Program PWSCF v.5.3.0 (svn rev. 11974) starts on 27Jan2017 at 19:23:18 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./K4ZnAs2.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 114 74 21 3760 1954 292 Max 115 75 22 3763 1975 293 Sum 4127 2683 759 135413 70741 10539 bravais-lattice index = 14 lattice parameter (alat) = 18.0498 a.u. unit-cell volume = 1732.4996 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 278.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 18.049826 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.818580 celldm(5)= 0.818580 celldm(6)= 0.818580 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.818580 0.574393 0.000000 ) a(3) = ( 0.818580 0.258546 0.512914 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.425121 -0.877574 ) b(2) = ( 0.000000 1.740968 -0.877574 ) b(3) = ( 0.000000 0.000000 1.949643 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) K 9.00 39.09830 K( 1.00) Zn 12.00 65.40900 Zn( 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= 219 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 2) = ( 0.0151515 -0.0215928 -0.0132966), wk = 0.0045662 k( 3) = ( 0.0303030 -0.0431855 -0.0265931), wk = 0.0045662 k( 4) = ( 0.0454546 -0.0647783 -0.0398897), wk = 0.0045662 k( 5) = ( 0.0606061 -0.0863710 -0.0531863), wk = 0.0045662 k( 6) = ( 0.0757576 -0.1079638 -0.0664829), wk = 0.0045662 k( 7) = ( 0.0909091 -0.1295565 -0.0797794), wk = 0.0045662 k( 8) = ( 0.1060606 -0.1511492 -0.0930760), wk = 0.0045662 k( 9) = ( 0.1212121 -0.1727420 -0.1063726), wk = 0.0045662 k( 10) = ( 0.1363636 -0.1943347 -0.1196692), wk = 0.0045662 k( 11) = ( 0.1515151 -0.2159275 -0.1329657), wk = 0.0045662 k( 12) = ( 0.1666667 -0.2375202 -0.1462623), wk = 0.0045662 k( 13) = ( 0.1818182 -0.2591130 -0.1595589), wk = 0.0045662 k( 14) = ( 0.1969697 -0.2807057 -0.1728555), wk = 0.0045662 k( 15) = ( 0.2121212 -0.3022985 -0.1861520), wk = 0.0045662 k( 16) = ( 0.2272727 -0.3238912 -0.1994486), wk = 0.0045662 k( 17) = ( 0.2424242 -0.3454840 -0.2127452), wk = 0.0045662 k( 18) = ( 0.2575758 -0.3670767 -0.2260418), wk = 0.0045662 k( 19) = ( 0.2727273 -0.3886695 -0.2393383), wk = 0.0045662 k( 20) = ( 0.2878788 -0.4102622 -0.2526349), wk = 0.0045662 k( 21) = ( 0.3030303 -0.4318550 -0.2659315), wk = 0.0045662 k( 22) = ( 0.3181818 -0.4534477 -0.2792281), wk = 0.0045662 k( 23) = ( 0.3333333 -0.4750405 -0.2925246), wk = 0.0045662 k( 24) = ( 0.3484849 -0.4966332 -0.3058212), wk = 0.0045662 k( 25) = ( 0.3636364 -0.5182260 -0.3191178), wk = 0.0045662 k( 26) = ( 0.3787879 -0.5398187 -0.3324143), wk = 0.0045662 k( 27) = ( 0.3939394 -0.5614115 -0.3457109), wk = 0.0045662 k( 28) = ( 0.4090909 -0.5830042 -0.3590075), wk = 0.0045662 k( 29) = ( 0.4242424 -0.6045970 -0.3723041), wk = 0.0045662 k( 30) = ( 0.4393939 -0.6261897 -0.3856006), wk = 0.0045662 k( 31) = ( 0.4545455 -0.6477825 -0.3988972), wk = 0.0045662 k( 32) = ( 0.4696970 -0.6693752 -0.4121938), wk = 