.4337 11.4337 11.5627 11.5627 12.0089 12.0089 12.1512 12.1512 12.2692 12.2692 12.3178 12.3178 12.6712 12.6712 k = 0.0000 0.0000 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7027 -4.7027 -2.9950 -2.9950 -2.8501 -2.8501 -1.7463 -1.7463 -1.7065 -1.7065 -0.5758 -0.5758 -0.0647 -0.0647 0.2406 0.2406 0.7003 0.7003 0.8017 0.8017 1.0773 1.0773 1.3043 1.3043 2.2531 2.2531 2.4496 2.4496 2.5657 2.5657 4.0195 4.0195 4.0644 4.0644 4.1835 4.1835 4.3583 4.3583 4.7387 4.7387 4.7922 4.7922 4.7944 4.7944 4.8910 4.8910 4.9524 4.9524 5.1699 5.1699 5.2514 5.2514 5.2885 5.2885 5.7709 5.7709 5.7969 5.7969 5.8500 5.8500 5.8888 5.8888 6.0407 6.0407 6.1044 6.1044 6.2624 6.2624 6.3680 6.3680 6.6854 6.6854 6.7563 6.7563 6.9265 6.9265 7.1594 7.1594 7.7742 7.7742 7.8217 7.8217 7.9012 7.9012 8.1485 8.1485 8.1838 8.1838 8.4107 8.4107 8.8753 8.8753 9.1142 9.1142 9.3861 9.3861 9.6781 9.6781 9.8297 9.8297 9.9310 9.9310 11.4337 11.4337 11.5627 11.5627 12.0089 12.0089 12.1512 12.1512 12.2692 12.2692 12.3178 12.3178 12.6712 12.6712 k = 0.0000 0.0000 0.5888 ( 9786 PWs) bands (ev): -17.8368 -17.8368 -4.7027 -4.7027 -2.9948 -2.9948 -2.8499 -2.8499 -1.7891 -1.7891 -1.6629 -1.6629 -0.5760 -0.5760 -0.0633 -0.0633 0.2409 0.2409 0.7001 0.7001 0.8024 0.8024 1.0781 1.0781 1.3055 1.3055 2.2502 2.2502 2.4478 2.4478 2.5634 2.5634 4.0154 4.0154 4.0694 4.0694 4.1836 4.1836 4.3582 4.3582 4.7263 4.7263 4.7826 4.7826 4.8097 4.8097 4.8905 4.8905 4.9494 4.9494 5.1696 5.1696 5.2486 5.2486 5.2952 5.2952 5.7626 5.7626 5.7971 5.7971 5.8501 5.8501 5.8858 5.8858 6.0409 6.0409 6.1087 6.1087 6.2633 6.2633 6.3681 6.3681 6.6778 6.6778 6.7698 6.7698 6.9339 6.9339 7.1677 7.1677 7.7480 7.7480 7.8307 7.8307 7.9188 7.9188 8.1372 8.1372 8.1897 8.1897 8.4127 8.4127 8.8845 8.8845 9.1141 9.1141 9.3845 9.3845 9.6750 9.6750 9.8271 9.8271 9.9308 9.9308 11.4100 11.4100 11.5784 11.5784 11.9859 11.9859 12.1537 12.1537 12.2923 12.2923 12.3309 12.3309 12.6499 12.6499 k = 0.0000 0.0000 0.5653 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7024 -4.7024 -2.9943 -2.9943 -2.8496 -2.8496 -1.8461 -1.8461 -1.6035 -1.6035 -0.5767 -0.5767 -0.0590 -0.0590 0.2415 0.2415 0.6996 0.6996 0.8047 0.8047 1.0804 1.0804 1.3091 1.3091 2.2416 2.2416 2.4422 2.4422 2.5565 2.5565 4.0065 4.0065 4.0803 4.0803 4.1843 4.1843 4.3577 4.3577 4.6989 4.6989 4.7755 4.7755 4.8224 4.8224 4.8912 4.8912 4.9415 4.9415 5.1667 5.1667 5.2467 5.2467 5.3095 5.3095 5.7445 5.7445 5.7908 5.7908 5.8501 5.8501 5.8802 5.8802 6.0427 6.0427 6.1178 6.1178 6.2658 6.2658 6.3690 6.3690 6.6660 6.6660 6.7957 6.7957 6.9603 6.9603 7.1914 7.1914 7.7036 7.7036 7.8348 7.8348 7.9589 7.9589 8.1108 8.1108 8.2034 8.2034 8.4180 8.4180 8.9108 8.9108 9.1138 9.1138 9.3797 9.3797 9.6659 9.6659 9.8193 9.8193 9.9303 9.9303 11.3606 11.3606 11.6002 11.6002 11.9443 11.9443 12.1625 12.1625 12.3064 12.3064 12.3977 12.3977 12.6048 12.6048 k = 0.0000 0.0000 0.5417 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7021 -4.7021 -2.9934 -2.9934 -2.8489 -2.8489 -1.9030 -1.9030 -1.5425 -1.5425 -0.5778 -0.5778 -0.0520 -0.0520 0.2426 0.2426 0.6987 0.6987 0.8085 0.8085 1.0841 1.0841 1.3152 1.3152 2.2274 2.2274 2.4330 2.4330 2.5449 2.5449 3.9967 3.9967 4.0921 4.0921 4.1861 4.1861 4.3571 4.3571 4.6662 4.6662 4.7675 4.7675 4.8216 4.8216 4.8956 4.8956 4.9327 4.9327 5.1583 5.1583 5.2515 5.2515 5.3264 5.3264 5.7219 5.7219 5.7767 5.7767 5.8429 5.8429 5.8814 5.8814 6.0474 6.0474 6.1259 6.1259 6.2694 6.2694 6.3718 6.3718 6.6567 6.6567 6.8239 6.8239 7.0098 7.0098 7.2273 7.2273 7.6587 7.6587 7.8321 7.8321 7.9990 7.9990 8.0801 8.0801 8.2244 8.2244 8.4254 8.4254 8.9501 8.9501 9.1140 9.1140 9.3719 9.3719 9.6513 9.6513 9.8061 9.8061 9.9296 9.9296 11.3047 11.3047 11.6001 11.6001 11.9172 11.9172 12.1783 12.1783 12.3106 12.3106 12.4730 12.4730 12.5701 12.5701 k = 0.0000 0.0000 0.5182 ( 9804 PWs) bands (ev): -17.8368 -17.8368 -4.7015 -4.7015 -2.9922 -2.9922 -2.8480 -2.8480 -1.9590 -1.9590 -1.4809 -1.4809 -0.5794 -0.5794 -0.0421 -0.0421 0.2441 0.2441 0.6975 0.6975 0.8140 0.8140 1.0891 1.0891 1.3237 1.3237 2.2077 2.2077 2.4201 2.4201 2.5288 2.5288 3.9872 3.9872 4.1011 4.1011 4.1902 4.1902 4.3570 4.3570 4.6322 4.6322 4.7567 4.7567 4.8090 4.8090 4.8916 4.8916 4.9355 4.9355 5.1446 5.1446 5.2606 5.2606 5.3448 5.3448 5.6964 5.6964 5.7602 5.7602 5.8287 5.8287 5.8899 5.8899 6.0541 6.0541 6.1301 6.1301 6.2726 6.2726 6.3776 6.3776 6.6470 6.6470 6.8602 6.8602 7.0782 7.0782 7.2723 7.2723 7.6176 7.6176 7.8246 7.8246 8.0036 8.0036 8.0766 8.0766 8.2547 8.2547 8.4346 8.4346 8.9965 8.9965 9.1164 9.1164 9.3614 9.3614 9.6321 9.6321 9.7872 9.7872 9.9289 9.9289 11.2490 11.2490 11.5701 11.5701 11.9126 11.9126 12.2014 12.2014 12.3130 12.3130 12.4744 12.4744 12.5523 12.5523 k = 0.0000 0.0000 0.4946 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7009 -4.7009 -2.9905 -2.9905 -2.8469 -2.8469 -2.0138 -2.0138 -1.4191 -1.4191 -0.5813 -0.5813 -0.0294 -0.0294 0.2462 0.2462 0.6961 0.6961 0.8211 0.8211 1.0954 1.0954 1.3347 1.3347 2.1827 2.1827 2.4035 2.4035 2.5081 2.5081 3.9785 3.9785 4.1045 4.1045 4.1973 4.1973 4.3580 4.3580 4.5985 4.5985 4.7396 4.7396 4.7944 4.7944 4.8728 4.8728 4.9520 4.9520 5.1269 5.1269 5.2684 5.2684 5.3656 5.3656 5.6693 5.6693 5.7453 5.7453 5.8138 5.8138 5.9008 5.9008 6.0618 6.0618 6.1306 6.1306 6.2745 6.2745 6.3863 6.3863 6.6343 6.6343 6.9111 6.9111 7.1573 7.1573 7.3235 7.3235 7.5830 7.5830 7.8117 7.8117 7.9703 7.9703 8.1042 8.1042 8.2937 8.2937 8.4463 8.4463 9.0394 9.0394 9.1271 9.1271 9.3492 9.3492 9.6094 9.6094 9.7625 9.7625 9.9286 9.9286 11.1961 11.1961 11.5199 11.5199 11.9177 11.9177 12.2312 12.2312 12.3131 12.3131 12.4546 12.4546 12.5184 12.5184 k = 0.0000 0.0000 0.4711 ( 9804 PWs) bands (ev): -17.8368 -17.8368 -4.7001 -4.7001 -2.9885 -2.9885 -2.8456 -2.8456 -2.0674 -2.0674 -1.3573 -1.3573 -0.5836 -0.5836 -0.0139 -0.0139 0.2488 0.2488 0.6945 0.6945 0.8300 0.8300 1.1027 1.1027 1.3483 1.3483 2.1528 2.1528 2.3835 2.3835 2.4831 2.4831 3.9706 3.9706 4.1012 4.1012 4.2066 4.2066 4.3608 4.3608 4.5661 4.5661 4.7134 4.7134 4.7857 4.7857 4.8477 4.8477 4.9712 4.9712 5.1070 5.1070 5.2697 5.2697 5.3899 5.3899 5.6431 5.6431 5.7336 5.7336 5.8014 5.8014 5.9122 5.9122 6.0698 6.0698 6.1289 6.1289 6.2752 6.2752 6.3969 6.3969 6.6188 6.6188 6.9769 6.9769 7.2391 7.2391 7.3773 7.3773 7.5601 7.5601 7.7920 7.7920 7.9356 7.9356 8.1324 8.1324 8.3371 8.3371 8.4628 8.4628 9.0626 9.0626 9.1567 9.1567 9.3372 9.3372 9.5842 9.5842 9.7321 9.7321 9.9294 9.9294 11.1477 11.1477 11.4613 11.4613 11.9185 11.9185 12.2647 12.2647 12.3092 12.3092 12.4527 12.4527 12.4918 12.4918 k = 0.0000 0.0000 0.4475 ( 9794 PWs) bands (ev): -17.8368 -17.8368 -4.6992 -4.6992 -2.9860 -2.9860 -2.8441 -2.8441 -2.1195 -2.1195 -1.2958 -1.2958 -0.5862 -0.5862 0.0042 0.0042 0.2520 0.2520 0.6927 0.6927 0.8405 0.8405 1.1112 1.1112 1.3644 1.3644 2.1181 2.1181 2.3601 2.3601 2.4538 2.4538 3.9632 3.9632 4.0918 4.0918 4.2161 4.2161 4.3656 4.3656 4.5357 4.5357 4.6805 4.6805 4.7834 4.7834 4.8209 4.8209 4.9855 4.9855 5.0888 5.0888 5.2619 5.2619 5.4169 5.4169 5.6205 5.6205 5.7251 5.7251 5.7934 5.7934 5.9235 5.9235 6.0775 6.0775 6.1265 6.1265 6.2755 6.2755 6.4080 6.4080 6.6025 6.6025 7.0536 7.0536 7.3118 7.3118 7.4274 7.4274 7.5597 7.5597 7.7665 7.7665 7.9099 7.9099 8.1576 8.1576 8.3765 8.3765 8.4880 8.4880 9.0673 9.0673 9.1953 9.1953 9.3313 9.3313 9.5583 9.5583 9.6970 9.6970 9.9325 9.9325 11.1044 11.1044 11.4010 11.4010 11.9106 11.9106 12.2902 12.2902 12.3053 12.3053 12.4579 12.4579 12.4938 12.4938 k = 0.0000 0.0000 0.4240 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.6981 -4.6981 -2.9831 -2.9831 -2.8424 -2.8424 -2.1702 -2.1702 -1.2350 -1.2350 -0.5890 -0.5890 0.0251 0.0251 0.2561 0.2561 0.6907 0.6907 0.8526 0.8526 1.1207 1.1207 1.3829 1.3829 2.0789 2.0789 2.3336 2.3336 2.4205 2.4205 3.9561 3.9561 4.0773 4.0773 4.2237 4.2237 4.3716 4.3716 4.5077 4.5077 4.6444 4.6444 4.7797 4.7797 4.8010 4.8010 4.9858 4.9858 5.0805 5.0805 5.2459 5.2459 5.4449 5.4449 5.6038 5.6038 5.7195 5.7195 5.7902 5.7902 5.9347 5.9347 6.0844 6.0844 6.1247 6.1247 6.2759 6.2759 6.4186 6.4186 6.5870 6.5870 7.1354 7.1354 7.3540 7.3540 7.4783 7.4783 7.5866 7.5866 7.7444 7.7444 7.8979 7.8979 8.1811 8.1811 8.4055 8.4055 8.5247 8.5247 9.0645 9.0645 9.2169 9.2169 9.3422 9.3422 9.5338 9.5338 9.6588 9.6588 9.9393 9.9393 11.0663 11.0663 11.3422 11.3422 11.8957 11.8957 12.2732 12.2732 12.3316 12.3316 12.4519 12.4519 12.5397 12.5397 k = 0.0000 0.0000 0.4004 ( 9800 PWs) bands (ev): -17.8368 -17.8368 -4.6970 -4.6970 -2.9796 -2.9796 -2.8405 -2.8405 -2.2194 -2.2194 -1.1752 -1.1752 -0.5921 -0.5921 0.0486 0.0486 0.2613 0.2613 0.6884 0.6884 0.8664 0.8664 1.1314 1.1314 1.4035 1.4035 2.0356 2.0356 2.3041 2.3041 2.3833 2.3833 3.9491 3.9491 4.0589 4.0589 4.2288 4.2288 4.3767 4.3767 4.4822 4.4822 4.6077 4.6077 4.7580 4.7580 4.8055 4.8055 4.9683 4.9683 5.0839 5.0839 5.2261 5.2261 5.4716 5.4716 5.5943 5.5943 5.7167 5.7167 5.7917 5.7917 5.9458 5.9458 6.0901 6.0901 6.1246 6.1246 6.2769 6.2769 6.4280 6.4280 6.5735 6.5735 7.2116 7.2116 7.3627 7.3627 7.5415 7.5415 7.6127 7.6127 7.7426 7.7426 7.9085 7.9085 8.2037 8.2037 8.4247 8.4247 8.5690 8.5690 9.0586 9.0586 9.2131 9.2131 9.3669 9.3669 9.5146 9.5146 9.6211 9.6211 9.9517 9.9517 11.0332 11.0332 11.2864 11.2864 11.8776 11.8776 12.2437 12.2437 12.3601 12.3601 12.4490 12.4490 12.6028 12.6028 k = 0.0000 0.0000 0.3768 ( 9786 PWs) bands (ev): -17.8369 -17.8369 -4.6958 -4.6958 -2.9757 -2.9757 -2.8385 -2.8385 -2.2670 -2.2670 -1.1167 -1.1167 -0.5952 -0.5952 0.0746 0.0746 0.2679 0.2679 0.6859 0.6859 0.8818 0.8818 1.1432 1.1432 1.4262 1.4262 1.9885 1.9885 2.2721 2.2721 2.3425 2.3425 3.9416 3.9416 4.0376 4.0376 4.2315 4.2315 4.3778 4.3778 4.4593 4.4593 4.5723 4.5723 4.7328 4.7328 4.8187 4.8187 4.9426 4.9426 5.0849 5.0849 5.2124 5.2124 5.4945 5.4945 5.5923 5.5923 5.7170 5.7170 5.7969 5.7969 5.9570 5.9570 6.0941 6.0941 6.1270 6.1270 6.2788 6.2788 6.4357 6.4357 6.5630 6.5630 7.2593 7.2593 7.3694 7.3694 7.5868 7.5868 7.6483 7.6483 7.7506 7.7506 7.9590 7.9590 8.2262 8.2262 8.4384 8.4384 8.6144 8.6144 9.0507 9.0507 9.1960 9.1960 9.3817 9.3817 9.5031 9.5031 9.5922 9.5922 9.9724 9.9724 11.0046 11.0046 11.2341 11.2341 11.8586 11.8586 12.2081 12.2081 12.3857 12.3857 12.4482 12.4482 12.6683 12.6683 k = 0.0000 0.0000 0.3533 ( 9792 PWs) bands (ev): -17.8369 -17.8369 -4.6946 -4.6946 -2.9711 -2.9711 -2.8365 -2.8365 -2.3130 -2.3130 -1.0600 -1.0600 -0.5985 -0.5985 0.1032 0.1032 0.2762 0.2762 0.6829 0.6829 0.8986 0.8986 1.1560 1.1560 1.4506 1.4506 1.9380 1.9380 2.2377 2.2377 2.2986 2.2986 3.9334 3.9334 4.0144 4.0144 4.2320 4.2320 4.3724 4.3724 4.4382 4.4382 4.5405 4.5405 4.7095 4.7095 4.8286 4.8286 4.9214 4.9214 5.0717 5.0717 5.2156 5.2156 5.5116 5.5116 5.5978 5.5978 5.7206 5.7206 5.8047 5.8047 5.9687 5.9687 6.0968 6.0968 6.1317 6.1317 6.2817 6.2817 6.4413 6.4413 6.5561 6.5561 7.2609 7.2609 7.3821 7.3821 7.6144 7.6144 7.7202 7.7202 7.7477 7.7477 8.0479 8.0479 8.2490 8.2490 8.4495 8.4495 8.6567 8.6567 9.0409 9.0409 9.1747 9.1747 9.3759 9.3759 9.4870 9.4870 9.5867 9.5867 10.0040 10.0040 10.9798 10.9798 11.1857 11.1857 11.8392 11.8392 12.1688 12.1688 12.3974 12.3974 12.4526 12.4526 12.7183 12.7183 k = 0.0000 0.0000 0.3297 ( 9786 PWs) bands (ev): -17.8369 -17.8369 -4.6933 -4.6933 -2.9660 -2.9660 -2.8343 -2.8343 -2.3573 -2.3573 -1.0054 -1.0054 -0.6018 -0.6018 0.1341 0.1341 0.2867 0.2867 0.6795 0.6795 0.9170 0.9170 1.1697 1.1697 1.4764 1.4764 1.8844 1.8844 2.2015 2.2015 2.2520 2.2520 3.9241 3.9241 3.9903 3.9903 4.2310 4.2310 4.3600 4.3600 4.4165 4.4165 4.5140 4.5140 4.6888 4.6888 4.8202 4.8202 4.9164 4.9164 5.0519 5.0519 5.2339 5.2339 5.5223 5.5223 5.6094 5.6094 5.7274 5.7274 5.8141 5.8141 5.9810 5.9810 6.0990 6.0990 6.1381 6.1381 6.2860 6.2860 6.4448 6.4448 6.5530 6.5530 7.2378 7.2378 7.3730 7.3730 7.6672 7.6672 7.7242 7.7242 7.8151 7.8151 8.1559 8.1559 8.2733 8.2733 8.4593 8.4593 8.6934 8.6934 9.0287 9.0287 9.1539 9.1539 9.3584 9.3584 9.4599 9.4599 9.6006 9.6006 10.0484 10.0484 10.9581 10.9581 11.1408 11.1408 11.8176 11.8176 12.1267 12.1267 12.3755 12.3755 12.4714 12.4714 12.7250 12.7250 k = 0.0000 0.0000 0.3062 ( 9800 PWs) bands (ev): -17.8369 -17.8369 -4.6919 -4.6919 -2.9602 -2.9602 -2.8322 -2.8322 -2.3999 -2.3999 -0.9535 -0.9535 -0.6050 -0.6050 0.1672 0.1672 0.2998 0.2998 0.6756 0.6756 0.9366 0.9366 1.1839 1.1839 1.5034 1.5034 1.8283 1.8283 2.1638 2.1638 2.2032 2.2032 3.9133 3.9133 3.9660 3.9660 4.2287 4.2287 4.3428 4.3428 4.3922 4.3922 4.4929 4.4929 4.6710 4.6710 4.7947 4.7947 4.9131 4.9131 5.0485 5.0485 5.2599 5.2599 5.5283 5.5283 5.6245 5.6245 5.7371 5.7371 5.8242 5.8242 5.9944 5.9944 6.1013 6.1013 6.1452 6.1452 6.2916 6.2916 6.4466 6.4466 6.5535 6.5535 7.2050 7.2050 7.3457 7.3457 7.6793 7.6793 7.7589 7.7589 7.9081 7.9081 8.2588 8.2588 8.3108 8.3108 8.4697 8.4697 8.7230 8.7230 9.0135 9.0135 9.1366 9.1366 9.3384 9.3384 9.4316 9.4316 9.6168 9.6168 10.1057 10.1057 10.9389 10.9389 11.0991 11.0991 11.7907 11.7907 12.0819 12.0819 12.3197 12.3197 12.4967 12.4967 12.7010 12.7010 k = 0.0000 0.0000 0.2826 ( 9794 PWs) bands (ev): -17.8369 -17.8369 -4.6906 -4.6906 -2.9537 -2.9537 -2.8300 -2.8300 -2.4408 -2.4408 -0.9046 -0.9046 -0.6082 -0.6082 0.2024 0.2024 0.3159 0.3159 0.6714 0.6714 0.9575 0.9575 1.1982 1.1982 1.5312 1.5312 1.7702 1.7702 2.1249 2.1249 2.1530 2.1530 3.9005 3.9005 3.9424 3.9424 4.2253 4.2253 4.3230 4.3230 4.3656 4.3656 4.4747 4.4747 4.6559 4.6559 4.7636 4.7636 4.8913 4.8913 5.0760 5.0760 5.2891 5.2891 5.5319 5.5319 5.6404 5.6404 5.7492 5.7492 5.8341 5.8341 6.0089 6.0089 6.1043 6.1043 6.1526 6.1526 6.2990 6.2990 6.4472 6.4472 6.5567 6.5567 7.1665 7.1665 7.3119 7.3119 7.6428 7.6428 7.8394 7.8394 8.0046 8.0046 8.3029 8.3029 8.4036 8.4036 8.4870 8.4870 8.7439 8.7439 8.9956 8.9956 9.1257 9.1257 9.3205 9.3205 9.4079 9.4079 9.6289 9.6289 10.1740 10.1740 10.9217 10.9217 11.0602 11.0602 11.7543 11.7543 12.0337 12.0337 12.2383 12.2383 12.5220 12.5220 12.6880 12.6880 k = 0.0000 0.0000 0.2591 ( 9796 PWs) bands (ev): -17.8369 -17.8369 -4.6892 -4.6892 -2.9465 -2.9465 -2.8278 -2.8278 -2.4800 -2.4800 -0.8592 -0.8592 -0.6113 -0.6113 0.2393 0.2393 0.3353 0.3353 0.6668 0.6668 0.9795 0.9795 1.2119 1.2119 1.5592 1.5592 1.7106 1.7106 2.0852 2.0852 2.1021 2.1021 3.8858 3.8858 3.9199 3.9199 4.2209 4.2209 4.3020 4.3020 4.3391 4.3391 4.4563 4.4563 4.6432 4.6432 4.7325 4.7325 4.8588 4.8588 5.1237 5.1237 5.3192 5.3192 5.5346 5.5346 5.6556 5.6556 5.7630 5.7630 5.8433 5.8433 6.0248 6.0248 6.1081 6.1081 6.1601 6.1601 6.3081 6.3081 6.4474 6.4474 6.5620 6.5620 7.1240 7.1240 7.2769 7.2769 7.5961 7.5961 7.9222 7.9222 8.1004 8.1004 8.3264 8.3264 8.4642 8.4642 8.5571 8.5571 8.7542 8.7542 8.9776 8.9776 9.1235 9.1235 9.3076 9.3076 9.3910 9.3910 9.6363 9.6363 10.2507 10.2507 10.9059 10.9059 11.0236 11.0236 11.7052 11.7052 11.9802 11.9802 12.1421 12.1421 12.5462 12.5462 12.6878 12.6878 k = 0.0000 0.0000 0.2355 ( 9792 PWs) bands (ev): -17.8370 -17.8370 -4.6879 -4.6879 -2.9384 -2.9384 -2.8257 -2.8257 -2.5174 -2.5174 -0.8177 -0.8177 -0.6143 -0.6143 0.2777 0.2777 0.3584 0.3584 0.6621 0.6621 1.0024 1.0024 1.2242 1.2242 1.5859 1.5859 1.6514 1.6514 2.0445 2.0445 2.0525 2.0525 3.8693 3.8693 3.8987 3.8987 4.2155 4.2155 4.2808 4.2808 4.3140 4.3140 4.4358 4.4358 4.6327 4.6327 4.7039 4.7039 4.8249 4.8249 5.1809 5.1809 5.3490 5.3490 5.5375 5.5375 5.6696 5.6696 5.7778 5.7778 5.8514 5.8514 6.0419 6.0419 6.1128 6.1128 6.1675 6.1675 6.3192 6.3192 6.4477 6.4477 6.5687 6.5687 7.0789 7.0789 7.2424 7.2424 7.5420 7.5420 8.0028 8.0028 8.1912 8.1912 8.3472 8.3472 8.4802 8.4802 8.6712 8.6712 8.7522 8.7522 8.9632 8.9632 9.1323 9.1323 9.3017 9.3017 9.3816 9.3816 9.6407 9.6407 10.3332 10.3332 10.8910 10.8910 10.9889 10.9889 11.6422 11.6422 11.9169 11.9169 12.0424 12.0424 12.5711 12.5711 12.6918 12.6918 k = 0.0000 0.0000 0.2120 ( 9809 PWs) bands (ev): -17.8370 -17.8370 -4.6867 -4.6867 -2.9295 -2.9295 -2.8237 -2.8237 -2.5531 -2.5531 -0.7803 -0.7803 -0.6171 -0.6171 0.3169 0.3169 0.3854 0.3854 0.6574 0.6574 1.0260 1.0260 1.2342 1.2342 1.5808 1.5808 1.6231 1.6231 1.9993 1.9993 2.0088 2.0088 3.8518 3.8518 3.8784 3.8784 4.2093 4.2093 4.2603 4.2603 4.2909 4.2909 4.4129 4.4129 4.6241 4.6241 4.6790 4.6790 4.7936 4.7936 5.2416 5.2416 5.3779 5.3779 5.5419 5.5419 5.6822 5.6822 5.7929 5.7929 5.8584 5.8584 6.0599 6.0599 6.1182 6.1182 6.1749 6.1749 6.3324 6.3324 6.4485 6.4485 6.5762 6.5762 7.0322 7.0322 7.2089 7.2089 7.4818 7.4818 8.0799 8.0799 8.2722 8.2722 8.3673 8.3673 8.4909 8.4909 8.7347 8.7347 8.7855 8.7855 8.9571 8.9571 9.1537 9.1537 9.3056 9.3056 9.3790 9.3790 9.6438 9.6438 10.4191 10.4191 10.8766 10.8766 10.9561 10.9561 11.5672 11.5672 11.8353 11.8353 11.9516 11.9516 12.5976 12.5976 12.6961 12.6961 k = 0.0000 0.0000 0.1884 ( 9813 PWs) bands (ev): -17.8370 -17.8370 -4.6855 -4.6855 -2.9197 -2.9197 -2.8218 -2.8218 -2.5870 -2.5870 -0.7471 -0.7471 -0.6196 -0.6196 0.3565 0.3565 0.4163 0.4163 0.6530 0.6530 1.0499 1.0499 1.2410 1.2410 1.5231 1.5231 1.6467 1.6467 1.9527 1.9527 1.9700 1.9700 3.8344 3.8344 3.8586 3.8586 4.2023 4.2023 4.2413 4.2413 4.2696 4.2696 4.3884 4.3884 4.6172 4.6172 4.6582 4.6582 4.7664 4.7664 5.3014 5.3014 5.4052 5.4052 5.5495 5.5495 5.6932 5.6932 5.8080 5.8080 5.8642 5.8642 6.0782 6.0782 6.1242 6.1242 6.1826 6.1826 6.3478 6.3478 6.4499 6.4499 6.5842 6.5842 6.9849 6.9849 7.1764 7.1764 7.4168 7.4168 8.1523 8.1523 8.3385 8.3385 8.3885 8.3885 8.5008 8.5008 8.7118 8.7118 8.8646 8.8646 8.9788 8.9788 9.1870 9.1870 9.3225 9.3225 9.3829 9.3829 9.6475 9.6475 10.5067 10.5067 10.8621 10.8621 10.9251 10.9251 11.4835 11.4835 11.7331 11.7331 11.8747 11.8747 12.6222 12.6222 12.7016 12.7016 k = 0.0000 0.0000 0.1649 ( 9817 PWs) bands (ev): -17.8370 -17.8370 -4.6844 -4.6844 -2.9089 -2.9089 -2.8201 -2.8201 -2.6192 -2.6192 -0.7184 -0.7184 -0.6220 -0.6220 0.3954 0.3954 0.4508 0.4508 0.6492 0.6492 1.0737 1.0737 1.2437 1.2437 1.4631 1.4631 1.6720 1.6720 1.9093 1.9093 1.9334 1.9334 3.8179 3.8179 3.8393 3.8393 4.1942 4.1942 4.2246 4.2246 4.2497 4.2497 4.3641 4.3641 4.6115 4.6115 4.6413 4.6413 4.7436 4.7436 5.3557 5.3557 5.4301 5.4301 5.5632 5.5632 5.7028 5.7028 5.8225 5.8225 5.8690 5.8690 6.0960 6.0960 6.1305 6.1305 6.1909 6.1909 6.3653 6.3653 6.4521 6.4521 6.5924 6.5924 6.9376 6.9376 7.1448 7.1448 7.3486 7.3486 8.2192 8.2192 8.3835 8.3835 8.4159 8.4159 8.5101 8.5101 8.6831 8.6831 8.8820 8.8820 9.0542 9.0542 9.2267 9.2267 9.3522 9.3522 9.3968 9.3968 9.6536 9.6536 10.5944 10.5944 10.8472 10.8472 10.8962 10.8962 11.3959 11.3959 11.6193 11.6193 11.8051 11.8051 12.6385 12.6385 12.7055 12.7055 k = 0.0000 0.0000 0.1413 ( 9835 PWs) bands (ev): -17.8370 -17.8370 -4.6835 -4.6835 -2.8971 -2.8971 -2.8185 -2.8185 -2.6496 -2.6496 -0.6940 -0.6940 -0.6240 -0.6240 0.4329 0.4329 0.4882 0.4882 0.6462 0.6462 1.0969 1.0969 1.2417 1.2417 1.4044 1.4044 1.6955 1.6955 1.8706 1.8706 1.8994 1.8994 3.8028 3.8028 3.8207 3.8207 4.1847 4.1847 4.2108 4.2108 4.2312 4.2312 4.3417 4.3417 4.6070 4.6070 4.6279 4.6279 4.7250 4.7250 5.3997 5.3997 5.4512 5.4512 5.5867 5.5867 5.7111 5.7111 5.8361 5.8361 5.8729 5.8729 6.1127 6.1127 6.1369 6.1369 6.2006 6.2006 6.3847 6.3847 6.4550 6.4550 6.6007 6.6007 6.8909 6.8909 7.1146 7.1146 7.2793 7.2793 8.2798 8.2798 8.4090 8.4090 8.4486 8.4486 8.5183 8.5183 8.6529 8.6529 8.8729 8.8729 9.1440 9.1440 9.2667 9.2667 9.3766 9.3766 9.4390 9.4390 9.6642 9.6642 10.6806 10.6806 10.8316 10.8316 10.8695 10.8695 11.3089 11.3089 11.5024 11.5024 11.7367 11.7367 12.6439 12.6439 12.7057 12.7057 k = 0.0000 0.0000 0.1178 ( 9847 PWs) bands (ev): -17.8370 -17.8370 -4.6826 -4.6826 -2.8842 -2.8842 -2.8172 -2.8172 -2.6783 -2.6783 -0.6738 -0.6738 -0.6258 -0.6258 0.4679 0.4679 0.5271 0.5271 0.6445 0.6445 1.1189 1.1189 1.2349 1.2349 1.3486 1.3486 1.7158 1.7158 1.8382 1.8382 1.8690 1.8690 3.7895 3.7895 3.8034 3.8034 4.1733 4.1733 4.2002 4.2002 4.2149 4.2149 4.3226 4.3226 4.6035 4.6035 4.6174 4.6174 4.7103 4.7103 5.4316 5.4316 5.4666 5.4666 5.6208 5.6208 5.7180 5.7180 5.8485 5.8485 5.8761 5.8761 6.1272 6.1272 6.1430 6.1430 6.2121 6.2121 6.4054 6.4054 6.4587 6.4587 6.6088 6.6088 6.8452 6.8452 7.0863 7.0863 7.2114 7.2114 8.3334 8.3334 8.4281 8.4281 8.4754 8.4754 8.5247 8.5247 8.6237 8.6237 8.8573 8.8573 9.2258 9.2258 9.3044 9.3044 9.3892 9.3892 9.5090 9.5090 9.6813 9.6813 10.7625 10.7625 10.8163 10.8163 10.8452 10.8452 11.2274 11.2274 11.3881 11.3881 11.6679 11.6679 12.6409 12.6409 12.7016 12.7016 k = 0.0000 0.0000 0.0942 ( 9855 PWs) bands (ev): -17.8370 -17.8370 -4.6819 -4.6819 -2.8703 -2.8703 -2.8160 -2.8160 -2.7052 -2.7052 -0.6576 -0.6576 -0.6273 -0.6273 0.4991 0.4991 0.5656 0.5656 0.6447 0.6447 1.1387 1.1387 1.2241 1.2241 1.2975 1.2975 1.7310 1.7310 1.8134 1.8134 1.8432 1.8432 3.7783 3.7783 3.7880 3.7880 4.1604 4.1604 4.1924 4.1924 4.2015 4.2015 4.3076 4.3076 4.6007 4.6007 4.6094 4.6094 4.6990 4.6990 5.4538 5.4538 5.4762 5.4762 5.6602 5.6602 5.7240 5.7240 5.8596 5.8596 5.8788 5.8788 6.1390 6.1390 6.1485 6.1485 6.2257 6.2257 6.4266 6.4266 6.4631 6.4631 6.6165 6.6165 6.8013 6.8013 7.0609 7.0609 7.1478 7.1478 8.3794 8.3794 8.4457 8.4457 8.4945 8.4945 8.5286 8.5286 8.5969 8.5969 8.8402 8.8402 9.2931 9.2931 9.3393 9.3393 9.3986 9.3986 9.5882 9.5882 9.7055 9.7055 10.7949 10.7949 10.8208 10.8208 10.8475 10.8475 11.1557 11.1557 11.2813 11.2813 11.5991 11.5991 12.6328 12.6328 12.6949 12.6949 k = 0.0000 0.0000 0.0707 ( 9859 PWs) bands (ev): -17.8370 -17.8370 -4.6813 -4.6813 -2.8553 -2.8553 -2.8151 -2.8151 -2.7303 -2.7303 -0.6454 -0.6454 -0.6284 -0.6284 0.5245 0.5245 0.6011 0.6011 0.6472 0.6472 1.1550 1.1550 1.2104 1.2104 1.2537 1.2537 1.7385 1.7385 1.7988 1.7988 1.8227 1.8227 3.7694 3.7694 3.7752 3.7752 4.1477 4.1477 4.1868 4.1868 4.1917 4.1917 4.2965 4.2965 4.5987 4.5987 4.6034 4.6034 4.6906 4.6906 5.4691 5.4691 5.4819 5.4819 5.6965 5.6965 5.7300 5.7300 5.8692 5.8692 5.8809 5.8809 6.1479 6.1479 6.1530 6.1530 6.2406 6.2406 6.4468 6.4468 6.4683 6.4683 6.6238 6.6238 6.7603 6.7603 7.0393 7.0393 7.0919 7.0919 8.4176 8.4176 8.4623 8.4623 8.5064 8.5064 8.5304 8.5304 8.5733 8.5733 8.8240 8.8240 9.3433 9.3433 9.3699 9.3699 9.4065 9.4065 9.6652 9.6652 9.7346 9.7346 10.7815 10.7815 10.7994 10.7994 10.9161 10.9161 11.0972 11.0972 11.1893 11.1893 11.5326 11.5326 12.6217 12.6217 12.6875 12.6875 k = 0.0000 0.0000 0.0471 ( 9863 PWs) bands (ev): -17.8370 -17.8370 -4.6809 -4.6809 -2.8394 -2.8394 -2.8145 -2.8145 -2.7535 -2.7535 -0.6367 -0.6367 -0.6293 -0.6293 0.5427 0.5427 0.6306 0.6306 0.6515 0.6515 1.1665 1.1665 1.1949 1.1949 1.2224 1.2224 1.7373 1.7373 1.7947 1.7947 1.8081 1.8081 3.7629 3.7629 3.7656 3.7656 4.1370 4.1370 4.1829 4.1829 4.1850 4.1850 4.2889 4.2889 4.5973 4.5973 4.5993 4.5993 4.6849 4.6849 5.4793 5.4793 5.4850 5.4850 5.7196 5.7196 5.7403 5.7403 5.8769 5.8769 5.8826 5.8826 6.1541 6.1541 6.1563 6.1563 6.2548 6.2548 6.4640 6.4640 6.4737 6.4737 6.6302 6.6302 6.7249 6.7249 7.0227 7.0227 7.0475 7.0475 8.4482 8.4482 8.4778 8.4778 8.5104 8.5104 8.5316 8.5316 8.5539 8.5539 8.8106 8.8106 9.3750 9.3750 9.3953 9.3953 9.4132 9.4132 9.7307 9.7307 9.7631 9.7631 10.7701 10.7701 10.7797 10.7797 10.9715 10.9715 11.0517 11.0517 11.1245 11.1245 11.4725 11.4725 12.6096 12.6096 12.6811 12.6903 k = 0.0000 0.0000 0.0236 ( 9873 PWs) bands (ev): -17.8370 -17.8370 -4.6806 -4.6806 -2.8235 -2.8235 -2.8141 -2.8141 -2.7737 -2.7737 -0.6317 -0.6317 -0.6298 -0.6298 0.5532 0.5532 0.6505 0.6505 0.6558 0.6558 1.1718 1.1718 1.1794 1.1794 1.2080 1.2080 1.7331 1.7331 1.7957 1.7957 1.7994 1.7994 3.7590 3.7590 3.7597 3.7597 4.1300 4.1300 4.1807 4.1807 4.1811 4.1811 4.2846 4.2846 4.5964 4.5964 4.5969 4.5969 4.6817 4.6817 5.4852 5.4852 5.4866 5.4866 5.7265 5.7265 5.7542 5.7542 5.8821 5.8821 5.8836 5.8836 6.1578 6.1578 6.1583 6.1583 6.2653 6.2653 6.4759 6.4759 6.4783 6.4783 6.6350 6.6350 6.6993 6.6993 7.0123 7.0123 7.0187 7.0187 8.4719 8.4719 8.4906 8.4906 8.5053 8.5053 8.5334 8.5334 8.5399 8.5399 8.8018 8.8018 9.3900 9.3900 9.4136 9.4136 9.4183 9.4183 9.7755 9.7755 9.7839 9.7839 10.7627 10.7627 10.7654 10.7654 10.9995 10.9995 11.0178 11.0178 11.1021 11.1021 11.4271 11.4271 12.5996 12.5996 12.6790 12.6805 k = 0.0000 0.0000 0.0000 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6805 -4.6805 -2.8139 -2.8139 -2.8139 -2.8139 -2.7848 -2.7848 -0.6300 -0.6300 -0.6299 -0.6299 0.5565 0.5565 0.6576 0.6576 0.6577 0.6577 1.1727 1.1727 1.1728 1.1728 1.2048 1.2048 1.7311 1.7311 1.7965 1.7965 1.7966 1.7966 3.7576 3.7576 3.7576 3.7576 4.1276 4.1276 4.1799 4.1799 4.1799 4.1799 4.2831 4.2831 4.5961 4.5961 4.5962 4.5962 4.6806 4.6806 5.4871 5.4871 5.4871 5.4871 5.7279 5.7279 5.7599 5.7599 5.8840 5.8840 5.8840 5.8840 6.1590 6.1590 6.1590 6.1590 6.2692 6.2692 6.4802 6.4802 6.4803 6.4803 6.6371 6.6371 6.6896 6.6896 7.0087 7.0087 7.0087 7.0087 8.4862 8.4862 8.4963 8.4963 8.4963 8.4963 8.5343 8.5343 8.5343 8.5343 8.7987 8.7987 9.3942 9.3942 9.4202 9.4202 9.4202 9.4202 9.7915 9.7915 9.7915 9.7915 10.7601 10.7601 10.7602 10.7602 11.0041 11.0041 11.0042 11.0042 11.1035 11.1035 11.4092 11.4092 12.5956 12.5956 12.6752 12.6753 k = 0.0000 0.0000 0.0000 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6805 -4.6805 -2.8139 -2.8139 -2.8139 -2.8139 -2.7848 -2.7848 -0.6300 -0.6300 -0.6299 -0.6299 0.5565 0.5565 0.6576 0.6576 0.6577 0.6577 1.1727 1.1727 1.1728 1.1728 1.2048 1.2048 1.7311 1.7311 1.7965 1.7965 1.7966 1.7966 3.7576 3.7576 3.7576 3.7576 4.1276 4.1276 4.1799 4.1799 4.1799 4.1799 4.2831 4.2831 4.5961 4.5961 4.5962 4.5962 4.6806 4.6806 5.4871 5.4871 5.4871 5.4871 5.7279 5.7279 5.7599 5.7599 5.8840 5.8840 5.8840 5.8840 6.1590 6.1590 6.1590 6.1590 6.2692 6.2692 6.4802 6.4802 6.4803 6.4803 6.6371 6.6371 6.6896 6.6896 7.0087 7.0087 7.0087 7.0087 8.4862 8.4862 8.4963 8.4963 8.4963 8.4963 8.5343 8.5343 8.5343 8.5343 8.7987 8.7987 9.3942 9.3942 9.4202 9.4202 9.4202 9.4202 9.7915 9.7915 9.7915 9.7915 10.7601 10.7601 10.7602 10.7602 11.0041 11.0041 11.0042 11.0042 11.1035 11.1035 11.4092 11.4092 12.5956 12.5956 12.6752 12.6753 k = 0.0078 0.0110 0.0191 ( 9873 PWs) bands (ev): -17.8370 -17.8370 -4.6806 -4.6806 -2.8235 -2.8235 -2.8141 -2.8141 -2.7738 -2.7738 -0.6308 -0.6308 -0.6306 -0.6306 0.5532 0.5532 0.6511 0.6511 0.6553 0.6553 1.1718 1.1718 1.1795 1.1795 1.2078 1.2078 1.7332 1.7332 1.7975 1.7975 1.7975 1.7975 3.7592 3.7592 3.7594 3.7594 4.1300 4.1300 4.1808 4.1808 4.1810 4.1810 4.2846 4.2846 4.5966 4.5966 4.5967 4.5967 4.6816 4.6816 5.4856 5.4856 5.4863 5.4863 5.7265 5.7265 5.7543 5.7543 5.8823 5.8823 5.8835 5.8835 6.1578 6.1578 6.1582 6.1582 6.2653 6.2653 6.4770 6.4770 6.4773 6.4773 6.6351 6.6351 6.6993 6.6993 7.0122 7.0122 7.0187 7.0187 8.4725 8.4725 8.4895 8.4895 8.5057 8.5057 8.5344 8.5344 8.5389 8.5389 8.8018 8.8018 9.3902 9.3902 9.4139 9.4139 9.4179 9.4179 9.7777 9.7777 9.7819 9.7819 10.7640 10.7640 10.7640 10.7640 10.9975 10.9975 11.0195 11.0195 11.1026 11.1026 11.4267 11.4267 12.5995 12.5995 12.6800 12.6810 k = 0.0156 0.0221 0.0383 ( 9876 PWs) bands (ev): -17.8370 -17.8370 -4.6809 -4.6809 -2.8393 -2.8393 -2.8144 -2.8144 -2.7537 -2.7537 -0.6334 -0.6334 -0.6326 -0.6326 0.5433 0.5433 0.6326 0.6326 0.6494 0.6494 1.1661 1.1661 1.1983 1.1983 1.2187 1.2187 1.7394 1.7394 1.8003 1.8003 1.8006 1.8006 3.7639 3.7639 3.7645 3.7645 4.1369 4.1369 4.1835 4.1835 4.1843 4.1843 4.2889 4.2889 4.5980 4.5980 4.5985 4.5985 4.6849 4.6849 5.4809 5.4809 5.4838 5.4838 5.7197 5.7197 5.7405 5.7405 5.8776 5.8776 5.8818 5.8818 6.1544 6.1544 6.1561 6.1561 6.2547 6.2547 6.4685 6.4685 6.4687 6.4687 6.6303 6.6303 6.7252 6.7252 7.0224 7.0224 7.0475 7.0475 8.4517 8.4517 8.4732 8.4732 8.5095 8.5095 8.5395 8.5395 8.5483 8.5483 8.8103 8.8103 9.3766 9.3766 9.3965 9.3965 9.4107 9.4107 9.7394 9.7394 9.7559 9.7559 10.7746 10.7746 10.7747 10.7747 10.9615 10.9615 11.0636 11.0636 11.1245 11.1245 11.4696 11.4696 12.6097 12.6097 12.6818 12.6963 k = 0.0234 0.0331 0.0574 ( 9852 PWs) bands (ev): -17.8370 -17.8370 -4.6813 -4.6813 -2.8551 -2.8551 -2.8151 -2.8151 -2.7307 -2.7307 -0.6379 -0.6379 -0.6360 -0.6360 0.5267 0.5267 0.6055 0.6055 0.6419 0.6419 1.1531 1.1531 1.2257 1.2257 1.2377 1.2377 1.7500 1.7500 1.8053 1.8053 1.8062 1.8062 3.7714 3.7714 3.7729 3.7729 4.1473 4.1473 4.1884 4.1884 4.1901 4.1901 4.2965 4.2965 4.6004 4.6004 4.6016 4.6016 4.6904 4.6904 5.4728 5.4728 5.4797 5.4797 5.6966 5.6966 5.7303 5.7303 5.8706 5.8706 5.8791 5.8791 6.1486 6.1486 6.1526 6.1526 6.2398 6.2398 6.4556 6.4556 6.4572 6.4572 6.6242 6.6242 6.7621 6.7621 7.0382 7.0382 7.0925 7.0925 8.4267 8.4267 8.4507 8.4507 8.5031 8.5031 8.5516 8.5516 8.5588 8.5588 8.8226 8.8226 9.3474 9.3474 9.3747 9.3747 9.3981 9.3981 9.6843 9.6843 9.7196 9.7196 10.7898 10.7898 10.7904 10.7904 10.8980 10.8980 11.1313 11.1313 11.1794 11.1794 11.5235 11.5235 12.6226 12.6226 12.6892 12.6892 k = 0.0312 0.0442 0.0765 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6819 -4.6819 -2.8701 -2.8701 -2.8160 -2.8160 -2.7057 -2.7057 -0.6444 -0.6444 -0.6410 -0.6410 0.5045 0.5045 0.5730 0.5730 0.6343 0.6343 1.1338 1.1338 1.2578 1.2578 1.2614 1.2614 1.7649 1.7649 1.8130 1.8130 1.8149 1.8149 3.7814 3.7814 3.7843 3.7843 4.1595 4.1595 4.1959 4.1959 4.1984 4.1984 4.3077 4.3077 4.6037 4.6037 4.6061 4.6061 4.6985 4.6985 5.4609 5.4609 5.4739 5.4739 5.6586 5.6586 5.7245 5.7245 5.8620 5.8620 5.8752 5.8752 6.1404 6.1404 6.1476 6.1476 6.2232 6.2232 6.4391 6.4391 6.4451 6.4451 6.6174 6.6174 6.8057 6.8057 7.0585 7.0585 7.1502 7.1502 8.3964 8.3964 8.4221 8.4221 8.4927 8.4927 8.5660 8.5660 8.5697 8.5697 8.8366 8.8366 9.3015 9.3015 9.3514 9.3514 9.3784 9.3784 9.6222 9.6222 9.6796 9.6796 10.8048 10.8048 10.8101 10.8101 10.8256 10.8256 11.2163 11.2163 11.2553 11.2553 11.5804 11.5804 12.6359 12.6359 12.6983 12.6983 k = 0.0391 0.0552 0.0957 ( 9855 PWs) bands (ev): -17.8370 -17.8370 -4.6826 -4.6826 -2.8840 -2.8840 -2.8172 -2.8172 -2.6789 -2.6789 -0.6531 -0.6531 -0.6478 -0.6478 0.4786 0.4786 0.5383 0.5383 0.6273 0.6273 1.1090 1.1090 1.2862 1.2862 1.2910 1.2910 1.7842 1.7842 1.8240 1.8240 1.8276 1.8276 3.7935 3.7935 3.7983 3.7983 4.1718 4.1718 4.2064 4.2064 4.2096 4.2096 4.3231 4.3231 4.6081 4.6081 4.6122 4.6122 4.7094 4.7094 5.4444 5.4444 5.4665 5.4665 5.6133 5.6133 5.7189 5.7189 5.8523 5.8523 5.8702 5.8702 6.1299 6.1299 6.1410 6.1410 6.2068 6.2068 6.4208 6.4208 6.4337 6.4337 6.6102 6.6102 6.8530 6.8530 7.0818 7.0818 7.2178 7.2178 8.3589 8.3589 8.3862 8.3862 8.4815 8.4815 8.5809 8.5809 8.5810 8.5810 8.8497 8.8497 9.2443 9.2443 9.3255 9.3255 9.3490 9.3490 9.5632 9.5632 9.6406 9.6406 10.7418 10.7418 10.8298 10.8298 10.8329 10.8329 11.3125 11.3125 11.3438 11.3438 11.6366 11.6366 12.6483 12.6483 12.7075 12.7075 k = 0.0469 0.0663 0.1148 ( 9849 PWs) bands (ev): -17.8370 -17.8370 -4.6834 -4.6834 -2.8968 -2.8968 -2.8186 -2.8186 -2.6503 -2.6503 -0.6644 -0.6644 -0.6567 -0.6567 0.4513 0.4513 0.5036 0.5036 0.6205 0.6205 1.0796 1.0796 1.3094 1.3094 1.3222 1.3222 1.8074 1.8074 1.8393 1.8393 1.8451 1.8451 3.8069 3.8069 3.8143 3.8143 4.1833 4.1833 4.2195 4.2195 4.2240 4.2240 4.3426 4.3426 4.6137 4.6137 4.6201 4.6201 4.7236 4.7236 5.4220 5.4220 5.4576 5.4576 5.5656 5.5656 5.7125 5.7125 5.8416 5.8416 5.8639 5.8639 6.1171 6.1171 6.1321 6.1321 6.1919 6.1919 6.4019 6.4019 6.4238 6.4238 6.6027 6.6027 6.9020 6.9020 7.1070 7.1070 7.2922 7.2922 8.3128 8.3128 8.3420 8.3420 8.4712 8.4712 8.5929 8.5929 8.5956 8.5956 8.8595 8.8595 9.1809 9.1809 9.2975 9.2975 9.3077 9.3077 9.5157 9.5157 9.6049 9.6049 10.6645 10.6645 10.8506 10.8506 10.8580 10.8580 11.4154 11.4154 11.4385 11.4385 11.6905 11.6905 12.6591 12.6591 12.7144 12.7144 k = 0.0547 0.0773 0.1340 ( 9837 PWs) bands (ev): -17.8370 -17.8370 -4.6844 -4.6844 -2.9086 -2.9086 -2.8203 -2.8203 -2.6199 -2.6199 -0.6784 -0.6784 -0.6678 -0.6678 0.4246 0.4246 0.4708 0.4708 0.6132 0.6132 1.0465 1.0465 1.3294 1.3294 1.3492 1.3492 1.8326 1.8326 1.8608 1.8608 1.8682 1.8682 3.8212 3.8212 3.8317 3.8317 4.1942 4.1942 4.2340 4.2340 4.2419 4.2419 4.3656 4.3656 4.6204 4.6204 4.6302 4.6302 4.7416 4.7416 5.3917 5.3917 5.4472 5.4472 5.5199 5.5199 5.7053 5.7053 5.8303 5.8303 5.8563 5.8563 6.1021 6.1021 6.1206 6.1206 6.1795 6.1795 6.3833 6.3833 6.4159 6.4159 6.5948 6.5948 6.9516 6.9516 7.1331 7.1331 7.3713 7.3713 8.2565 8.2565 8.2883 8.2883 8.4627 8.4627 8.6057 8.6057 8.6095 8.6095 8.8635 8.8635 9.1158 9.1158 9.2564 9.2564 9.2695 9.2695 9.4824 9.4824 9.5732 9.5732 10.5914 10.5914 10.8718 10.8718 10.8846 10.8846 11.5214 11.5214 11.5342 11.5342 11.7414 11.7414 12.6672 12.6672 12.7166 12.7166 k = 0.0625 0.0884 0.1531 ( 9861 PWs) bands (ev): -17.8370 -17.8370 -4.6855 -4.6855 -2.9193 -2.9193 -2.8223 -2.8223 -2.5877 -2.5877 -0.6953 -0.6953 -0.6815 -0.6815 0.4001 0.4001 0.4411 0.4411 0.6050 0.6050 1.0107 1.0107 1.3450 1.3450 1.3708 1.3708 1.8575 1.8575 1.8905 1.8905 1.8970 1.8970 3.8355 3.8355 3.8500 3.8500 4.2053 4.2053 4.2488 4.2488 4.2635 4.2635 4.3907 4.3907 4.6284 4.6284 4.6429 4.6429 4.7639 4.7639 5.3524 5.3524 5.4353 5.4353 5.4799 5.4799 5.6973 5.6973 5.8186 5.8186 5.8474 5.8474 6.0851 6.0851 6.1067 6.1067 6.1695 6.1695 6.3657 6.3657 6.4100 6.4100 6.5864 6.5864 7.0010 7.0010 7.1592 7.1592 7.4527 7.4527 8.1894 8.1894 8.2249 8.2249 8.4567 8.4567 8.6193 8.6193 8.6218 8.6218 8.8588 8.8588 9.0532 9.0532 9.2011 9.2011 9.2438 9.2438 9.4603 9.4603 9.5457 9.5457 10.5252 10.5252 10.8926 10.8926 10.9120 10.9120 11.6248 11.6248 11.6280 11.6280 11.7900 11.7900 12.6724 12.6724 12.7124 12.7124 k = 0.0703 0.0994 0.1722 ( 9813 PWs) bands (ev): -17.8370 -17.8370 -4.6866 -4.6866 -2.9290 -2.9290 -2.8246 -2.8246 -2.5538 -2.5538 -0.7154 -0.7154 -0.6978 -0.6978 0.3790 0.3790 0.4154 0.4154 0.5952 0.5952 0.9732 0.9732 1.3560 1.3560 1.3862 1.3862 1.8822 1.8822 1.9275 1.9275 1.9312 1.9312 3.8494 3.8494 3.8683 3.8683 4.2168 4.2168 4.2637 4.2637 4.2888 4.2888 4.4159 4.4159 4.6379 4.6379 4.6588 4.6588 4.7909 4.7909 5.3057 5.3057 5.4220 5.4220 5.4462 5.4462 5.6884 5.6884 5.8067 5.8067 5.8371 5.8371 6.0667 6.0667 6.0911 6.0911 6.1614 6.1614 6.3498 6.3498 6.4062 6.4062 6.5777 6.5777 7.0497 7.0497 7.1847 7.1847 7.5345 7.5345 8.1118 8.1118 8.1520 8.1520 8.4534 8.4534 8.6310 8.6310 8.6336 8.6336 8.8419 8.8419 8.9982 8.9982 9.1475 9.1475 9.2218 9.2218 9.4460 9.4460 9.5222 9.5222 10.4678 10.4678 10.9122 10.9122 10.9393 10.9393 11.7013 11.7013 11.7330 11.7330 11.8409 11.8409 12.6759 12.6759 12.7024 12.7024 k = 0.0781 0.1105 0.1914 ( 9813 PWs) bands (ev): -17.8370 -17.8370 -4.6879 -4.6879 -2.9377 -2.9377 -2.8272 -2.8272 -2.5180 -2.5180 -0.7386 -0.7386 -0.7170 -0.7170 0.3620 0.3620 0.3945 0.3945 0.5828 0.5828 0.9353 0.9353 1.3628 1.3628 1.3958 1.3958 1.9081 1.9081 1.9691 1.9691 1.9701 1.9701 3.8622 3.8622 3.8860 3.8860 4.2289 4.2289 4.2786 4.2786 4.3179 4.3179 4.4394 4.4394 4.6491 4.6491 4.6783 4.6783 4.8228 4.8228 5.2556 5.2556 5.4075 5.4075 5.4171 5.4171 5.6790 5.6790 5.7948 5.7948 5.8254 5.8254 6.0472 6.0472 6.0746 6.0746 6.1544 6.1544 6.3356 6.3356 6.4045 6.4045 6.5684 6.5684 7.0973 7.0973 7.2090 7.2090 7.6149 7.6149 8.0249 8.0249 8.0708 8.0708 8.4527 8.4527 8.6343 8.6343 8.6483 8.6483 8.8096 8.8096 8.9579 8.9579 9.0987 9.0987 9.2035 9.2035 9.4368 9.4368 9.5026 9.5026 10.4208 10.4208 10.9304 10.9304 10.9660 10.9660 11.7517 11.7517 11.8344 11.8344 11.9014 11.9014 12.6799 12.6799 12.6896 12.6896 k = 0.0859 0.1215 0.2105 ( 9813 PWs) bands (ev): -17.8369 -17.8369 -4.6892 -4.6892 -2.9455 -2.9455 -2.8300 -2.8300 -2.4804 -2.4804 -0.7648 -0.7648 -0.7390 -0.7390 0.3498 0.3498 0.3787 0.3787 0.5670 0.5670 0.8983 0.8983 1.3657 1.3657 1.4002 1.4002 1.9356 1.9356 2.0124 2.0124 2.0136 2.0136 3.8738 3.8738 3.9024 3.9024 4.2413 4.2413 4.2934 4.2934 4.3501 4.3501 4.4597 4.4597 4.6623 4.6623 4.7017 4.7017 4.8589 4.8589 5.2060 5.2060 5.3908 5.3908 5.3916 5.3916 5.6691 5.6691 5.7829 5.7829 5.8122 5.8122 6.0272 6.0272 6.0578 6.0578 6.1479 6.1479 6.3233 6.3233 6.4047 6.4047 6.5587 6.5587 7.1436 7.1436 7.2316 7.2316 7.6917 7.6917 7.9308 7.9308 7.9833 7.9833 8.4535 8.4535 8.6269 8.6269 8.6626 8.6626 8.7669 8.7669 8.9352 8.9352 9.0562 9.0562 9.1876 9.1876 9.4314 9.4314 9.4865 9.4865 10.3853 10.3853 10.9470 10.9470 10.9918 10.9918 11.7738 11.7738 11.9304 11.9304 11.9708 11.9708 12.6779 12.6779 12.6864 12.6864 k = 0.0938 0.1326 0.2296 ( 9801 PWs) bands (ev): -17.8369 -17.8369 -4.6905 -4.6905 -2.9523 -2.9523 -2.8332 -2.8332 -2.4410 -2.4410 -0.7941 -0.7941 -0.7638 -0.7638 0.3424 0.3424 0.3683 0.3683 0.5468 0.5468 0.8639 0.8639 1.3655 1.3655 1.4003 1.4003 1.9648 1.9648 2.0568 2.0568 2.0595 2.0595 3.8839 3.8839 3.9171 3.9171 4.2533 4.2533 4.3084 4.3084 4.3847 4.3847 4.4763 4.4763 4.6777 4.6777 4.7289 4.7289 4.8977 4.8977 5.1602 5.1602 5.3671 5.3671 5.3747 5.3747 5.6590 5.6590 5.7711 5.7711 5.7978 5.7978 6.0074 6.0074 6.0412 6.0412 6.1416 6.1416 6.3129 6.3129 6.4068 6.4068 6.5486 6.5486 7.1883 7.1883 7.2518 7.2518 7.7622 7.7622 7.8328 7.8328 7.8921 7.8921 8.4507 8.4507 8.6032 8.6032 8.6757 8.6757 8.7304 8.7304 8.9260 8.9260 9.0205 9.0205 9.1726 9.1726 9.4288 9.4288 9.4734 9.4734 10.3617 10.3617 10.9621 10.9621 11.0162 11.0162 11.7748 11.7748 12.0183 12.0183 12.0403 12.0403 12.6717 12.6717 12.6968 12.6968 k = 0.1016 0.1436 0.2488 ( 9789 PWs) bands (ev): -17.8369 -17.8369 -4.6918 -4.6918 -2.9583 -2.9583 -2.8367 -2.8367 -2.3998 -2.3998 -0.8259 -0.8259 -0.7910 -0.7910 0.3399 0.3399 0.3631 0.3631 0.5213 0.5213 0.8332 0.8332 1.3628 1.3628 1.3969 1.3969 1.9956 1.9956 2.1022 2.1022 2.1057 2.1057 3.8924 3.8924 3.9297 3.9297 4.2641 4.2641 4.3235 4.3235 4.4207 4.4207 4.4894 4.4894 4.6957 4.6957 4.7592 4.7592 4.9363 4.9363 5.1216 5.1216 5.3465 5.3465 5.3567 5.3567 5.6489 5.6489 5.7593 5.7593 5.7824 5.7824 5.9882 5.9882 6.0250 6.0250 6.1353 6.1353 6.3043 6.3043 6.4105 6.4105 6.5381 6.5381 7.2307 7.2307 7.2687 7.2687 7.7293 7.7293 7.8002 7.8002 7.8288 7.8288 8.4291 8.4291 8.5759 8.5759 8.6865 8.6865 8.7091 8.7091 8.9258 8.9258 8.9917 8.9917 9.1572 9.1572 9.4284 9.4284 9.4627 9.4627 10.3498 10.3498 10.9762 10.9762 11.0396 11.0396 11.7617 11.7617 12.0952 12.0952 12.1033 12.1033 12.6756 12.6756 12.7131 12.7131 k = 0.1094 0.1547 0.2679 ( 9801 PWs) bands (ev): -17.8369 -17.8369 -4.6931 -4.6931 -2.9634 -2.9634 -2.8404 -2.8404 -2.3569 -2.3569 -0.8600 -0.8600 -0.8204 -0.8204 0.3422 0.3422 0.3631 0.3631 0.4901 0.4901 0.8072 0.8072 1.3581 1.3581 1.3908 1.3908 2.0275 2.0275 2.1474 2.1474 2.1513 2.1513 3.8996 3.8996 3.9400 3.9400 4.2723 4.2723 4.3390 4.3390 4.4568 4.4568 4.4996 4.4996 4.7167 4.7167 4.7914 4.7914 4.9694 4.9694 5.0949 5.0949 5.3307 5.3307 5.3378 5.3378 5.6391 5.6391 5.7476 5.7476 5.7664 5.7664 5.9700 5.9700 6.0098 6.0098 6.1287 6.1287 6.2974 6.2974 6.4159 6.4159 6.5271 6.5271 7.2696 7.2696 7.2802 7.2802 7.6304 7.6304 7.7117 7.7117 7.8822 7.8822 8.3744 8.3744 8.5703 8.5703 8.6936 8.6936 8.6970 8.6970 8.9316 8.9316 8.9697 8.9697 9.1412 9.1412 9.4296 9.4296 9.4535 9.4535 10.3490 10.3490 10.9903 10.9903 11.0623 11.0623 11.7395 11.7395 12.1569 12.1569 12.1582 12.1582 12.6933 12.6933 12.7369 12.7369 k = 0.1172 0.1657 0.2870 ( 9804 PWs) bands (ev): -17.8369 -17.8369 -4.6945 -4.6945 -2.9677 -2.9677 -2.8445 -2.8445 -2.3122 -2.3122 -0.8960 -0.8960 -0.8517 -0.8517 0.3489 0.3489 0.3680 0.3680 0.4536 0.4536 0.7861 0.7861 1.3520 1.3520 1.3826 1.3826 2.0603 2.0603 2.1916 2.1916 2.1954 2.1954 3.9055 3.9055 3.9482 3.9482 4.2764 4.2764 4.3553 4.3553 4.4917 4.4917 4.5079 4.5079 4.7407 4.7407 4.8231 4.8231 4.9903 4.9903 5.0856 5.0856 5.3181 5.3181 5.3223 5.3223 5.6299 5.6299 5.7359 5.7359 5.7503 5.7503 5.9531 5.9531 5.9958 5.9958 6.1218 6.1218 6.2920 6.2920 6.4227 6.4227 6.5159 6.5159 7.2819 7.2819 7.3007 7.3007 7.5387 7.5387 7.6331 7.6331 7.9226 7.9226 8.3004 8.3004 8.5820 8.5820 8.6898 8.6898 8.6961 8.6961 8.9412 8.9412 8.9542 8.9542 9.1250 9.1250 9.4317 9.4317 9.4453 9.4453 10.3578 10.3578 11.0055 11.0055 11.0850 11.0850 11.7124 11.7124 12.2000 12.2000 12.2052 12.2052 12.7271 12.7271 12.7661 12.7661 k = 0.1250 0.1768 0.3062 ( 9807 PWs) bands (ev): -17.8369 -17.8369 -4.6957 -4.6957 -2.9711 -2.9711 -2.8488 -2.8488 -2.2658 -2.2658 -0.9333 -0.9333 -0.8843 -0.8843 0.3593 0.3593 0.3774 0.3774 0.4127 0.4127 0.7694 0.7694 1.3447 1.3447 1.3729 1.3729 2.0937 2.0937 2.2340 2.2340 2.2375 2.2375 3.9104 3.9104 3.9543 3.9543 4.2752 4.2752 4.3726 4.3726 4.5153 4.5153 4.5243 4.5243 4.7675 4.7675 4.8500 4.8500 5.0009 5.0009 5.0911 5.0911 5.2979 5.2979 5.3246 5.3246 5.6216 5.6216 5.7242 5.7242 5.7348 5.7348 5.9377 5.9377 5.9838 5.9838 6.1142 6.1142 6.2882 6.2882 6.4308 6.4308 6.5044 6.5044 7.2665 7.2665 7.3076 7.3076 7.4728 7.4728 7.5735 7.5735 7.9418 7.9418 8.2286 8.2286 8.5963 8.5963 8.6888 8.6888 8.6936 8.6936 8.9444 8.9444 8.9527 8.9527 9.1099 9.1099 9.4342 9.4342 9.4377 9.4377 10.3747 10.3747 11.0231 11.0231 11.1087 11.1087 11.6841 11.6841 12.2331 12.2331 12.2370 12.2370 12.7760 12.7760 12.7792 12.7792 k = 0.1328 0.1878 0.3253 ( 9804 PWs) bands (ev): -17.8368 -17.8368 -4.6969 -4.6969 -2.9738 -2.9738 -2.8534 -2.8534 -2.2178 -2.2178 -0.9716 -0.9716 -0.9181 -0.9181 0.3618 0.3618 0.3798 0.3798 0.3908 0.3908 0.7564 0.7564 1.3366 1.3366 1.3620 1.3620 2.1274 2.1274 2.2740 2.2740 2.2771 2.2771 3.9143 3.9143 3.9584 3.9584 4.2681 4.2681 4.3910 4.3910 4.5228 4.5228 4.5538 4.5538 4.7961 4.7961 4.8676 4.8676 5.0146 5.0146 5.0987 5.0987 5.2777 5.2777 5.3388 5.3388 5.6147 5.6147 5.7126 5.7126 5.7207 5.7207 5.9241 5.9241 5.9744 5.9744 6.1060 6.1060 6.2857 6.2857 6.4399 6.4399 6.4929 6.4929 7.2273 7.2273 7.2629 7.2629 7.4612 7.4612 7.5412 7.5412 7.9258 7.9258 8.1806 8.1806 8.6029 8.6029 8.6865 8.6865 8.6970 8.6970 8.9388 8.9388 8.9639 8.9639 9.0980 9.0980 9.4302 9.4302 9.4365 9.4365 10.3977 10.3977 11.0445 11.0445 11.1346 11.1346 11.6574 11.6574 12.2563 12.2563 12.2577 12.2577 12.7084 12.7084 12.8362 12.8362 k = 0.1406 0.1989 0.3445 ( 9792 PWs) bands (ev): -17.8368 -17.8368 -4.6981 -4.6981 -2.9757 -2.9757 -2.8583 -2.8583 -2.1683 -2.1683 -1.0105 -1.0105 -0.9524 -0.9524 0.3182 0.3182 0.3939 0.3939 0.4078 0.4078 0.7463 0.7463 1.3279 1.3279 1.3504 1.3504 2.1609 2.1609 2.3111 2.3111 2.3137 2.3137 3.9176 3.9176 3.9608 3.9608 4.2554 4.2554 4.4102 4.4102 4.5309 4.5309 4.5799 4.5799 4.8251 4.8251 4.8757 4.8757 5.0342 5.0342 5.1053 5.1053 5.2579 5.2579 5.3621 5.3621 5.6099 5.6099 5.7014 5.7014 5.7086 5.7086 5.9125 5.9125 5.9682 5.9682 6.0971 6.0971 6.2844 6.2844 6.4490 6.4490 6.4822 6.4822 7.1672 7.1672 7.1872 7.1872 7.4844 7.4844 7.5351 7.5351 7.8692 7.8692 8.1669 8.1669 8.5992 8.5992 8.6758 8.6758 8.7122 8.7122 8.9354 8.9354 8.9724 8.9724 9.0921 9.0921 9.4228 9.4228 9.4381 9.4381 10.4251 10.4251 11.0713 11.0713 11.1641 11.1641 11.6347 11.6347 12.2668 12.2668 12.2750 12.2750 12.6142 12.6142 12.9026 12.9026 k = 0.1484 0.2099 0.3636 ( 9825 PWs) bands (ev): -17.8368 -17.8368 -4.6992 -4.6992 -2.9769 -2.9769 -2.8635 -2.8635 -2.1175 -2.1175 -1.0495 -1.0495 -0.9870 -0.9870 0.2698 0.2698 0.4143 0.4143 0.4280 0.4280 0.7383 0.7383 1.3188 1.3188 1.3382 1.3382 2.1941 2.1941 2.3450 2.3450 2.3469 2.3469 3.9202 3.9202 3.9617 3.9617 4.2380 4.2380 4.4300 4.4300 4.5400 4.5400 4.6028 4.6028 4.8525 4.8525 4.8784 4.8784 5.0481 5.0481 5.1200 5.1200 5.2392 5.2392 5.3882 5.3882 5.6082 5.6082 5.6913 5.6913 5.6989 5.6989 5.9033 5.9033 5.9659 5.9659 6.0874 6.0874 6.2842 6.2842 6.4541 6.4541 6.4764 6.4764 7.0960 7.0960 7.1063 7.1063 7.5155 7.5155 7.5467 7.5467 7.7904 7.7904 8.1745 8.1745 8.5891 8.5891 8.6626 8.6626 8.7271 8.7271 8.9323 8.9323 8.9757 8.9757 9.0947 9.0947 9.4155 9.4155 9.4387 9.4387 10.4548 10.4548 11.1046 11.1046 11.1985 11.1985 11.6180 11.6180 12.2709 12.2709 12.2860 12.2860 12.5222 12.5222 12.9521 12.9521 k = 0.1562 0.2210 0.3827 ( 9804 PWs) bands (ev): -17.8368 -17.8368 -4.7002 -4.7002 -2.9773 -2.9773 -2.8689 -2.8689 -2.0653 -2.0653 -1.0883 -1.0883 -1.0216 -1.0216 0.2208 0.2208 0.4373 0.4373 0.4507 0.4507 0.7319 0.7319 1.3096 1.3096 1.3258 1.3258 2.2266 2.2266 2.3754 2.3754 2.3767 2.3767 3.9225 3.9225 3.9615 3.9615 4.2169 4.2169 4.4501 4.4501 4.5501 4.5501 4.6226 4.6226 4.8763 4.8763 4.8799 4.8799 5.0483 5.0483 5.1481 5.1481 5.2224 5.2224 5.4103 5.4103 5.6108 5.6108 5.6834 5.6834 5.6919 5.6919 5.8967 5.8967 5.9680 5.9680 6.0772 6.0772 6.2850 6.2850 6.4483 6.4483 6.4820 6.4820 7.0216 7.0216 7.0283 7.0283 7.5382 7.5382 7.5695 7.5695 7.7147 7.7147 8.1900 8.1900 8.5756 8.5756 8.6479 8.6479 8.7368 8.7368 8.9277 8.9277 8.9730 8.9730 9.1057 9.1057 9.4085 9.4085 9.4380 9.4380 10.4853 10.4853 11.1452 11.1452 11.2388 11.2388 11.6087 11.6087 12.2706 12.2706 12.2914 12.2914 12.4370 12.4370 12.9902 12.9902 k = 0.1641 0.2320 0.4019 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.7011 -4.7011 -2.9771 -2.9771 -2.8745 -2.8745 -2.0122 -2.0122 -1.1264 -1.1264 -1.0558 -1.0558 0.1720 0.1720 0.4622 0.4622 0.4754 0.4754 0.7267 0.7267 1.3003 1.3003 1.3133 1.3133 2.2580 2.2580 2.4020 2.4020 2.4026 2.4026 3.9245 3.9245 3.9603 3.9603 4.1935 4.1935 4.4701 4.4701 4.5610 4.5610 4.6393 4.6393 4.8817 4.8817 4.8950 4.8950 5.0413 5.0413 5.1819 5.1819 5.2083 5.2083 5.4231 5.4231 5.6180 5.6180 5.6801 5.6801 5.6872 5.6872 5.8933 5.8933 5.9743 5.9743 6.0670 6.0670 6.2864 6.2864 6.4376 6.4376 6.4931 6.4931 6.9485 6.9485 6.9561 6.9561 7.5186 7.5186 7.6004 7.6004 7.6823 7.6823 8.2076 8.2076 8.5605 8.5605 8.6324 8.6324 8.7400 8.7400 8.9203 8.9203 8.9655 8.9655 9.1213 9.1213 9.4022 9.4022 9.4359 9.4359 10.5151 10.5151 11.1938 11.1938 11.2860 11.2860 11.6081 11.6081 12.2667 12.2667 12.2911 12.2911 12.3616 12.3616 13.0215 13.0215 k = 0.1719 0.2431 0.4210 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.7019 -4.7019 -2.9762 -2.9762 -2.8803 -2.8803 -1.9582 -1.9582 -1.1637 -1.1637 -1.0894 -1.0894 0.1242 0.1242 0.4885 0.4885 0.5017 0.5017 0.7222 0.7222 1.2910 1.2910 1.3009 1.3009 2.2882 2.2882 2.4247 2.4247 2.4248 2.4248 3.9264 3.9264 3.9584 3.9584 4.1689 4.1689 4.4896 4.4896 4.5726 4.5726 4.6528 4.6528 4.8847 4.8847 4.9081 4.9081 5.0326 5.0326 5.1972 5.1972 5.2146 5.2146 5.4246 5.4246 5.6259 5.6259 5.6841 5.6841 5.6855 5.6855 5.8934 5.8934 5.9833 5.9833 6.0584 6.0584 6.2884 6.2884 6.4258 6.4258 6.5051 6.5051 6.8795 6.8795 6.8909 6.8909 7.4477 7.4477 7.6377 7.6377 7.7055 7.7055 8.2252 8.2252 8.5444 8.5444 8.6167 8.6167 8.7376 8.7376 8.9094 8.9094 8.9543 8.9543 9.1372 9.1372 9.3969 9.3969 9.4325 9.4325 10.5429 10.5429 11.2506 11.2506 11.3406 11.3406 11.6172 11.6172 12.2598 12.2598 12.2780 12.2780 12.3048 12.3048 13.0419 13.0419 k = 0.1797 0.2541 0.4401 ( 9811 PWs) bands (ev): -17.8368 -17.8368 -4.7026 -4.7026 -2.9746 -2.9746 -2.8862 -2.8862 -1.9037 -1.9037 -1.1998 -1.1998 -1.1222 -1.1222 0.0780 0.0780 0.5156 0.5156 0.5289 0.5289 0.7184 0.7184 1.2819 1.2819 1.2888 1.2888 2.3167 2.3167 2.4429 2.4429 2.4437 2.4437 3.9281 3.9281 3.9562 3.9562 4.1440 4.1440 4.5083 4.5083 4.5846 4.5846 4.6627 4.6627 4.8888 4.8888 4.9162 4.9162 5.0247 5.0247 5.1891 5.1891 5.2435 5.2435 5.4158 5.4158 5.6296 5.6296 5.6818 5.6818 5.7024 5.7024 5.8973 5.8973 5.9907 5.9907 6.0556 6.0556 6.2904 6.2904 6.4140 6.4140 6.5163 6.5163 6.8164 6.8164 6.8339 6.8339 7.3624 7.3624 7.6810 7.6810 7.7502 7.7502 8.2413 8.2413 8.5280 8.5280 8.6013 8.6013 8.7314 8.7314 8.8943 8.8943 8.9400 8.9400 9.1500 9.1500 9.3928 9.3928 9.4278 9.4278 10.5680 10.5680 11.3154 11.3154 11.4031 11.4031 11.6365 11.6365 12.2339 12.2339 12.2501 12.2501 12.2867 12.2867 13.0444 13.0444 k = 0.1875 0.2652 0.4593 ( 9805 PWs) bands (ev): -17.8368 -17.8368 -4.7032 -4.7032 -2.9725 -2.9725 -2.8923 -2.8923 -1.8490 -1.8490 -1.2344 -1.2344 -1.1540 -1.1540 0.0341 0.0341 0.5429 0.5429 0.5564 0.5564 0.7150 0.7150 1.2730 1.2730 1.2771 1.2771 2.3434 2.3434 2.4573 2.4573 2.4588 2.4588 3.9300 3.9300 3.9539 3.9539 4.1195 4.1195 4.5259 4.5259 4.5964 4.5964 4.6686 4.6686 4.8942 4.8942 4.9209 4.9209 5.0187 5.0187 5.1834 5.1834 5.2669 5.2669 5.3997 5.3997 5.6290 5.6290 5.6793 5.6793 5.7277 5.7277 5.9046 5.9046 5.9908 5.9908 6.0638 6.0638 6.2921 6.2921 6.4021 6.4021 6.5255 6.5255 6.7604 6.7604 6.7858 6.7858 7.2775 7.2775 7.7298 7.7298 7.8033 7.8033 8.2550 8.2550 8.5115 8.5115 8.5865 8.5865 8.7233 8.7233 8.8750 8.8750 8.9225 8.9225 9.1577 9.1577 9.3894 9.3894 9.4221 9.4221 10.5897 10.5897 11.3877 11.3877 11.4733 11.4733 11.6664 11.6664 12.1924 12.1924 12.2381 12.2381 12.2747 12.2747 13.0175 13.0175 k = 0.1953 0.2762 0.4784 ( 9796 PWs) bands (ev): -17.8368 -17.8368 -4.7037 -4.7037 -2.9698 -2.9698 -2.8984 -2.8984 -1.7947 -1.7947 -1.2672 -1.2672 -1.1847 -1.1847 -0.0071 -0.0071 0.5700 0.5700 0.5837 0.5837 0.7119 0.7119 1.2645 1.2645 1.2661 1.2661 2.3680 2.3680 2.4680 2.4680 2.4703 2.4703 3.9319 3.9319 3.9519 3.9519 4.0959 4.0959 4.5422 4.5422 4.6075 4.6075 4.6703 4.6703 4.9009 4.9009 4.9242 4.9242 5.0151 5.0151 5.1795 5.1795 5.2839 5.2839 5.3795 5.3795 5.6263 5.6263 5.6760 5.6760 5.7564 5.7564 5.9143 5.9143 5.9837 5.9837 6.0825 6.0825 6.2931 6.2931 6.3901 6.3901 6.5311 6.5311 6.7129 6.7129 6.7476 6.7476 7.1980 7.1980 7.7838 7.7838 7.8617 7.8617 8.2652 8.2652 8.4955 8.4955 8.5727 8.5727 8.7149 8.7149 8.8517 8.8517 8.9020 8.9020 9.1598 9.1598 9.3861 9.3861 9.4155 9.4155 10.6079 10.6079 11.4670 11.4670 11.5512 11.5512 11.7070 11.7070 12.1620 12.1620 12.2243 12.2243 12.2614 12.2614 12.9565 12.9565 k = 0.2031 0.2873 0.4976 ( 9790 PWs) bands (ev): -17.8368 -17.8368 -4.7042 -4.7042 -2.9666 -2.9666 -2.9046 -2.9046 -1.7413 -1.7413 -1.2977 -1.2977 -1.2141 -1.2141 -0.0448 -0.0448 0.5961 0.5961 0.6099 0.6099 0.7090 0.7090 1.2559 1.2559 1.2564 1.2564 2.3903 2.3903 2.4753 2.4753 2.4784 2.4784 3.9340 3.9340 3.9504 3.9504 4.0737 4.0737 4.5572 4.5572 4.6175 4.6175 4.6678 4.6678 4.9090 4.9090 4.9277 4.9277 5.0140 5.0140 5.1770 5.1770 5.2929 5.2929 5.3588 5.3588 5.6226 5.6226 5.6714 5.6714 5.7853 5.7853 5.9252 5.9252 5.9736 5.9736 6.1064 6.1064 6.2929 6.2929 6.3775 6.3775 6.5322 6.5322 6.6746 6.6746 6.7192 6.7192 7.1267 7.1267 7.8423 7.8423 7.9241 7.9241 8.2710 8.2710 8.4808 8.4808 8.5602 8.5602 8.7072 8.7072 8.8248 8.8248 8.8789 8.8789 9.1569 9.1569 9.3820 9.3820 9.4082 9.4082 10.6229 10.6229 11.5524 11.5524 11.6361 11.6361 11.7582 11.7582 12.1425 12.1425 12.2092 12.2092 12.2471 12.2471 12.8600 12.8600 k = 0.2109 0.2983 0.5167 ( 9799 PWs) bands (ev): -17.8368 -17.8368 -4.7045 -4.7045 -2.9629 -2.9629 -2.9108 -2.9108 -1.6897 -1.6897 -1.3255 -1.3255 -1.2422 -1.2422 -0.0786 -0.0786 0.6206 0.6206 0.6343 0.6343 0.7063 0.7063 1.2468 1.2468 1.2490 1.2490 2.4101 2.4101 2.4796 2.4796 2.4834 2.4834 3.9364 3.9364 3.9497 3.9497 4.0531 4.0531 4.5709 4.5709 4.6256 4.6256 4.6619 4.6619 4.9184 4.9184 4.9320 4.9320 5.0153 5.0153 5.1757 5.1757 5.2904 5.2904 5.3431 5.3431 5.6187 5.6187 5.6657 5.6657 5.8129 5.8129 5.9355 5.9355 5.9631 5.9631 6.1322 6.1322 6.2914 6.2914 6.3637 6.3637 6.5292 6.5292 6.6461 6.6461 6.6993 6.6993 7.0657 7.0657 7.9043 7.9043 7.9887 7.9887 8.2714 8.2714 8.4682 8.4682 8.5495 8.5495 8.7006 8.7006 8.7953 8.7953 8.8534 8.8534 9.1500 9.1500 9.3767 9.3767 9.4002 9.4002 10.6352 10.6352 11.6428 11.6428 11.7276 11.7276 11.8195 11.8195 12.1323 12.1323 12.1936 12.1936 12.2331 12.2331 12.7509 12.7509 k = 0.2188 0.3094 0.5358 ( 9793 PWs) bands (ev): -17.8368 -17.8368 -4.7048 -4.7048 -2.9588 -2.9588 -2.9169 -2.9169 -1.6414 -1.6414 -1.3495 -1.3495 -1.2689 -1.2689 -0.1077 -0.1077 0.6427 0.6427 0.6560 0.6560 0.7039 0.7039 1.2391 1.2391 1.2423 1.2423 2.4270 2.4270 2.4814 2.4814 2.4859 2.4859 3.9391 3.9391 3.9500 3.9500 4.0343 4.0343 4.5832 4.5832 4.6317 4.6317 4.6535 4.6535 4.9286 4.9286 4.9372 4.9372 5.0187 5.0187 5.1758 5.1758 5.2748 5.2748 5.3355 5.3355 5.6155 5.6155 5.6589 5.6589 5.8382 5.8382 5.9436 5.9436 5.9535 5.9535 6.1577 6.1577 6.2889 6.2889 6.3482 6.3482 6.5246 6.5246 6.6274 6.6274 6.6844 6.6844 7.0170 7.0170 7.9680 7.9680 8.0534 8.0534 8.2658 8.2658 8.4595 8.4595 8.5411 8.5411 8.6950 8.6950 8.7647 8.7647 8.8260 8.8260 9.1403 9.1403 9.3702 9.3702 9.3915 9.3915 10.6452 10.6452 11.7370 11.7370 11.8249 11.8249 11.8904 11.8904 12.1290 12.1290 12.1782 12.1782 12.2212 12.2212 12.6404 12.6404 k = 0.2266 0.3204 0.5550 ( 9802 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9544 -2.9544 -2.9229 -2.9229 -1.5984 -1.5984 -1.3681 -1.3681 -1.2942 -1.2942 -0.1315 -0.1315 0.6615 0.6615 0.6742 0.6742 0.7016 0.7016 1.2330 1.2330 1.2365 1.2365 2.4408 2.4408 2.4816 2.4816 2.4863 2.4863 3.9421 3.9421 3.9513 3.9513 4.0175 4.0175 4.5943 4.5943 4.6357 4.6357 4.6440 4.6440 4.9385 4.9385 4.9425 4.9425 5.0241 5.0241 5.1776 5.1776 5.2527 5.2527 5.3312 5.3312 5.6140 5.6140 5.6514 5.6514 5.8607 5.8607 5.9452 5.9452 5.9485 5.9485 6.1813 6.1813 6.2863 6.2863 6.3309 6.3309 6.5210 6.5210 6.6177 6.6177 6.6705 6.6705 6.9816 6.9816 8.0308 8.0308 8.1136 8.1136 8.2541 8.2541 8.4574 8.4574 8.5352 8.5352 8.6898 8.6898 8.7351 8.7351 8.7970 8.7970 9.1296 9.1296 9.3636 9.3636 9.3825 9.3825 10.6534 10.6534 11.8335 11.8335 11.9267 11.9267 11.9695 11.9695 12.1297 12.1297 12.1639 12.1639 12.2133 12.2133 12.5306 12.5306 k = 0.2344 0.3315 0.5741 ( 9802 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9497 -2.9497 -2.9287 -2.9287 -1.5643 -1.5643 -1.3783 -1.3783 -1.3181 -1.3181 -0.1493 -0.1493 0.6760 0.6760 0.6881 0.6881 0.6998 0.6998 1.2288 1.2288 1.2319 1.2319 2.4509 2.4509 2.4810 2.4810 2.4854 2.4854 3.9455 3.9455 3.9534 3.9534 4.0032 4.0032 4.6042 4.6042 4.6345 4.6345 4.6380 4.6380 4.9467 4.9467 4.9472 4.9472 5.0306 5.0306 5.1815 5.1815 5.2302 5.2302 5.3270 5.3270 5.6151 5.6151 5.6434 5.6434 5.8795 5.8795 5.9389 5.9389 5.9494 5.9494 6.2018 6.2018 6.2846 6.2846 6.3129 6.3129 6.5198 6.5198 6.6155 6.6155 6.6556 6.6556 6.9594 6.9594 8.0890 8.0890 8.1624 8.1624 8.2369 8.2369 8.4659 8.4659 8.5309 8.5309 8.6849 8.6849 8.7109 8.7109 8.7666 8.7666 9.1196 9.1196 9.3582 9.3582 9.3733 9.3733 10.6601 10.6601 11.9299 11.9299 12.0306 12.0306 12.0530 12.0530 12.1327 12.1327 12.1517 12.1517 12.2123 12.2123 12.4246 12.4246 k = 0.2422 0.3425 0.5932 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9447 -2.9447 -2.9343 -2.9343 -1.5435 -1.5435 -1.3763 -1.3763 -1.3404 -1.3404 -0.1604 -0.1604 0.6851 0.6851 0.6967 0.6967 0.6990 0.6990 1.2267 1.2267 1.2286 1.2286 2.4566 2.4566 2.4811 2.4811 2.4837 2.4837 3.9492 3.9492 3.9549 3.9549 3.9927 3.9927 4.6126 4.6126 4.6260 4.6260 4.6388 4.6388 4.9507 4.9507 4.9517 4.9517 5.0367 5.0367 5.1879 5.1879 5.2105 5.2105 5.3230 5.3230 5.6192 5.6192 5.6350 5.6350 5.8929 5.8929 5.9363 5.9363 5.9465 5.9465 6.2175 6.2175 6.2847 6.2847 6.2964 6.2964 6.5205 6.5205 6.6193 6.6193 6.6405 6.6405 6.9482 6.9482 8.1380 8.1380 8.1886 8.1886 8.2186 8.2186 8.4865 8.4865 8.5245 8.5245 8.6816 8.6816 8.6990 8.6990 8.7353 8.7353 9.1120 9.1120 9.3558 9.3558 9.3647 9.3647 10.6648 10.6648 12.0223 12.0223 12.1096 12.1096 12.1114 12.1114 12.1593 12.1593 12.1599 12.1599 12.2233 12.2233 12.3299 12.3299 k = 0.2500 0.3536 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9396 -2.9396 -2.9396 -2.9396 -1.5373 -1.5373 -1.3613 -1.3613 -1.3613 -1.3613 -0.1642 -0.1642 0.6878 0.6878 0.6994 0.6994 0.6995 0.6995 1.2267 1.2267 1.2268 1.2268 2.4581 2.4581 2.4821 2.4821 2.4822 2.4822 3.9532 3.9532 3.9533 3.9533 3.9887 3.9887 4.6193 4.6193 4.6193 4.6193 4.6388 4.6388 4.9527 4.9527 4.9527 4.9527 5.0394 5.0394 5.1966 5.1966 5.1967 5.1967 5.3211 5.3211 5.6264 5.6264 5.6264 5.6264 5.8975 5.8975 5.9403 5.9403 5.9403 5.9403 6.2241 6.2241 6.2869 6.2869 6.2870 6.2870 6.5214 6.5214 6.6277 6.6277 6.6278 6.6278 6.9451 6.9451 8.1741 8.1741 8.1741 8.1741 8.2156 8.2156 8.5104 8.5104 8.5104 8.5104 8.6827 8.6827 8.7072 8.7072 8.7073 8.7073 9.1090 9.1090 9.3580 9.3580 9.3580 9.3580 10.6667 10.6667 12.0968 12.0968 12.0968 12.0968 12.1064 12.1064 12.2054 12.2054 12.2054 12.2054 12.2437 12.2437 12.3028 12.3028 k = 0.2500 0.3536 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9396 -2.9396 -2.9396 -2.9396 -1.5373 -1.5373 -1.3613 -1.3613 -1.3613 -1.3613 -0.1642 -0.1642 0.6878 0.6878 0.6994 0.6994 0.6995 0.6995 1.2267 1.2267 1.2268 1.2268 2.4581 2.4581 2.4821 2.4821 2.4822 2.4822 3.9532 3.9532 3.9533 3.9533 3.9887 3.9887 4.6193 4.6193 4.6193 4.6193 4.6388 4.6388 4.9527 4.9527 4.9527 4.9527 5.0394 5.0394 5.1966 5.1966 5.1967 5.1967 5.3211 5.3211 5.6264 5.6264 5.6264 5.6264 5.8975 5.8975 5.9403 5.9403 5.9403 5.9403 6.2241 6.2241 6.2869 6.2869 6.2870 6.2870 6.5214 6.5214 6.6277 6.6277 6.6278 6.6278 6.9451 6.9451 8.1741 8.1741 8.1741 8.1741 8.2156 8.2156 8.5104 8.5104 8.5104 8.5104 8.6827 8.6827 8.7072 8.7072 8.7073 8.7073 9.1090 9.1090 9.3580 9.3580 9.3580 9.3580 10.6667 10.6667 12.0968 12.0968 12.0968 12.0968 12.1064 12.1064 12.2054 12.2054 12.2054 12.2054 12.2437 12.2437 12.3028 12.3028 k = 0.2578 0.3315 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9446 -2.9446 -2.9344 -2.9344 -1.5415 -1.5415 -1.3807 -1.3807 -1.3381 -1.3381 -0.1603 -0.1603 0.6858 0.6858 0.6959 0.6959 0.6988 0.6988 1.2264 1.2264 1.2288 1.2288 2.4574 2.4574 2.4814 2.4814 2.4831 2.4831 3.9471 3.9471 3.9575 3.9575 3.9922 3.9922 4.6149 4.6149 4.6234 4.6234 4.6393 4.6393 4.9492 4.9492 4.9532 4.9532 5.0362 5.0362 5.1911 5.1911 5.2076 5.2076 5.3237 5.3237 5.6178 5.6178 5.6363 5.6363 5.8943 5.8943 5.9318 5.9318 5.9499 5.9499 6.2173 6.2173 6.2904 6.2904 6.2914 6.2914 6.5196 6.5196 6.6209 6.6209 6.6396 6.6396 6.9473 6.9473 8.1400 8.1400 8.1957 8.1957 8.2115 8.2115 8.4871 8.4871 8.5183 8.5183 8.6652 8.6652 8.7159 8.7159 8.7357 8.7357 9.1131 9.1131 9.3553 9.3553 9.3665 9.3665 10.6642 10.6642 12.0365 12.0365 12.0620 12.0620 12.1285 12.1285 12.1666 12.1666 12.1844 12.1844 12.2235 12.2235 12.2914 12.2914 k = 0.2656 0.3094 0.6124 ( 9805 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9492 -2.9492 -2.9292 -2.9292 -1.5507 -1.5507 -1.3987 -1.3987 -1.3123 -1.3123 -0.1483 -0.1483 0.6794 0.6794 0.6859 0.6859 0.6968 0.6968 1.2275 1.2275 1.2326 1.2326 2.4562 2.4562 2.4822 2.4822 2.4826 2.4826 3.9388 3.9388 3.9618 3.9618 4.0007 4.0007 4.6130 4.6130 4.6236 4.6236 4.6415 4.6415 4.9408 4.9408 4.9528 4.9528 5.0278 5.0278 5.1934 5.1934 5.2202 5.2202 5.3322 5.3322 5.6093 5.6093 5.6481 5.6481 5.8872 5.8872 5.9221 5.9221 5.9607 5.9607 6.2019 6.2019 6.2977 6.2977 6.3035 6.3035 6.5137 6.5137 6.6218 6.6218 6.6538 6.6538 6.9526 6.9526 8.0983 8.0983 8.1998 8.1998 8.2037 8.2037 8.4583 8.4583 8.5017 8.5017 8.6363 8.6363 8.7516 8.7516 8.7757 8.7757 9.1286 9.1286 9.3599 9.3599 9.3819 9.3819 10.6549 10.6549 11.9514 11.9514 11.9811 11.9811 12.0521 12.0521 12.1664 12.1664 12.1792 12.1792 12.1979 12.1979 12.3720 12.3720 k = 0.2734 0.2873 0.6124 ( 9811 PWs) bands (ev): -17.8368 -17.8368 -4.7050 -4.7050 -2.9534 -2.9534 -2.9240 -2.9240 -1.5617 -1.5617 -1.4152 -1.4152 -1.2873 -1.2873 -0.1285 -0.1285 0.6665 0.6665 0.6695 0.6695 0.6954 0.6954 1.2298 1.2298 1.2378 1.2378 2.4555 2.4555 2.4805 2.4805 2.4851 2.4851 3.9303 3.9303 3.9661 3.9661 4.0120 4.0120 4.6137 4.6137 4.6201 4.6201 4.6451 4.6451 4.9278 4.9278 4.9520 4.9520 5.0178 5.0178 5.2011 5.2011 5.2338 5.2338 5.3473 5.3473 5.6011 5.6011 5.6611 5.6611 5.8786 5.8786 5.9123 5.9123 5.9703 5.9703 6.1842 6.1842 6.3057 6.3057 6.3216 6.3216 6.5045 6.5045 6.6293 6.6293 6.6699 6.6699 6.9594 6.9594 8.0505 8.0505 8.1831 8.1831 8.2001 8.2001 8.4282 8.4282 8.4675 8.4675 8.6086 8.6086 8.7846 8.7846 8.8154 8.8154 9.1609 9.1609 9.3761 9.3761 9.4040 9.4040 10.6363 10.6363 11.8614 11.8614 11.8854 11.8854 11.9569 11.9569 12.1742 12.1742 12.1868 12.1868 12.1971 12.1971 12.4604 12.4604 k = 0.2812 0.2652 0.6124 ( 9799 PWs) bands (ev): -17.8368 -17.8368 -4.7050 -4.7050 -2.9572 -2.9572 -2.9191 -2.9191 -1.5729 -1.5729 -1.4303 -1.4303 -1.2645 -1.2645 -0.1011 -0.1011 0.6465 0.6465 0.6469 0.6469 0.6954 0.6954 1.2331 1.2331 1.2437 1.2437 2.4549 2.4549 2.4776 2.4776 2.4907 2.4907 3.9222 3.9222 3.9701 3.9701 4.0251 4.0251 4.6140 4.6140 4.6167 4.6167 4.6488 4.6488 4.9115 4.9115 4.9518 4.9518 5.0097 5.0097 5.2118 5.2118 5.2478 5.2478 5.3682 5.3682 5.5932 5.5932 5.6745 5.6745 5.8696 5.8696 5.9034 5.9034 5.9772 5.9772 6.1673 6.1673 6.3148 6.3148 6.3431 6.3431 6.4942 6.4942 6.6413 6.6413 6.6874 6.6874 6.9667 6.9667 7.9970 7.9970 8.1630 8.1630 8.1869 8.1869 8.3997 8.3997 8.4235 8.4235 8.5827 8.5827 8.8016 8.8016 8.8449 8.8449 9.2126 9.2126 9.4079 9.4079 9.4319 9.4319 10.6058 10.6058 11.7738 11.7738 11.7895 11.7895 11.8663 11.8663 12.1821 12.1821 12.2028 12.2028 12.2079 12.2079 12.5473 12.5473 k = 0.2891 0.2431 0.6124 ( 9811 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9604 -2.9604 -2.9143 -2.9143 -1.5834 -1.5834 -1.4440 -1.4440 -1.2443 -1.2443 -0.0671 -0.0671 0.6185 0.6185 0.6199 0.6199 0.6970 0.6970 1.2370 1.2370 1.2499 1.2499 2.4518 2.4518 2.4769 2.4769 2.4995 2.4995 3.9148 3.9148 3.9738 3.9738 4.0392 4.0392 4.6054 4.6054 4.6215 4.6215 4.6518 4.6518 4.8950 4.8950 4.9534 4.9534 5.0050 5.0050 5.2243 5.2243 5.2615 5.2615 5.3935 5.3935 5.5857 5.5857 5.6871 5.6871 5.8611 5.8611 5.8961 5.8961 5.9802 5.9802 6.1533 6.1533 6.3249 6.3249 6.3671 6.3671 6.4844 6.4844 6.6559 6.6559 6.7061 6.7061 6.9738 6.9738 7.9384 7.9384 8.1407 8.1407 8.1653 8.1653 8.3744 8.3744 8.3747 8.3747 8.5582 8.5582 8.8007 8.8007 8.8583 8.8583 9.2790 9.2790 9.4563 9.4563 9.4640 9.4640 10.5614 10.5614 11.6918 11.6918 11.6997 11.6997 11.7834 11.7834 12.1919 12.1919 12.2257 12.2257 12.2281 12.2281 12.6285 12.6285 k = 0.2969 0.2210 0.6124 ( 9814 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9632 -2.9632 -2.9098 -2.9098 -1.5928 -1.5928 -1.4564 -1.4564 -1.2266 -1.2266 -0.0274 -0.0274 0.5848 0.5848 0.5873 0.5873 0.7003 0.7003 1.2413 1.2413 1.2560 1.2560 2.4438 2.4438 2.4815 2.4815 2.5115 2.5115 3.9083 3.9083 3.9770 3.9770 4.0538 4.0538 4.5944 4.5944 4.6271 4.6271 4.6530 4.6530 4.8822 4.8822 4.9578 4.9578 5.0037 5.0037 5.2382 5.2382 5.2743 5.2743 5.4216 5.4216 5.5790 5.5790 5.6975 5.6975 5.8544 5.8544 5.8911 5.8911 5.9783 5.9783 6.1436 6.1436 6.3357 6.3357 6.3922 6.3922 6.4770 6.4770 6.6722 6.6722 6.7257 6.7257 6.9804 6.9804 7.8757 7.8757 8.1164 8.1164 8.1366 8.1366 8.3229 8.3229 8.3540 8.3540 8.5350 8.5350 8.7858 8.7858 8.8551 8.8551 9.3502 9.3502 9.4994 9.4994 9.5178 9.5178 10.5032 10.5032 11.6176 11.6176 11.6189 11.6189 11.7098 11.7098 12.2074 12.2074 12.2546 12.2546 12.2551 12.2551 12.7003 12.7003 k = 0.3047 0.1989 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9653 -2.9653 -2.9057 -2.9057 -1.6010 -1.6010 -1.4674 -1.4674 -1.2107 -1.2107 0.0162 0.0162 0.5463 0.5463 0.5493 0.5493 0.7057 0.7057 1.2456 1.2456 1.2617 1.2617 2.4317 2.4317 2.4907 2.4907 2.5270 2.5270 3.9027 3.9027 3.9796 3.9796 4.0683 4.0683 4.5809 4.5809 4.6325 4.6325 4.6516 4.6516 4.8767 4.8767 4.9662 4.9662 5.0053 5.0053 5.2531 5.2531 5.2858 5.2858 5.4510 5.4510 5.5731 5.5731 5.7041 5.7041 5.8507 5.8507 5.8889 5.8889 5.9716 5.9716 6.1390 6.1390 6.3470 6.3470 6.4138 6.4138 6.4766 6.4766 6.6897 6.6897 6.7462 6.7462 6.9863 6.9863 7.8098 7.8098 8.0902 8.0902 8.1021 8.1021 8.2708 8.2708 8.3377 8.3377 8.5130 8.5130 8.7616 8.7616 8.8379 8.8379 9.4140 9.4140 9.5394 9.5394 9.5863 9.5863 10.4333 10.4333 11.5481 11.5481 11.5533 11.5533 11.6469 11.6469 12.2312 12.2312 12.2875 12.2875 12.2888 12.2888 12.7591 12.7591 k = 0.3125 0.1768 0.6124 ( 9796 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9669 -2.9669 -2.9020 -2.9020 -1.6077 -1.6077 -1.4770 -1.4770 -1.1962 -1.1962 0.0621 0.0621 0.5036 0.5036 0.5065 0.5065 0.7140 0.7140 1.2498 1.2498 1.2667 1.2667 2.4168 2.4168 2.5036 2.5036 2.5458 2.5458 3.8980 3.8980 3.9815 3.9815 4.0824 4.0824 4.5651 4.5651 4.6367 4.6367 4.6472 4.6472 4.8806 4.8806 4.9798 4.9798 5.0096 5.0096 5.2691 5.2691 5.2956 5.2956 5.4802 5.4802 5.5684 5.5684 5.7055 5.7055 5.8513 5.8513 5.8899 5.8899 5.9615 5.9615 6.1389 6.1389 6.3587 6.3587 6.4233 6.4233 6.4915 6.4915 6.7081 6.7081 6.7675 6.7675 6.9914 6.9914 7.7422 7.7422 8.0621 8.0621 8.0631 8.0631 8.2188 8.2188 8.3252 8.3252 8.4921 8.4921 8.7314 8.7314 8.8103 8.8103 9.4572 9.4572 9.5864 9.5864 9.6547 9.6547 10.3563 10.3563 11.4863 11.4863 11.5012 11.5012 11.5966 11.5966 12.2642 12.2642 12.3240 12.3240 12.3274 12.3274 12.8014 12.8014 k = 0.3203 0.1547 0.6124 ( 9793 PWs) bands (ev): -17.8367 -17.8367 -4.7049 -4.7049 -2.9679 -2.9679 -2.8987 -2.8987 -1.6130 -1.6130 -1.4854 -1.4854 -1.1822 -1.1822 0.1081 0.1081 0.4571 0.4571 0.4595 0.4595 0.7260 0.7260 1.2536 1.2536 1.2711 1.2711 2.4001 2.4001 2.5196 2.5196 2.5679 2.5679 3.8944 3.8944 3.9827 3.9827 4.0956 4.0956 4.5473 4.5473 4.6384 4.6384 4.6403 4.6403 4.8943 4.8943 4.9991 4.9991 5.0160 5.0160 5.2860 5.2860 5.3037 5.3037 5.5081 5.5081 5.5653 5.5653 5.7013 5.7013 5.8560 5.8560 5.8942 5.8942 5.9501 5.9501 6.1423 6.1423 6.3709 6.3709 6.4212 6.4212 6.5207 6.5207 6.7272 6.7272 6.7895 6.7895 6.9957 6.9957 7.6740 7.6740 8.0206 8.0206 8.0324 8.0324 8.1673 8.1673 8.3160 8.3160 8.4723 8.4723 8.6977 8.6977 8.7752 8.7752 9.4731 9.4731 9.6371 9.6371 9.7166 9.7166 10.2784 10.2784 11.4325 11.4325 11.4635 11.4635 11.5606 11.5606 12.3056 12.3056 12.3634 12.3634 12.3689 12.3689 12.8246 12.8246 k = 0.3281 0.1326 0.6124 ( 9793 PWs) bands (ev): -17.8367 -17.8367 -4.7050 -4.7050 -2.9684 -2.9684 -2.8960 -2.8960 -1.6168 -1.6168 -1.4925 -1.4925 -1.1682 -1.1682 0.1519 0.1519 0.4074 0.4074 0.4092 0.4092 0.7426 0.7426 1.2571 1.2571 1.2746 1.2746 2.3825 2.3825 2.5382 2.5382 2.5929 2.5929 3.8918 3.8918 3.9831 3.9831 4.1077 4.1077 4.5282 4.5282 4.6321 4.6321 4.6372 4.6372 4.9169 4.9169 5.0241 5.0241 5.0245 5.0245 5.3033 5.3033 5.3102 5.3102 5.5330 5.5330 5.5641 5.5641 5.6929 5.6929 5.8627 5.8627 5.9021 5.9021 5.9403 5.9403 6.1476 6.1476 6.3834 6.3834 6.4147 6.4147 6.5566 6.5566 6.7470 6.7470 6.8124 6.8124 6.9995 6.9995 7.6068 7.6068 7.9755 7.9755 8.0011 8.0011 8.1167 8.1167 8.3093 8.3093 8.4529 8.4529 8.6626 8.6626 8.7349 8.7349 9.4617 9.4617 9.6822 9.6822 9.7665 9.7665 10.2058 10.2058 11.3855 11.3855 11.4420 11.4420 11.5407 11.5407 12.3523 12.3523 12.4040 12.4040 12.4114 12.4114 12.8285 12.8285 k = 0.3359 0.1105 0.6124 ( 9787 PWs) bands (ev): -17.8367 -17.8367 -4.7051 -4.7051 -2.9682 -2.9682 -2.8938 -2.8938 -1.6192 -1.6192 -1.4983 -1.4983 -1.1534 -1.1534 0.1906 0.1906 0.3551 0.3551 0.3568 0.3568 0.7649 0.7649 1.2602 1.2602 1.2775 1.2775 2.3648 2.3648 2.5592 2.5592 2.6205 2.6205 3.8902 3.8902 3.9828 3.9828 4.1185 4.1185 4.5084 4.5084 4.6234 4.6234 4.6328 4.6328 4.9469 4.9469 5.0346 5.0346 5.0538 5.0538 5.3157 5.3157 5.3207 5.3207 5.5528 5.5528 5.5653 5.5653 5.6837 5.6837 5.8671 5.8671 5.9134 5.9134 5.9360 5.9360 6.1539 6.1539 6.3964 6.3964 6.4073 6.4073 6.5954 6.5954 6.7671 6.7671 6.8359 6.8359 7.0032 7.0032 7.5420 7.5420 7.9285 7.9285 7.9686 7.9686 8.0669 8.0669 8.3047 8.3047 8.4331 8.4331 8.6282 8.6282 8.6913 8.6913 9.4235 9.4235 9.7148 9.7148 9.8005 9.8005 10.1431 10.1431 11.3452 11.3452 11.4376 11.4376 11.5375 11.5375 12.3978 12.3978 12.4442 12.4442 12.4516 12.4516 12.8179 12.8179 k = 0.3438 0.0884 0.6124 ( 9757 PWs) bands (ev): -17.8367 -17.8367 -4.7052 -4.7052 -2.9675 -2.9675 -2.8922 -2.8922 -1.6200 -1.6200 -1.5029 -1.5029 -1.1375 -1.1375 0.2194 0.2194 0.3007 0.3007 0.3054 0.3054 0.7936 0.7936 1.2628 1.2628 1.2797 1.2797 2.3481 2.3481 2.5821 2.5821 2.6503 2.6503 3.8895 3.8895 3.9819 3.9819 4.1281 4.1281 4.4887 4.4887 4.6151 4.6151 4.6254 4.6254 4.9823 4.9823 5.0462 5.0462 5.0860 5.0860 5.3216 5.3216 5.3374 5.3374 5.5646 5.5646 5.5693 5.5693 5.6782 5.6782 5.8650 5.8650 5.9282 5.9282 5.9404 5.9404 6.1604 6.1604 6.4004 6.4004 6.4100 6.4100 6.6352 6.6352 6.7875 6.7875 6.8600 6.8600 7.0074 7.0074 7.4808 7.4808 7.8800 7.8800 7.9350 7.9350 8.0184 8.0184 8.3013 8.3013 8.4112 8.4112 8.5966 8.5966 8.6460 8.6460 9.3604 9.3604 9.7312 9.7312 9.8160 9.8160 10.0906 10.0906 11.3114 11.3114 11.4495 11.4495 11.5503 11.5503 12.4312 12.4312 12.4795 12.4795 12.4846 12.4846 12.8049 12.8049 k = 0.3516 0.0663 0.6124 ( 9781 PWs) bands (ev): -17.8367 -17.8367 -4.7054 -4.7054 -2.9663 -2.9663 -2.8911 -2.8911 -1.6193 -1.6193 -1.5062 -1.5062 -1.1200 -1.1200 0.2168 0.2168 0.2447 0.2447 0.2757 0.2757 0.8288 0.8288 1.2651 1.2651 1.2814 1.2814 2.3333 2.3333 2.6066 2.6066 2.6820 2.6820 3.8898 3.8898 3.9803 3.9803 4.1364 4.1364 4.4696 4.4696 4.6076 4.6076 4.6153 4.6153 5.0214 5.0214 5.0592 5.0592 5.1177 5.1177 5.3300 5.3300 5.3522 5.3522 5.5661 5.5661 5.5768 5.5768 5.6800 5.6800 5.8565 5.8565 5.9463 5.9463 5.9522 5.9522 6.1669 6.1669 6.3952 6.3952 6.4242 6.4242 6.6743 6.6743 6.8082 6.8082 6.8848 6.8848 7.0128 7.0128 7.4247 7.4247 7.8302 7.8302 7.9001 7.9001 7.9722 7.9722 8.2981 8.2981 8.3856 8.3856 8.5701 8.5701 8.6008 8.6008 9.2770 9.2770 9.7306 9.7306 9.8125 9.8125 10.0445 10.0445 11.2846 11.2846 11.4749 11.4749 11.5765 11.5765 12.4417 12.4417 12.4962 12.4962 12.5028 12.5028 12.8098 12.8098 k = 0.3594 0.0442 0.6124 ( 9778 PWs) bands (ev): -17.8367 -17.8367 -4.7057 -4.7057 -2.9645 -2.9645 -2.8906 -2.8906 -1.6171 -1.6171 -1.5084 -1.5084 -1.1007 -1.1007 0.1689 0.1689 0.1876 0.1876 0.2815 0.2815 0.8699 0.8699 1.2669 1.2669 1.2825 1.2825 2.3218 2.3218 2.6324 2.6324 2.7152 2.7152 3.8909 3.8909 3.9782 3.9782 4.1436 4.1436 4.4516 4.4516 4.6010 4.6010 4.6030 4.6030 5.0607 5.0607 5.0748 5.0748 5.1446 5.1446 5.3436 5.3436 5.3637 5.3637 5.5597 5.5597 5.5883 5.5883 5.6881 5.6881 5.8448 5.8448 5.9676 5.9676 5.9678 5.9678 6.1735 6.1735 6.3928 6.3928 6.4394 6.4394 6.7105 6.7105 6.8298 6.8298 6.9101 6.9101 7.0200 7.0200 7.3754 7.3754 7.7795 7.7795 7.8621 7.8621 7.9305 7.9305 8.2936 8.2936 8.3548 8.3548 8.5501 8.5501 8.5577 8.5577 9.1797 9.1797 9.7135 9.7135 9.7911 9.7911 9.9996 9.9996 11.2648 11.2648 11.5087 11.5087 11.6118 11.6118 12.4226 12.4226 12.4822 12.4822 12.4978 12.4978 12.8480 12.8480 k = 0.3672 0.0221 0.6124 ( 9778 PWs) bands (ev): -17.8367 -17.8367 -4.7060 -4.7060 -2.9623 -2.9623 -2.8905 -2.8905 -1.6133 -1.6133 -1.5094 -1.5094 -1.0794 -1.0794 0.1107 0.1107 0.1298 0.1298 0.2885 0.2885 0.9153 0.9153 1.2684 1.2684 1.2833 1.2833 2.3149 2.3149 2.6593 2.6593 2.7495 2.7495 3.8926 3.8926 3.9757 3.9757 4.1498 4.1498 4.4348 4.4348 4.5887 4.5887 4.5954 4.5954 5.0852 5.0852 5.1056 5.1056 5.1632 5.1632 5.3644 5.3644 5.3701 5.3701 5.5502 5.5502 5.6044 5.6044 5.6979 5.6979 5.8333 5.8333 5.9847 5.9847 5.9923 5.9923 6.1806 6.1806 6.3943 6.3943 6.4558 6.4558 6.7403 6.7403 6.8541 6.8541 6.9359 6.9359 7.0289 7.0289 7.3348 7.3348 7.7283 7.7283 7.8194 7.8194 7.8959 7.8959 8.2853 8.2853 8.3187 8.3187 8.5197 8.5197 8.5366 8.5366 9.0742 9.0742 9.6813 9.6813 9.7537 9.7537 9.9516 9.9516 11.2517 11.2517 11.5444 11.5444 11.6501 11.6501 12.3752 12.3752 12.4414 12.4414 12.4655 12.4655 12.9038 12.9038 k = 0.3750-0.0000 0.6124 ( 9745 PWs) bands (ev): -17.8367 -17.8367 -4.7063 -4.7063 -2.9596 -2.9596 -2.8910 -2.8910 -1.6081 -1.6081 -1.5093 -1.5093 -1.0559 -1.0559 0.0502 0.0502 0.0719 0.0719 0.2895 0.2895 0.9629 0.9629 1.2697 1.2697 1.2838 1.2838 2.3139 2.3139 2.6868 2.6868 2.7846 2.7846 3.8949 3.8949 3.9727 3.9727 4.1552 4.1552 4.4196 4.4196 4.5728 4.5728 4.5908 4.5908 5.1015 5.1015 5.1419 5.1419 5.1725 5.1725 5.3709 5.3709 5.3915 5.3915 5.5401 5.5401 5.6261 5.6261 5.7042 5.7042 5.8268 5.8268 6.0020 6.0020 6.0204 6.0204 6.1891 6.1891 6.4002 6.4002 6.4739 6.4739 6.7602 6.7602 6.8833 6.8833 6.9621 6.9621 7.0389 7.0389 7.3055 7.3055 7.6767 7.6767 7.7718 7.7718 7.8689 7.8689 8.2699 8.2699 8.2784 8.2784 8.4902 8.4902 8.5283 8.5283 8.9652 8.9652 9.6357 9.6357 9.7028 9.7028 9.8978 9.8978 11.2441 11.2441 11.5744 11.5744 11.6840 11.6840 12.3110 12.3110 12.3815 12.3815 12.4109 12.4109 12.9059 12.9059 k = 0.3828-0.0221 0.6124 ( 9787 PWs) bands (ev): -17.8367 -17.8367 -4.7066 -4.7066 -2.9566 -2.9566 -2.8919 -2.8919 -1.6014 -1.6014 -1.5080 -1.5080 -1.0302 -1.0302 -0.0108 -0.0108 0.0143 0.0143 0.2841 0.2841 1.0107 1.0107 1.2706 1.2706 1.2841 1.2841 2.3201 2.3201 2.7149 2.7149 2.8201 2.8201 3.8976 3.8976 3.9694 3.9694 4.1598 4.1598 4.4060 4.4060 4.5557 4.5557 4.5873 4.5873 5.1177 5.1177 5.1717 5.1717 5.1744 5.1744 5.3678 5.3678 5.4213 5.4213 5.5275 5.5275 5.6536 5.6536 5.7048 5.7048 5.8296 5.8296 6.0194 6.0194 6.0520 6.0520 6.1999 6.1999 6.4111 6.4111 6.4940 6.4940 6.7687 6.7687 6.9170 6.9170 6.9887 6.9887 7.0490 7.0490 7.2903 7.2903 7.6251 7.6251 7.7212 7.7212 7.8484 7.8484 8.2350 8.2350 8.2450 8.2450 8.4719 8.4719 8.5231 8.5231 8.8569 8.8569 9.5787 9.5787 9.6405 9.6405 9.8370 9.8370 11.2407 11.2407 11.5915 11.5915 11.7052 11.7052 12.2410 12.2410 12.3098 12.3098 12.3441 12.3441 12.9075 12.9075 k = 0.3906-0.0442 0.6124 ( 9787 PWs) bands (ev): -17.8366 -17.8366 -4.7070 -4.7070 -2.9533 -2.9533 -2.8931 -2.8931 -1.5931 -1.5931 -1.5057 -1.5057 -1.0023 -1.0023 -0.0715 -0.0715 -0.0426 -0.0426 0.2729 0.2729 1.0565 1.0565 1.2714 1.2714 1.2841 1.2841 2.3346 2.3346 2.7432 2.7432 2.8558 2.8558 3.9004 3.9004 3.9658 3.9658 4.1637 4.1637 4.3941 4.3941 4.5376 4.5376 4.5846 4.5846 5.1338 5.1338 5.1715 5.1715 5.1903 5.1903 5.3638 5.3638 5.4503 5.4503 5.5093 5.5093 5.6865 5.6865 5.7027 5.7027 5.8423 5.8423 6.0365 6.0365 6.0872 6.0872 6.2135 6.2135 6.4268 6.4268 6.5170 6.5170 6.7673 6.7673 6.9527 6.9527 7.0157 7.0157 7.0593 7.0593 7.2906 7.2906 7.5738 7.5738 7.6693 7.6693 7.8329 7.8329 8.1898 8.1898 8.2107 8.2107 8.4646 8.4646 8.5179 8.5179 8.7531 8.7531 9.5121 9.5121 9.5689 9.5689 9.7693 9.7693 11.2392 11.2392 11.5902 11.5902 11.7064 11.7064 12.1726 12.1726 12.2346 12.2346 12.2740 12.2740 12.9239 12.9239 k = 0.3984-0.0663 0.6124 ( 9778 PWs) bands (ev): -17.8366 -17.8366 -4.7074 -4.7074 -2.9497 -2.9497 -2.8947 -2.8947 -1.5835 -1.5835 -1.5024 -1.5024 -0.9724 -0.9724 -0.1316 -0.1316 -0.0983 -0.0983 0.2565 0.2565 1.0988 1.0988 1.2719 1.2719 1.2841 1.2841 2.3583 2.3583 2.7716 2.7716 2.8912 2.8912 3.9034 3.9034 3.9620 3.9620 4.1670 4.1670 4.3839 4.3839 4.5188 4.5188 4.5828 4.5828 5.1484 5.1484 5.1657 5.1657 5.1952 5.1952 5.3580 5.3580 5.4764 5.4764 5.4876 5.4876 5.7026 5.7026 5.7232 5.7232 5.8614 5.8614 6.0533 6.0533 6.1258 6.1258 6.2306 6.2306 6.4473 6.4473 6.5437 6.5437 6.7586 6.7586 6.9866 6.9866 7.0432 7.0432 7.0726 7.0726 7.3056 7.3056 7.5233 7.5233 7.6174 7.6174 7.8216 7.8216 8.1436 8.1436 8.1697 8.1697 8.4656 8.4656 8.5054 8.5054 8.6617 8.6617 9.4377 9.4377 9.4896 9.4896 9.6953 9.6953 11.2375 11.2375 11.5683 11.5683 11.6834 11.6834 12.1079 12.1079 12.1640 12.1640 12.2061 12.2061 12.9578 12.9578 k = 0.4062-0.0884 0.6124 ( 9784 PWs) bands (ev): -17.8366 -17.8366 -4.7079 -4.7079 -2.9459 -2.9459 -2.8965 -2.8965 -1.5726 -1.5726 -1.4982 -1.4982 -0.9405 -0.9405 -0.1903 -0.1903 -0.1524 -0.1524 0.2354 0.2354 1.1362 1.1362 1.2723 1.2723 1.2839 1.2839 2.3913 2.3913 2.8001 2.8001 2.9260 2.9260 3.9063 3.9063 3.9580 3.9580 4.1696 4.1696 4.3753 4.3753 4.4995 4.4995 4.5816 4.5816 5.1552 5.1552 5.1585 5.1585 5.1924 5.1924 5.3416 5.3416 5.4739 5.4739 5.4994 5.4994 5.7056 5.7056 5.7614 5.7614 5.8834 5.8834 6.0688 6.0688 6.1672 6.1672 6.2515 6.2515 6.4716 6.4716 6.5753 6.5753 6.7462 6.7462 7.0151 7.0151 7.0711 7.0711 7.0927 7.0927 7.3324 7.3324 7.4740 7.4740 7.5668 7.5668 7.8135 7.8135 8.0973 8.0973 8.1249 8.1249 8.4676 8.4676 8.4718 8.4718 8.6004 8.6004 9.3574 9.3574 9.4041 9.4041 9.6163 9.6163 11.2331 11.2331 11.5275 11.5275 11.6375 11.6375 12.0453 12.0453 12.1055 12.1055 12.1427 12.1427 13.0093 13.0093 k = 0.4141-0.1105 0.6124 ( 9790 PWs) bands (ev): -17.8366 -17.8366 -4.7083 -4.7083 -2.9421 -2.9421 -2.8985 -2.8985 -1.5604 -1.5604 -1.4932 -1.4932 -0.9069 -0.9069 -0.2473 -0.2473 -0.2046 -0.2046 0.2103 0.2103 1.1683 1.1683 1.2725 1.2725 1.2837 1.2837 2.4333 2.4333 2.8286 2.8286 2.9600 2.9600 3.9090 3.9090 3.9539 3.9539 4.1716 4.1716 4.3684 4.3684 4.4801 4.4801 4.5809 4.5809 5.1386 5.1386 5.1506 5.1506 5.1971 5.1971 5.3108 5.3108 5.4766 5.4766 5.5196 5.5196 5.7098 5.7098 5.7987 5.7987 5.9055 5.9055 6.0822 6.0822 6.2101 6.2101 6.2757 6.2757 6.4970 6.4970 6.6129 6.6129 6.7361 6.7361 7.0380 7.0380 7.0998 7.0998 7.1202 7.1202 7.3674 7.3674 7.4265 7.4265 7.5194 7.5194 7.8076 7.8076 8.0515 8.0515 8.0784 8.0784 8.3976 8.3976 8.4806 8.4806 8.5759 8.5759 9.2730 9.2730 9.3137 9.3137 9.5333 9.5333 11.2242 11.2242 11.4720 11.4720 11.5748 11.5748 11.9851 11.9851 12.0596 12.0596 12.0847 12.0847 13.0759 13.0759 k = 0.4219-0.1326 0.6124 ( 9790 PWs) bands (ev): -17.8366 -17.8366 -4.7087 -4.7087 -2.9382 -2.9382 -2.9006 -2.9006 -1.5472 -1.5472 -1.4875 -1.4875 -0.8719 -0.8719 -0.3021 -0.3021 -0.2544 -0.2544 0.1816 0.1816 1.1949 1.1949 1.2726 1.2726 1.2834 1.2834 2.4831 2.4831 2.8573 2.8573 2.9929 2.9929 3.9115 3.9115 3.9496 3.9496 4.1729 4.1729 4.3629 4.3629 4.4609 4.4609 4.5802 4.5802 5.0995 5.0995 5.1427 5.1427 5.2031 5.2031 5.2809 5.2809 5.4902 5.4902 5.5377 5.5377 5.7136 5.7136 5.8333 5.8333 5.9263 5.9263 6.0928 6.0928 6.2525 6.2525 6.3022 6.3022 6.5178 6.5178 6.6575 6.6575 6.7374 6.7374 7.0584 7.0584 7.1295 7.1295 7.1504 7.1504 7.3815 7.3815 7.4064 7.4064 7.4788 7.4788 7.8030 7.8030 8.0072 8.0072 8.0317 8.0317 8.3167 8.3167 8.4896 8.4896 8.5655 8.5655 9.1871 9.1871 9.2202 9.2202 9.4478 9.4478 11.2091 11.2091 11.4074 11.4074 11.5027 11.5027 11.9314 11.9314 12.0218 12.0218 12.0316 12.0316 13.1538 13.1538 k = 0.4297-0.1547 0.6124 ( 9772 PWs) bands (ev): -17.8366 -17.8366 -4.7091 -4.7091 -2.9345 -2.9345 -2.9028 -2.9028 -1.5331 -1.5331 -1.4812 -1.4812 -0.8358 -0.8358 -0.3540 -0.3540 -0.3014 -0.3014 0.1500 0.1500 1.2163 1.2163 1.2726 1.2726 1.2831 1.2831 2.5390 2.5390 2.8865 2.8865 3.0243 3.0243 3.9137 3.9137 3.9453 3.9453 4.1735 4.1735 4.3587 4.3587 4.4421 4.4421 4.5792 4.5792 5.0434 5.0434 5.1351 5.1351 5.1945 5.1945 5.2730 5.2730 5.5078 5.5078 5.5540 5.5540 5.7155 5.7155 5.8644 5.8644 5.9445 5.9445 6.1007 6.1007 6.2923 6.2923 6.3292 6.3292 6.5267 6.5267 6.7093 6.7093 6.7595 6.7595 7.0793 7.0793 7.1607 7.1607 7.1780 7.1780 7.3399 7.3399 7.4264 7.4264 7.4695 7.4695 7.7979 7.7979 7.9655 7.9655 7.9861 7.9861 8.2373 8.2373 8.4962 8.4962 8.5546 8.5546 9.1029 9.1029 9.1255 9.1255 9.3613 9.3613 11.1874 11.1874 11.3386 11.3386 11.4274 11.4274 11.8870 11.8870 11.9834 11.9834 11.9886 11.9886 13.2385 13.2385 k = 0.4375-0.1768 0.6124 ( 9778 PWs) bands (ev): -17.8366 -17.8366 -4.7095 -4.7095 -2.9308 -2.9308 -2.9049 -2.9049 -1.5185 -1.5185 -1.4745 -1.4745 -0.7993 -0.7993 -0.4025 -0.4025 -0.3451 -0.3451 0.1160 0.1160 1.2332 1.2332 1.2726 1.2726 1.2829 1.2829 2.5984 2.5984 2.9168 2.9168 3.0538 3.0538 3.9156 3.9156 3.9410 3.9410 4.1734 4.1734 4.3557 4.3557 4.4240 4.4240 4.5773 4.5773 4.9754 4.9754 5.1280 5.1280 5.1753 5.1753 5.2851 5.2851 5.5260 5.5260 5.5688 5.5688 5.7145 5.7145 5.8916 5.8916 5.9596 5.9596 6.1064 6.1064 6.3282 6.3282 6.3553 6.3553 6.5225 6.5225 6.7667 6.7667 6.8038 6.8038 7.1016 7.1016 7.1935 7.1935 7.1975 7.1975 7.3035 7.3035 7.4120 7.4120 7.5103 7.5103 7.7905 7.7905 7.9284 7.9284 7.9424 7.9424 8.1633 8.1633 8.4972 8.4972 8.5357 8.5357 9.0246 9.0246 9.0329 9.0329 9.2752 9.2752 11.1596 11.1596 11.2696 11.2696 11.3534 11.3534 11.8521 11.8521 11.9397 11.9397 11.9589 11.9589 13.3258 13.3259 k = 0.4453-0.1989 0.6124 ( 9778 PWs) bands (ev): -17.8366 -17.8366 -4.7099 -4.7099 -2.9274 -2.9274 -2.9069 -2.9069 -1.5037 -1.5037 -1.4676 -1.4676 -0.7631 -0.7631 -0.4466 -0.4466 -0.3852 -0.3852 0.0805 0.0805 1.2460 1.2460 1.2726 1.2726 1.2826 1.2826 2.6580 2.6580 2.9493 2.9493 3.0812 3.0812 3.9171 3.9171 3.9368 3.9368 4.1726 4.1726 4.3536 4.3536 4.4071 4.4071 4.5736 4.5736 4.9022 4.9022 5.1217 5.1217 5.1563 5.1563 5.3046 5.3046 5.5433 5.5433 5.5822 5.5822 5.7100 5.7100 5.9151 5.9151 5.9713 5.9713 6.1110 6.1110 6.3591 6.3591 6.3795 6.3795 6.5109 6.5109 6.8263 6.8263 6.8619 6.8619 7.1257 7.1257 7.2062 7.2062 7.2243 7.2243 7.2789 7.2789 7.4095 7.4095 7.5579 7.5579 7.7784 7.7784 7.8978 7.8978 7.9017 7.9017 8.0969 8.0969 8.4874 8.4874 8.5025 8.5025 8.9475 8.9475 8.9577 8.9577 9.1913 9.1913 11.1272 11.1272 11.2036 11.2036 11.2837 11.2837 11.8261 11.8261 11.9007 11.9007 11.9325 11.9325 13.4115 13.4115 k = 0.4531-0.2210 0.6124 ( 9772 PWs) bands (ev): -17.8365 -17.8365 -4.7103 -4.7103 -2.9242 -2.9242 -2.9088 -2.9088 -1.4891 -1.4891 -1.4609 -1.4609 -0.7285 -0.7285 -0.4852 -0.4852 -0.4212 -0.4212 0.0442 0.0442 1.2554 1.2554 1.2730 1.2730 1.2823 1.2823 2.7140 2.7140 2.9851 2.9851 3.1060 3.1060 3.9183 3.9183 3.9328 3.9328 4.1711 4.1711 4.3521 4.3521 4.3916 4.3916 4.5664 4.5664 4.8303 4.8303 5.1161 5.1161 5.1401 5.1401 5.3271 5.3271 5.5589 5.5589 5.5943 5.5943 5.7017 5.7017 5.9350 5.9350 5.9794 5.9794 6.1153 6.1153 6.3853 6.3853 6.4015 6.4015 6.4972 6.4972 6.8828 6.8828 6.9223 6.9223 7.1497 7.1497 7.2112 7.2112 7.2274 7.2274 7.2953 7.2953 7.4238 7.4238 7.6039 7.6039 7.7615 7.7615 7.8652 7.8652 7.8748 7.8748 8.0396 8.0396 8.4505 8.4505 8.4600 8.4600 8.8761 8.8761 8.9064 8.9064 9.1118 9.1118 11.0925 11.0925 11.1428 11.1428 11.2207 11.2207 11.8072 11.8072 11.8666 11.8666 11.9093 11.9093 13.4907 13.4909 k = 0.4609-0.2431 0.6124 ( 9769 PWs) bands (ev): -17.8365 -17.8365 -4.7106 -4.7106 -2.9214 -2.9214 -2.9105 -2.9105 -1.4753 -1.4753 -1.4544 -1.4544 -0.6976 -0.6976 -0.5164 -0.5164 -0.4527 -0.4527 0.0083 0.0083 1.2617 1.2617 1.2739 1.2739 1.2821 1.2821 2.7627 2.7627 3.0250 3.0250 3.1279 3.1279 3.9190 3.9190 3.9290 3.9290 4.1690 4.1690 4.3509 4.3509 4.3778 4.3778 4.5532 4.5532 4.7664 4.7664 5.1114 5.1114 5.1271 5.1271 5.3508 5.3508 5.5722 5.5722 5.6048 5.6048 5.6898 5.6898 5.9515 5.9515 5.9844 5.9844 6.1199 6.1199 6.4069 6.4069 6.4209 6.4209 6.4844 6.4844 6.9299 6.9299 6.9711 6.9711 7.1670 7.1670 7.2141 7.2141 7.2336 7.2336 7.3447 7.3447 7.4496 7.4496 7.6405 7.6405 7.7467 7.7467 7.8348 7.8348 7.8567 7.8567 7.9937 7.9937 8.3793 8.3793 8.4089 8.4089 8.8253 8.8253 8.8703 8.8703 9.0395 9.0395 11.0578 11.0578 11.0889 11.0889 11.1660 11.1660 11.7938 11.7938 11.8373 11.8373 11.8898 11.8898 13.5570 13.5582 k = 0.4688-0.2652 0.6124 ( 9757 PWs) bands (ev): -17.8365 -17.8365 -4.7108 -4.7108 -2.9191 -2.9191 -2.9119 -2.9119 -1.4627 -1.4627 -1.4486 -1.4486 -0.6740 -0.6740 -0.5370 -0.5370 -0.4792 -0.4792 -0.0259 -0.0259 1.2651 1.2651 1.2758 1.2758 1.2819 1.2819 2.8015 2.8015 3.0680 3.0680 3.1464 3.1464 3.9194 3.9194 3.9257 3.9257 4.1663 4.1663 4.3498 4.3498 4.3661 4.3661 4.5315 4.5315 4.7172 4.7172 5.1075 5.1075 5.1170 5.1170 5.3749 5.3749 5.5830 5.5830 5.6138 5.6138 5.6749 5.6749 5.9648 5.9648 5.9870 5.9870 6.1248 6.1248 6.4242 6.4242 6.4376 6.4376 6.4739 6.4739 6.9629 6.9629 6.9972 6.9972 7.1787 7.1787 7.2065 7.2065 7.2835 7.2835 7.4057 7.4057 7.4819 7.4819 7.6520 7.6520 7.7499 7.7499 7.8132 7.8132 7.8408 7.8408 7.9611 7.9611 8.2936 8.2936 8.3344 8.3344 8.7953 8.7953 8.8440 8.8440 8.9785 8.9785 11.0255 11.0255 11.0433 11.0433 11.1206 11.1206 11.7843 11.7843 11.8132 11.8132 11.8739 11.8739 13.6033 13.6049 k = 0.4766-0.2873 0.6124 ( 9751 PWs) bands (ev): -17.8365 -17.8365 -4.7110 -4.7110 -2.9172 -2.9172 -2.9131 -2.9131 -1.4520 -1.4520 -1.4438 -1.4438 -0.6619 -0.6619 -0.5438 -0.5438 -0.5003 -0.5003 -0.0567 -0.0567 1.2666 1.2666 1.2781 1.2781 1.2818 1.2818 2.8299 2.8299 3.1105 3.1105 3.1613 3.1613 3.9194 3.9194 3.9229 3.9229 4.1631 4.1631 4.3485 4.3485 4.3567 4.3567 4.5023 4.5023 4.6858 4.6858 5.1045 5.1045 5.1096 5.1096 5.3982 5.3982 5.5910 5.5910 5.6209 5.6209 5.6586 5.6586 5.9750 5.9750 5.9880 5.9880 6.1294 6.1294 6.4376 6.4376 6.4509 6.4509 6.4663 6.4663 6.9815 6.9815 7.0031 7.0031 7.1916 7.1916 7.2062 7.2062 7.3489 7.3489 7.4703 7.4703 7.5172 7.5172 7.6383 7.6383 7.7667 7.7667 7.8062 7.8062 7.8330 7.8330 7.9411 7.9411 8.1997 8.1997 8.2433 8.2433 8.7802 8.7802 8.8203 8.8203 8.9339 8.9339 10.9978 10.9978 11.0068 11.0068 11.0851 11.0851 11.7777 11.7777 11.7943 11.7943 11.8618 11.8618 13.6340 13.6400 k = 0.4844-0.3094 0.6124 ( 9715 PWs) bands (ev): -17.8365 -17.8365 -4.7112 -4.7112 -2.9158 -2.9158 -2.9140 -2.9140 -1.4438 -1.4438 -1.4400 -1.4400 -0.6606 -0.6606 -0.5391 -0.5391 -0.5156 -0.5156 -0.0817 -0.0817 1.2671 1.2671 1.2800 1.2800 1.2817 1.2817 2.8490 2.8490 3.1472 3.1472 3.1722 3.1722 3.9193 3.9193 3.9207 3.9207 4.1598 4.1598 4.3468 4.3468 4.3498 4.3498 4.4733 4.4733 4.6686 4.6686 5.1023 5.1023 5.1045 5.1045 5.4188 5.4188 5.5955 5.5955 5.6261 5.6261 5.6437 5.6437 5.9823 5.9823 5.9882 5.9882 6.1333 6.1333 6.4471 6.4471 6.4573 6.4573 6.4647 6.4647 6.9896 6.9896 6.9995 6.9995 7.2040 7.2040 7.2101 7.2101 7.4145 7.4145 7.5262 7.5262 7.5513 7.5513 7.6178 7.6178 7.7720 7.7720 7.8227 7.8227 7.8473 7.8473 7.9305 7.9305 8.1045 8.1045 8.1439 8.1439 8.7736 8.7736 8.7965 8.7965 8.9079 8.9079 10.9765 10.9765 10.9802 10.9802 11.0597 11.0597 11.7733 11.7733 11.7808 11.7808 11.8533 11.8533 13.6541 13.6555 k = 0.4922-0.3315 0.6124 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9149 -2.9149 -2.9145 -2.9145 -1.4387 -1.4387 -1.4377 -1.4377 -0.6633 -0.6633 -0.5314 -0.5314 -0.5249 -0.5249 -0.0982 -0.0982 1.2673 1.2673 1.2812 1.2812 1.2816 1.2816 2.8598 2.8598 3.1722 3.1722 3.1788 3.1788 3.9190 3.9190 3.9194 3.9194 4.1571 4.1571 4.3450 4.3450 4.3456 4.3456 4.4528 4.4528 4.6604 4.6604 5.1010 5.1010 5.1016 5.1016 5.4337 5.4337 5.5965 5.5965 5.6293 5.6293 5.6337 5.6337 5.9867 5.9867 5.9881 5.9881 6.1358 6.1358 6.4529 6.4529 6.4557 6.4557 6.4696 6.4696 6.9922 6.9922 6.9946 6.9946 7.2128 7.2128 7.2142 7.2142 7.4661 7.4661 7.5610 7.5610 7.5724 7.5724 7.6029 7.6029 7.7732 7.7732 7.8713 7.8713 7.8774 7.8774 7.9273 7.9273 8.0166 8.0166 8.0433 8.0433 8.7711 8.7711 8.7776 8.7776 8.8960 8.8960 10.9632 10.9632 10.9641 10.9641 11.0445 11.0445 11.7708 11.7708 11.7727 11.7727 11.8484 11.8484 13.6648 13.6651 k = 0.5000-0.3536 0.6124 ( 9688 PWs) bands (ev): -17.8365 -17.8365 -4.7113 -4.7113 -2.9147 -2.9147 -2.9146 -2.9146 -1.4370 -1.4370 -1.4369 -1.4369 -0.6647 -0.6647 -0.5281 -0.5281 -0.5281 -0.5281 -0.1041 -0.1041 1.2673 1.2673 1.2816 1.2816 1.2816 1.2816 2.8633 2.8633 3.1811 3.1811 3.1811 3.1811 3.9189 3.9189 3.9190 3.9190 4.1561 4.1561 4.3442 4.3442 4.3442 4.3442 4.4456 4.4456 4.6580 4.6580 5.1006 5.1006 5.1006 5.1006 5.4393 5.4393 5.5960 5.5960 5.6304 5.6304 5.6304 5.6304 5.9881 5.9881 5.9881 5.9881 6.1367 6.1367 6.4548 6.4548 6.4548 6.4548 6.4716 6.4716 6.9926 6.9926 6.9926 6.9926 7.2159 7.2159 7.2159 7.2159 7.4878 7.4878 7.5719 7.5719 7.5719 7.5719 7.6027 7.6027 7.7757 7.7757 7.8995 7.8995 7.9432 7.9432 7.9433 7.9433 7.9546 7.9546 7.9546 7.9546 8.7705 8.7705 8.7705 8.7705 8.8927 8.8927 10.9586 10.9586 10.9587 10.9587 11.0394 11.0394 11.7699 11.7699 11.7700 11.7700 11.8468 11.8468 13.6678 13.6679 k = 0.2500 0.3536 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9396 -2.9396 -2.9396 -2.9396 -1.5373 -1.5373 -1.3613 -1.3613 -1.3613 -1.3613 -0.1642 -0.1642 0.6878 0.6878 0.6994 0.6994 0.6995 0.6995 1.2267 1.2267 1.2268 1.2268 2.4581 2.4581 2.4821 2.4821 2.4822 2.4822 3.9532 3.9532 3.9533 3.9533 3.9887 3.9887 4.6193 4.6193 4.6193 4.6193 4.6388 4.6388 4.9527 4.9527 4.9527 4.9527 5.0394 5.0394 5.1966 5.1966 5.1967 5.1967 5.3211 5.3211 5.6264 5.6264 5.6264 5.6264 5.8975 5.8975 5.9403 5.9403 5.9403 5.9403 6.2241 6.2241 6.2869 6.2869 6.2870 6.2870 6.5214 6.5214 6.6277 6.6277 6.6278 6.6278 6.9451 6.9451 8.1741 8.1741 8.1741 8.1741 8.2156 8.2156 8.5104 8.5104 8.5104 8.5104 8.6827 8.6827 8.7072 8.7072 8.7073 8.7073 9.1090 9.1090 9.3580 9.3580 9.3580 9.3580 10.6667 10.6667 12.0968 12.0968 12.0968 12.0968 12.1064 12.1064 12.2054 12.2054 12.2054 12.2054 12.2437 12.2437 12.3028 12.3028 k = 0.2368 0.3349 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9445 -2.9445 -2.9345 -2.9345 -1.5421 -1.5421 -1.3791 -1.3791 -1.3391 -1.3391 -0.1605 -0.1605 0.6854 0.6854 0.6967 0.6967 0.6989 0.6989 1.2261 1.2261 1.2291 1.2291 2.4571 2.4571 2.4805 2.4805 2.4841 2.4841 3.9481 3.9481 3.9564 3.9564 3.9922 3.9922 4.6137 4.6137 4.6247 4.6247 4.6390 4.6390 4.9486 4.9486 4.9540 4.9540 5.0367 5.0367 5.1893 5.1893 5.2088 5.2088 5.3233 5.3233 5.6187 5.6187 5.6353 5.6353 5.8937 5.8937 5.9341 5.9341 5.9481 5.9481 6.2178 6.2178 6.2863 6.2863 6.2947 6.2947 6.5202 6.5202 6.6200 6.6200 6.6399 6.6399 6.9476 6.9476 8.1404 8.1404 8.1925 8.1925 8.2143 8.2143 8.4849 8.4849 8.5238 8.5238 8.6752 8.6752 8.7040 8.7040 8.7364 8.7364 9.1123 9.1123 9.3552 9.3552 9.3657 9.3657 10.6646 10.6646 12.0154 12.0154 12.0960 12.0960 12.1255 12.1255 12.1478 12.1478 12.2099 12.2099 12.2466 12.2466 12.2860 12.2860 k = 0.2237 0.3163 0.6124 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.7051 -4.7051 -2.9493 -2.9493 -2.9291 -2.9291 -1.5548 -1.5548 -1.3949 -1.3949 -1.3113 -1.3113 -0.1497 -0.1497 0.6759 0.6759 0.6906 0.6906 0.6978 0.6978 1.2252 1.2252 1.2348 1.2348 2.4539 2.4539 2.4771 2.4771 2.4883 2.4883 3.9417 3.9417 3.9592 3.9592 4.0006 4.0006 4.6075 4.6075 4.6298 4.6298 4.6400 4.6400 4.9375 4.9375 4.9569 4.9569 5.0308 5.0308 5.1850 5.1850 5.2246 5.2246 5.3298 5.3298 5.6129 5.6129 5.6448 5.6448 5.8832 5.8832 5.9310 5.9310 5.9556 5.9556 6.2034 6.2034 6.2881 6.2881 6.3091 6.3091 6.5175 6.5175 6.6166 6.6166 6.6556 6.6556 6.9549 6.9549 8.0985 8.0985 8.1831 8.1831 8.2168 8.2168 8.4465 8.4465 8.5318 8.5318 8.6705 8.6705 8.7175 8.7175 8.7761 8.7761 9.1219 9.1219 9.3561 9.3561 9.3792 9.3792 10.6581 10.6581 11.8806 11.8806 12.0539 12.0539 12.1134 12.1134 12.1374 12.1374 12.2128 12.2128 12.2553 12.2553 12.3117 12.3117 k = 0.2105 0.2977 0.6124 ( 9794 PWs) bands (ev): -17.8368 -17.8368 -4.7050 -4.7050 -2.9538 -2.9538 -2.9236 -2.9236 -1.5724 -1.5724 -1.4114 -1.4114 -1.2782 -1.2782 -0.1322 -0.1322 0.6571 0.6571 0.6830 0.6830 0.6974 0.6974 1.2238 1.2238 1.2435 1.2435 2.4482 2.4482 2.4726 2.4726 2.4945 2.4945 3.9358 3.9358 3.9626 3.9626 4.0111 4.0111 4.5998 4.5998 4.6338 4.6338 4.6429 4.6429 4.9211 4.9211 4.9611 4.9611 5.0252 5.0252 5.1823 5.1823 5.2404 5.2404 5.3411 5.3411 5.6093 5.6093 5.6541 5.6541 5.8687 5.8687 5.9302 5.9302 5.9621 5.9621 6.1860 6.1860 6.2912 6.2912 6.3250 6.3250 6.5157 6.5157 6.6172 6.6172 6.6736 6.6736 6.9669 6.9669 8.0520 8.0520 8.1581 8.1581 8.2116 8.2116 8.4004 8.4004 8.5384 8.5384 8.6765 8.6765 8.7346 8.7346 8.8184 8.8184 9.1372 9.1372 9.3609 9.3609 9.3985 9.3985 10.6468 10.6468 11.7363 11.7363 11.9990 11.9990 12.1112 12.1112 12.1320 12.1320 12.2079 12.2079 12.2655 12.2655 12.3530 12.3530 k = 0.1974 0.2791 0.6124 ( 9800 PWs) bands (ev): -17.8368 -17.8368 -4.7049 -4.7049 -2.9582 -2.9582 -2.9179 -2.9179 -1.5923 -1.5923 -1.4297 -1.4297 -1.2407 -1.2407 -0.1087 -0.1087 0.6303 0.6303 0.6739 0.6739 0.6974 0.6974 1.2219 1.2219 1.2547 1.2547 2.4393 2.4393 2.4680 2.4680 2.5021 2.5021 3.9316 3.9316 3.9670 3.9670 4.0222 4.0222 4.5897 4.5897 4.6371 4.6371 4.6474 4.6474 4.9022 4.9022 4.9656 4.9656 5.0221 5.0221 5.1802 5.1802 5.2535 5.2535 5.3566 5.3566 5.6084 5.6084 5.6623 5.6623 5.8533 5.8533 5.9303 5.9303 5.9677 5.9677 6.1677 6.1677 6.2954 6.2954 6.3385 6.3385 6.5176 6.5176 6.6210 6.6210 6.6926 6.6926 6.9832 6.9832 8.0033 8.0033 8.1262 8.1262 8.1943 8.1943 8.3517 8.3517 8.5435 8.5435 8.6906 8.6906 8.7516 8.7516 8.8593 8.8593 9.1577 9.1577 9.3701 9.3701 9.4222 9.4222 10.6299 10.6299 11.6002 11.6002 11.9448 11.9448 12.1090 12.1090 12.1284 12.1284 12.1994 12.1994 12.2742 12.2742 12.3871 12.3871 k = 0.1842 0.2605 0.6124 ( 9794 PWs) bands (ev): -17.8368 -17.8368 -4.7048 -4.7048 -2.9624 -2.9624 -2.9121 -2.9121 -1.6126 -1.6126 -1.4501 -1.4501 -1.1996 -1.1996 -0.0800 -0.0800 0.5964 0.5964 0.6641 0.6641 0.6978 0.6978 1.2194 1.2194 1.2673 1.2673 2.4270 2.4270 2.4641 2.4641 2.5106 2.5106 3.9298 3.9298 3.9724 3.9724 4.0333 4.0333 4.5765 4.5765 4.6409 4.6409 4.6524 4.6524 4.8838 4.8838 4.9686 4.9686 5.0221 5.0221 5.1787 5.1787 5.2633 5.2633 5.3743 5.3743 5.6101 5.6101 5.6681 5.6681 5.8397 5.8397 5.9305 5.9305 5.9727 5.9727 6.1494 6.1494 6.3002 6.3002 6.3473 6.3473 6.5258 6.5258 6.6276 6.6276 6.7115 6.7115 7.0034 7.0034 7.9545 7.9545 8.0906 8.0906 8.1678 8.1678 8.3035 8.3035 8.5451 8.5451 8.7080 8.7080 8.7686 8.7686 8.8969 8.8969 9.1818 9.1818 9.3839 9.3839 9.4484 9.4484 10.6069 10.6069 11.4789 11.4789 11.8926 11.8926 12.1055 12.1055 12.1272 12.1272 12.1905 12.1905 12.2824 12.2824 12.4102 12.4102 k = 0.1711 0.2419 0.6124 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7046 -4.7046 -2.9664 -2.9664 -2.9061 -2.9061 -1.6325 -1.6325 -1.4724 -1.4724 -1.1556 -1.1556 -0.0474 -0.0474 0.5563 0.5563 0.6543 0.6543 0.6984 0.6984 1.2162 1.2162 1.2803 1.2803 2.4117 2.4117 2.4609 2.4609 2.5195 2.5195 3.9308 3.9308 3.9788 3.9788 4.0441 4.0441 4.5603 4.5603 4.6458 4.6458 4.6572 4.6572 4.8677 4.8677 4.9687 4.9687 5.0255 5.0255 5.1779 5.1779 5.2702 5.2702 5.3916 5.3916 5.6139 5.6139 5.6711 5.6711 5.8306 5.8306 5.9298 5.9298 5.9778 5.9778 6.1317 6.1317 6.3048 6.3048 6.3508 6.3508 6.5411 6.5411 6.6367 6.6367 6.7290 6.7290 7.0268 7.0268 7.9075 7.9075 8.0530 8.0530 8.1355 8.1355 8.2575 8.2575 8.5416 8.5416 8.7218 8.7218 8.7891 8.7891 8.9317 8.9317 9.2057 9.2057 9.4024 9.4024 9.4753 9.4753 10.5770 10.5770 11.3770 11.3770 11.8434 11.8434 12.1018 12.1018 12.1252 12.1252 12.1838 12.1838 12.2910 12.2910 12.4255 12.4255 k = 0.1579 0.2233 0.6124 ( 9780 PWs) bands (ev): -17.8368 -17.8368 -4.7044 -4.7044 -2.9702 -2.9702 -2.9000 -2.9000 -1.6513 -1.6513 -1.4961 -1.4961 -1.1090 -1.1090 -0.0120 -0.0120 0.5110 0.5110 0.6455 0.6455 0.6991 0.6991 1.2123 1.2123 1.2928 1.2928 2.3944 2.3944 2.4582 2.4582 2.5283 2.5283 3.9347 3.9347 3.9861 3.9861 4.0546 4.0546 4.5416 4.5416 4.6516 4.6516 4.6619 4.6619 4.8547 4.8547 4.9659 4.9659 5.0307 5.0307 5.1781 5.1781 5.2751 5.2751 5.4063 5.4063 5.6180 5.6180 5.6728 5.6728 5.8275 5.8275 5.9280 5.9280 5.9834 5.9834 6.1155 6.1155 6.3072 6.3072 6.3515 6.3515 6.5627 6.5627 6.6479 6.6479 6.7442 6.7442 7.0523 7.0523 7.8642 7.8642 8.0150 8.0150 8.1008 8.1008 8.2140 8.2140 8.5333 8.5333 8.7270 8.7270 8.8156 8.8156 8.9653 8.9653 9.2219 9.2219 9.4272 9.4272 9.5020 9.5020 10.5402 10.5402 11.2981 11.2981 11.7982 11.7982 12.0984 12.0984 12.1199 12.1199 12.1815 12.1815 12.3003 12.3003 12.4340 12.4340 k = 0.1447 0.2047 0.6124 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7042 -4.7042 -2.9738 -2.9738 -2.8939 -2.8939 -1.6687 -1.6687 -1.5207 -1.5207 -1.0602 -1.0602 0.0250 0.0250 0.4613 0.4613 0.6388 0.6388 0.6999 0.6999 1.2076 1.2076 1.3040 1.3040 2.3758 2.3758 2.4559 2.4559 2.5366 2.5366 3.9412 3.9412 3.9941 3.9941 4.0647 4.0647 4.5210 4.5210 4.6579 4.6579 4.6670 4.6670 4.8448 4.8448 4.9608 4.9608 5.0357 5.0357 5.1792 5.1792 5.2784 5.2784 5.4165 5.4165 5.6201 5.6201 5.6774 5.6774 5.8301 5.8301 5.9249 5.9249 5.9892 5.9892 6.1017 6.1017 6.3050 6.3050 6.3531 6.3531 6.5885 6.5885 6.6610 6.6610 6.7566 6.7566 7.0788 7.0788 7.8262 7.8262 7.9777 7.9777 8.0659 8.0659 8.1730 8.1730 8.5211 8.5211 8.7252 8.7252 8.8457 8.8457 8.9983 8.9983 9.2230 9.2230 9.4604 9.4604 9.5282 9.5282 10.4963 10.4963 11.2440 11.2440 11.7575 11.7575 12.0950 12.0950 12.1115 12.1115 12.1832 12.1832 12.3109 12.3109 12.4376 12.4376 k = 0.1316 0.1861 0.6124 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7040 -4.7040 -2.9772 -2.9772 -2.8878 -2.8878 -1.6845 -1.6845 -1.5455 -1.5455 -1.0096 -1.0096 0.0621 0.0621 0.4079 0.4079 0.6351 0.6351 0.7008 0.7008 1.2018 1.2018 1.3131 1.3131 2.3567 2.3567 2.4540 2.4540 2.5441 2.5441 3.9501 3.9501 4.0028 4.0028 4.0748 4.0748 4.4995 4.4995 4.6637 4.6637 4.6737 4.6737 4.8376 4.8376 4.9541 4.9541 5.0386 5.0386 5.1813 5.1813 5.2802 5.2802 5.4198 5.4198 5.6210 5.6210 5.6875 5.6875 5.8366 5.8366 5.9205 5.9205 5.9947 5.9947 6.0918 6.0918 6.2971 6.2971 6.3578 6.3578 6.6165 6.6165 6.6757 6.6757 6.7657 6.7657 7.1048 7.1048 7.7952 7.7952 7.9422 7.9422 8.0325 8.0325 8.1346 8.1346 8.5065 8.5065 8.7209 8.7209 8.8743 8.8743 9.0289 9.0289 9.2079 9.2079 9.5018 9.5018 9.5536 9.5536 10.4458 10.4458 11.2149 11.2149 11.7213 11.7213 12.0899 12.0899 12.1034 12.1034 12.1864 12.1864 12.3229 12.3229 12.4393 12.4393 k = 0.1184 0.1675 0.6124 ( 9788 PWs) bands (ev): -17.8368 -17.8368 -4.7038 -4.7038 -2.9804 -2.9804 -2.8819 -2.8819 -1.6986 -1.6986 -1.5700 -1.5700 -0.9575 -0.9575 0.0979 0.0979 0.3518 0.3518 0.6355 0.6355 0.7019 0.7019 1.1949 1.1949 1.3195 1.3195 2.3380 2.3380 2.4524 2.4524 2.5504 2.5504 3.9606 3.9606 4.0121 4.0121 4.0850 4.0850 4.4780 4.4780 4.6690 4.6690 4.6824 4.6824 4.8324 4.8324 4.9465 4.9465 5.0385 5.0385 5.1837 5.1837 5.2805 5.2805 5.4146 5.4146 5.6250 5.6250 5.7023 5.7023 5.8448 5.8448 5.9153 5.9153 5.9988 5.9988 6.0872 6.0872 6.2851 6.2851 6.3647 6.3647 6.6442 6.6442 6.6920 6.6920 6.7719 6.7719 7.1289 7.1289 7.7725 7.7725 7.9095 7.9095 8.0015 8.0015 8.0986 8.0986 8.4906 8.4906 8.7177 8.7177 8.8946 8.8946 9.0501 9.0501 9.1890 9.1890 9.5482 9.5482 9.5781 9.5781 10.3894 10.3894 11.2086 11.2086 11.6898 11.6898 12.0820 12.0820 12.0986 12.0986 12.1880 12.1880 12.3369 12.3369 12.4430 12.4430 k = 0.1053 0.1489 0.6124 ( 9792 PWs) bands (ev): -17.8368 -17.8368 -4.7036 -4.7036 -2.9833 -2.9833 -2.8761 -2.8761 -1.7109 -1.7109 -1.5938 -1.5938 -0.9043 -0.9043 0.1308 0.1308 0.2939 0.2939 0.6408 0.6408 0.7032 0.7032 1.1864 1.1864 1.3231 1.3231 2.3202 2.3202 2.4511 2.4511 2.5555 2.5555 3.9717 3.9717 4.0217 4.0217 4.0957 4.0957 4.4571 4.4571 4.6746 4.6746 4.6924 4.6924 4.8288 4.8288 4.9382 4.9382 5.0353 5.0353 5.1859 5.1859 5.2794 5.2794 5.4008 5.4008 5.6351 5.6351 5.7199 5.7199 5.8526 5.8526 5.9096 5.9096 6.0009 6.0009 6.0888 6.0888 6.2711 6.2711 6.3722 6.3722 6.6689 6.6689 6.7093 6.7093 6.7771 6.7771 7.1496 7.1496 7.7592 7.7592 7.8803 7.8803 7.9734 7.9734 8.0653 8.0653 8.4745 8.4745 8.7176 8.7176 8.8943 8.8943 9.0539 9.0539 9.1891 9.1891 9.5949 9.5949 9.6018 9.6018 10.3283 10.3283 11.2210 11.2210 11.6624 11.6624 12.0732 12.0732 12.0962 12.0962 12.1861 12.1861 12.3539 12.3539 12.4523 12.4523 k = 0.0921 0.1303 0.6124 ( 9802 PWs) bands (ev): -17.8368 -17.8368 -4.7035 -4.7035 -2.9859 -2.9859 -2.8707 -2.8707 -1.7213 -1.7213 -1.6163 -1.6163 -0.8505 -0.8505 0.1594 0.1594 0.2354 0.2354 0.6514 0.6514 0.7050 0.7050 1.1760 1.1760 1.3238 1.3238 2.3041 2.3041 2.4502 2.4502 2.5594 2.5594 3.9825 3.9825 4.0312 4.0312 4.1074 4.1074 4.4374 4.4374 4.6814 4.6814 4.7035 4.7035 4.8262 4.8262 4.9295 4.9295 5.0289 5.0289 5.1875 5.1875 5.2768 5.2768 5.3809 5.3809 5.6509 5.6509 5.7389 5.7389 5.8583 5.8583 5.9043 5.9043 6.0018 6.0018 6.0961 6.0961 6.2567 6.2567 6.3790 6.3790 6.6886 6.6886 6.7240 6.7240 6.7862 6.7862 7.1656 7.1656 7.7561 7.7561 7.8549 7.8549 7.9489 7.9489 8.0352 8.0352 8.4591 8.4591 8.7195 8.7195 8.8606 8.8606 9.0543 9.0543 9.2127 9.2127 9.6206 9.6206 9.6427 9.6427 10.2641 10.2641 11.2472 11.2472 11.6390 11.6390 12.0649 12.0649 12.0957 12.0957 12.1806 12.1806 12.3745 12.3745 12.4695 12.4695 k = 0.0789 0.1116 0.6124 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.7033 -4.7033 -2.9883 -2.9883 -2.8657 -2.8657 -1.7299 -1.7299 -1.6372 -1.6372 -0.7968 -0.7968 0.1693 0.1693 0.1908 0.1908 0.6665 0.6665 0.7080 0.7080 1.1635 1.1635 1.3222 1.3222 2.2900 2.2900 2.4496 2.4496 2.5622 2.5622 3.9924 3.9924 4.0403 4.0403 4.1201 4.1201 4.4192 4.4192 4.6895 4.6895 4.7152 4.7152 4.8242 4.8242 4.9206 4.9206 5.0199 5.0199 5.1878 5.1878 5.2730 5.2730 5.3585 5.3585 5.6702 5.6702 5.7583 5.7583 5.8602 5.8602 5.9001 5.9001 6.0032 6.0032 6.1064 6.1064 6.2437 6.2437 6.3841 6.3841 6.7025 6.7025 6.7309 6.7309 6.8046 6.8046 7.1760 7.1760 7.7631 7.7631 7.8336 7.8336 7.9287 7.9287 8.0091 8.0091 8.4450 8.4450 8.7101 8.7101 8.8107 8.8107 9.0639 9.0639 9.2463 9.2463 9.6382 9.6382 9.6855 9.6855 10.1986 10.1986 11.2817 11.2817 11.6190 11.6190 12.0565 12.0565 12.0990 12.0990 12.1732 12.1732 12.3986 12.3986 12.4949 12.4949 k = 0.0658 0.0930 0.6124 ( 9798 PWs) bands (ev): -17.8368 -17.8368 -4.7031 -4.7031 -2.9903 -2.9903 -2.8612 -2.8612 -1.7365 -1.7365 -1.6561 -1.6561 -0.7442 -0.7442 0.1163 0.1163 0.2053 0.2053 0.6828 0.6828 0.7149 0.7149 1.1485 1.1485 1.3188 1.3188 2.2782 2.2782 2.4494 2.4494 2.5640 2.5640 4.0008 4.0008 4.0482 4.0482 4.1340 4.1340 4.4027 4.4027 4.6992 4.6992 4.7274 4.7274 4.8223 4.8223 4.9120 4.9120 5.0084 5.0084 5.1866 5.1866 5.2683 5.2683 5.3367 5.3367 5.6908 5.6908 5.7770 5.7770 5.8577 5.8577 5.8975 5.8975 6.0064 6.0064 6.1165 6.1165 6.2343 6.2343 6.3867 6.3867 6.7084 6.7084 6.7341 6.7341 6.8304 6.8304 7.1804 7.1804 7.7783 7.7783 7.8165 7.8165 7.9140 7.9140 7.9887 7.9887 8.4324 8.4324 8.6530 8.6530 8.7959 8.7959 9.0778 9.0778 9.2817 9.2817 9.6524 9.6524 9.7240 9.7240 10.1340 10.1340 11.3196 11.3196 11.6023 11.6023 12.0468 12.0468 12.1085 12.1085 12.1663 12.1663 12.4241 12.4241 12.5272 12.5272 k = 0.0526 0.0744 0.6124 ( 9796 PWs) bands (ev): -17.8368 -17.8368 -4.7030 -4.7030 -2.9920 -2.9920 -2.8573 -2.8573 -1.7413 -1.7413 -1.6727 -1.6727 -0.6940 -0.6940 0.0620 0.0620 0.2193 0.2193 0.6933 0.6933 0.7311 0.7311 1.1313 1.1313 1.3147 1.3147 2.2688 2.2688 2.4493 2.4493 2.5650 2.5650 4.0076 4.0076 4.0545 4.0545 4.1482 4.1482 4.3883 4.3883 4.7100 4.7100 4.7402 4.7402 4.8200 4.8200 4.9041 4.9041 4.9950 4.9950 5.1836 5.1836 5.2632 5.2632 5.3182 5.3182 5.7113 5.7113 5.7933 5.7933 5.8523 5.8523 5.8956 5.8956 6.0122 6.0122 6.1223 6.1223 6.2317 6.2317 6.3862 6.3862 6.7053 6.7053 6.7398 6.7398 6.8582 6.8582 7.1794 7.1794 7.7927 7.7927 7.8073 7.8073 7.9070 7.9070 7.9778 7.9778 8.4208 8.4208 8.5627 8.5627 8.8108 8.8108 9.0910 9.0910 9.3152 9.3152 9.6631 9.6631 9.7573 9.7573 10.0731 10.0731 11.3563 11.3563 11.5884 11.5884 12.0359 12.0359 12.1259 12.1259 12.1615 12.1615 12.4445 12.4445 12.5638 12.5638 k = 0.0395 0.0558 0.6124 ( 9804 PWs) bands (ev): -17.8368 -17.8368 -4.7029 -4.7029 -2.9933 -2.9933 -2.8542 -2.8542 -1.7443 -1.7443 -1.6865 -1.6865 -0.6484 -0.6484 0.0129 0.0129 0.2293 0.2293 0.6975 0.6975 0.7545 0.7545 1.1129 1.1129 1.3106 1.3106 2.2617 2.2617 2.4493 2.4493 2.5655 2.5655 4.0128 4.0128 4.0591 4.0591 4.1618 4.1618 4.3761 4.3761 4.7208 4.7208 4.7534 4.7534 4.8167 4.8167 4.8977 4.8977 4.9806 4.9806 5.1794 5.1794 5.2583 5.2583 5.3044 5.3044 5.7308 5.7308 5.8046 5.8046 5.8469 5.8469 5.8937 5.8937 6.0202 6.0202 6.1212 6.1212 6.2371 6.2371 6.3825 6.3825 6.6983 6.6983 6.7464 6.7464 6.8845 6.8845 7.1744 7.1744 7.7877 7.7877 7.8158 7.8158 7.9062 7.9062 7.9863 7.9863 8.4059 8.4059 8.4692 8.4692 8.8331 8.8331 9.1017 9.1017 9.3443 9.3443 9.6704 9.6704 9.7851 9.7851 10.0186 10.0186 11.3883 11.3883 11.5775 11.5775 12.0253 12.0253 12.1475 12.1475 12.1633 12.1633 12.4435 12.4435 12.5975 12.5975 k = 0.0263 0.0372 0.6124 ( 9794 PWs) bands (ev): -17.8368 -17.8368 -4.7028 -4.7028 -2.9942 -2.9942 -2.8519 -2.8519 -1.7458 -1.7458 -1.6972 -1.6972 -0.6106 -0.6106 -0.0276 -0.0276 0.2358 0.2358 0.6992 0.6992 0.7779 0.7779 1.0955 1.0955 1.3073 1.3073 2.2569 2.2569 2.4495 2.4495 2.5657 2.5657 4.0166 4.0166 4.0622 4.0622 4.1731 4.1731 4.3666 4.3666 4.7301 4.7301 4.7670 4.7670 4.8116 4.8116 4.8934 4.8934 4.9669 4.9669 5.1748 5.1748 5.2545 5.2545 5.2952 5.2952 5.7486 5.7486 5.8072 5.8072 5.8458 5.8458 5.8915 5.8915 6.0293 6.0293 6.1149 6.1149 6.2478 6.2478 6.3766 6.3766 6.6916 6.6916 6.7518 6.7518 6.9064 6.9064 7.1676 7.1676 7.7804 7.7804 7.8209 7.8209 7.9049 7.9049 8.0240 8.0240 8.3477 8.3477 8.4210 8.4210 8.8544 8.8544 9.1089 9.1089 9.3668 9.3668 9.6750 9.6750 9.8074 9.8074 9.9738 9.9738 11.4129 11.4129 11.5694 11.5694 12.0166 12.0166 12.1519 12.1519 12.1929 12.1929 12.4083 12.4083 12.6244 12.6244 k = 0.0132 0.0186 0.6124 ( 9794 PWs) bands (ev): -17.8368 -17.8368 -4.7028 -4.7028 -2.9948 -2.9948 -2.8505 -2.8505 -1.7463 -1.7463 -1.7041 -1.7041 -0.5850 -0.5850 -0.0549 -0.0549 0.2395 0.2395 0.7000 0.7000 0.7952 0.7952 1.0823 1.0823 1.3051 1.3051 2.2540 2.2540 2.4496 2.4496 2.5657 2.5657 4.0188 4.0188 4.0639 4.0639 4.1808 4.1808 4.3605 4.3605 4.7365 4.7365 4.7806 4.7806 4.8039 4.8039 4.8914 4.8914 4.9564 4.9564 5.1712 5.1712 5.2522 5.2522 5.2901 5.2901 5.7635 5.7635 5.8017 5.8017 5.8484 5.8484 5.8896 5.8896 6.0373 6.0373 6.1077 6.1077 6.2581 6.2581 6.3706 6.3706 6.6870 6.6870 6.7552 6.7552 6.9212 6.9212 7.1617 7.1617 7.7758 7.7758 7.8217 7.8217 7.9023 7.9023 8.0858 8.0858 8.2566 8.2566 8.4126 8.4126 8.8697 8.8697 9.1130 9.1130 9.3812 9.3812 9.6774 9.6774 9.8234 9.8234 9.9427 9.9427 11.4284 11.4284 11.5644 11.5644 12.0109 12.0109 12.1515 12.1515 12.2356 12.2356 12.3559 12.3559 12.6548 12.6548 k = 0.0000 0.0000 0.6124 ( 9820 PWs) bands (ev): -17.8368 -17.8368 -4.7027 -4.7027 -2.9950 -2.9950 -2.8501 -2.8501 -1.7463 -1.7463 -1.7065 -1.7065 -0.5758 -0.5758 -0.0647 -0.0647 0.2406 0.2406 0.7003 0.7003 0.8017 0.8017 1.0773 1.0773 1.3043 1.3043 2.2531 2.2531 2.4496 2.4496 2.5657 2.5657 4.0195 4.0195 4.0644 4.0644 4.1835 4.1835 4.3583 4.3583 4.7387 4.7387 4.7922 4.7922 4.7944 4.7944 4.8910 4.8910 4.9524 4.9524 5.1699 5.1699 5.2514 5.2514 5.2885 5.2885 5.7709 5.7709 5.7969 5.7969 5.8500 5.8500 5.8888 5.8888 6.0407 6.0407 6.1044 6.1044 6.2624 6.2624 6.3680 6.3680 6.6854 6.6854 6.7563 6.7563 6.9265 6.9265 7.1594 7.1594 7.7742 7.7742 7.8217 7.8217 7.9012 7.9012 8.1485 8.1485 8.1838 8.1838 8.4107 8.4107 8.8753 8.8753 9.1142 9.1142 9.3861 9.3861 9.6781 9.6781 9.8297 9.8297 9.9310 9.9310 11.4337 11.4337 11.5627 11.5627 12.0089 12.0089 12.1512 12.1512 12.2692 12.2692 12.3178 12.3178 12.6712 12.6712 Writing output data file BaxGe3Ptx4.save init_run : 0.73s CPU 0.95s WALL ( 1 calls) electrons : 879.58s CPU 886.21s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.08s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 879.57s CPU 886.20s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.14s CPU 0.25s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.10s WALL ( 178 calls) cegterg : 831.86s CPU 837.65s WALL ( 508 calls) Called by sum_band: Called by *egterg: h_psi : 422.26s CPU 427.43s WALL ( 9098 calls) s_psi : 26.32s CPU 26.09s WALL ( 9098 calls) g_psi : 0.49s CPU 0.50s WALL ( 8412 calls) cdiaghg : 341.16s CPU 342.01s WALL ( 8590 calls) cegterg:over : 37.92s CPU 38.08s WALL ( 8412 calls) cegterg:upda : 23.02s CPU 23.11s WALL ( 8412 calls) cegterg:last : 12.93s CPU 12.96s WALL ( 1042 calls) cdiaghg:chol : 13.08s CPU 13.30s WALL ( 8590 calls) cdiaghg:inve : 10.88s CPU 10.90s WALL ( 8590 calls) cdiaghg:para : 23.46s CPU 23.53s WALL ( 17180 calls) Called by h_psi: h_psi:vloc : 363.14s CPU 368.02s WALL ( 9098 calls) h_psi:vnl : 58.46s CPU 58.73s WALL ( 9098 calls) add_vuspsi : 27.80s CPU 27.94s WALL ( 9098 calls) General routines calbec : 30.61s CPU 30.76s WALL ( 9098 calls) fft : 0.02s CPU 0.04s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 344.53s CPU 349.31s WALL ( 1485484 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.18s CPU 0.29s WALL ( 356 calls) Parallel routines fft_scatter : 252.61s CPU 255.88s WALL ( 1485507 calls) PWSCF : 15m45.98s CPU 16m 8.36s WALL This run was terminated on: 23:52:42 30Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=