0.0045662 k( 33) = ( 0.4848485 -0.6909680 -0.4254904), wk = 0.0045662 k( 34) = ( 0.5000000 -0.7125607 -0.4387869), wk = 0.0045662 k( 35) = ( 0.5000000 -0.7125607 -0.4387869), wk = 0.0045662 k( 36) = ( 0.5000000 -0.6968424 -0.4643124), wk = 0.0045662 k( 37) = ( 0.5000000 -0.6811241 -0.4898378), wk = 0.0045662 k( 38) = ( 0.5000000 -0.6654059 -0.5153633), wk = 0.0045662 k( 39) = ( 0.5000000 -0.6496876 -0.5408887), wk = 0.0045662 k( 40) = ( 0.5000000 -0.6339693 -0.5664142), wk = 0.0045662 k( 41) = ( 0.5000000 -0.6182510 -0.5919396), wk = 0.0045662 k( 42) = ( 0.5000000 -0.6025327 -0.6174651), wk = 0.0045662 k( 43) = ( 0.5000000 -0.5868144 -0.6429905), wk = 0.0045662 k( 44) = ( 0.5000000 -0.5710961 -0.6685160), wk = 0.0045662 k( 45) = ( 0.5000000 -0.5553779 -0.6940414), wk = 0.0045662 k( 46) = ( 0.5000000 -0.5396596 -0.7195669), wk = 0.0045662 k( 47) = ( 0.5000000 -0.5239413 -0.7450923), wk = 0.0045662 k( 48) = ( 0.5000000 -0.5082230 -0.7706178), wk = 0.0045662 k( 49) = ( 0.5000000 -0.4925047 -0.7961432), wk = 0.0045662 k( 50) = ( 0.5000000 -0.4767864 -0.8216687), wk = 0.0045662 k( 51) = ( 0.5000000 -0.4610681 -0.8471942), wk = 0.0045662 k( 52) = ( 0.5000000 -0.4453498 -0.8727196), wk = 0.0045662 k( 53) = ( 0.5000000 -0.4296316 -0.8982450), wk = 0.0045662 k( 54) = ( 0.5000000 -0.4139133 -0.9237705), wk = 0.0045662 k( 55) = ( 0.5000000 -0.3981950 -0.9492959), wk = 0.0045662 k( 56) = ( 0.5000000 -0.3824767 -0.9748214), wk = 0.0045662 k( 57) = ( 0.8104021 -0.2844371 -0.7803263), wk = 0.0045662 k( 58) = ( 0.8012726 -0.2714265 -0.7545154), wk = 0.0045662 k( 59) = ( 0.7921431 -0.2584159 -0.7287043), wk = 0.0045662 k( 60) = ( 0.7830136 -0.2454053 -0.7028933), wk = 0.0045662 k( 61) = ( 0.7738842 -0.2323947 -0.6770824), wk = 0.0045662 k( 62) = ( 0.7647547 -0.2193841 -0.6512714), wk = 0.0045662 k( 63) = ( 0.7556252 -0.2063735 -0.6254604), wk = 0.0045662 k( 64) = ( 0.7464958 -0.1933629 -0.5996494), wk = 0.0045662 k( 65) = ( 0.7373663 -0.1803523 -0.5738384), wk = 0.0045662 k( 66) = ( 0.7282368 -0.1673417 -0.5480274), wk = 0.0045662 k( 67) = ( 0.7191073 -0.1543311 -0.5222164), wk = 0.0045662 k( 68) = ( 0.7099779 -0.1413204 -0.4964054), wk = 0.0045662 k( 69) = ( 0.7008484 -0.1283098 -0.4705944), wk = 0.0045662 k( 70) = ( 0.6917189 -0.1152992 -0.4447834), wk = 0.0045662 k( 71) = ( 0.6825895 -0.1022886 -0.4189724), wk = 0.0045662 k( 72) = ( 0.6734600 -0.0892780 -0.3931614), wk = 0.0045662 k( 73) = ( 0.6643305 -0.0762674 -0.3673504), wk = 0.0045662 k( 74) = ( 0.6552010 -0.0632568 -0.3415394), wk = 0.0045662 k( 75) = ( 0.6460716 -0.0502462 -0.3157284), wk = 0.0045662 k( 76) = ( 0.6369421 -0.0372356 -0.2899174), wk = 0.0045662 k( 77) = ( 0.6278126 -0.0242250 -0.2641064), wk = 0.0045662 k( 78) = ( 0.6186831 -0.0112144 -0.2382954), wk = 0.0045662 k( 79) = ( 0.6095537 0.0017962 -0.2124844), wk = 0.0045662 k( 80) = ( 0.6004242 0.0148068 -0.1866734), wk = 0.0045662 k( 81) = ( 0.5912947 0.0278174 -0.1608624), wk = 0.0045662 k( 82) = ( 0.5821652 0.0408280 -0.1350514), wk = 0.0045662 k( 83) = ( 0.5730358 0.0538386 -0.1092404), wk = 0.0045662 k( 84) = ( 0.5639063 0.0668492 -0.0834295), wk = 0.0045662 k( 85) = ( 0.5547768 0.0798599 -0.0576184), wk = 0.0045662 k( 86) = ( 0.5456474 0.0928705 -0.0318074), wk = 0.0045662 k( 87) = ( 0.5365179 0.1058811 -0.0059965), wk = 0.0045662 k( 88) = ( 0.5273884 0.1188917 0.0198145), wk = 0.0045662 k( 89) = ( 0.5182589 0.1319023 0.0456255), wk = 0.0045662 k( 90) = ( 0.5091295 0.1449129 0.0714365), wk = 0.0045662 k( 91) = ( 0.5000000 0.1579235 0.0972475), wk = 0.0045662 k( 92) = ( 0.5000000 0.1579235 0.0972475), wk = 0.0045662 k( 93) = ( 0.4722222 0.1491500 0.0918449), wk = 0.0045662 k( 94) = ( 0.4444444 0.1403764 0.0864422), wk = 0.0045662 k( 95) = ( 0.4166667 0.1316029 0.0810396), wk = 0.0045662 k( 96) = ( 0.3888889 0.1228294 0.0756370), wk = 0.0045662 k( 97) = ( 0.3611111 0.1140559 0.0702343), wk = 0.0045662 k( 98) = ( 0.3333333 0.1052823 0.0648317), wk = 0.0045662 k( 99) = ( 0.3055556 0.0965088 0.0594290), wk = 0.0045662 k( 100) = ( 0.2777778 0.0877353 0.0540264), wk = 0.0045662 k( 101) = ( 0.2500000 0.0789618 0.0486238), wk = 0.0045662 k( 102) = ( 0.2222222 0.0701882 0.0432211), wk = 0.0045662 k( 103) = ( 0.1944444 0.0614147 0.0378185), wk = 0.0045662 k( 104) = ( 0.1666667 0.0526412 0.0324158), wk = 0.0045662 k( 105) = ( 0.1388889 0.0438676 0.0270132), wk = 0.0045662 k( 106) = ( 0.1111111 0.0350941 0.0216106), wk = 0.0045662 k( 107) = ( 0.0833333 0.0263206 0.0162079), wk = 0.0045662 k( 108) = ( 0.0555556 0.0175471 0.0108053), wk = 0.0045662 k( 109) = ( 0.0277778 0.0087735 0.0054026), wk = 0.0045662 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 112) = ( 0.0090737 -0.0129311 -0.0256532), wk = 0.0045662 k( 113) = ( 0.0181473 -0.0258621 -0.0513064), wk = 0.0045662 k( 114) = ( 0.0272210 -0.0387932 -0.0769596), wk = 0.0045662 k( 115) = ( 0.0362946 -0.0517243 -0.1026128), wk = 0.0045662 k( 116) = ( 0.0453683 -0.0646553 -0.1282660), wk = 0.0045662 k( 117) = ( 0.0544419 -0.0775864 -0.1539192), wk = 0.0045662 k( 118) = ( 0.0635156 -0.0905174 -0.1795724), wk = 0.0045662 k( 119) = ( 0.0725893 -0.1034485 -0.2052256), wk = 0.0045662 k( 120) = ( 0.0816629 -0.1163796 -0.2308787), wk = 0.0045662 k( 121) = ( 0.0907366 -0.1293106 -0.2565319), wk = 0.0045662 k( 122) = ( 0.0998102 -0.1422417 -0.2821851), wk = 0.0045662 k( 123) = ( 0.1088839 -0.1551728 -0.3078383), wk = 0.0045662 k( 124) = ( 0.1179575 -0.1681038 -0.3334915), wk = 0.0045662 k( 125) = ( 0.1270312 -0.1810349 -0.3591447), wk = 0.0045662 k( 126) = ( 0.1361049 -0.1939660 -0.3847979), wk = 0.0045662 k( 127) = ( 0.1451785 -0.2068970 -0.4104511), wk = 0.0045662 k( 128) = ( 0.1542522 -0.2198281 -0.4361043), wk = 0.0045662 k( 129) = ( 0.1633258 -0.2327591 -0.4617575), wk = 0.0045662 k( 130) = ( 0.1723995 -0.2456902 -0.4874107), wk = 0.0045662 k( 131) = ( 0.1814731 -0.2586213 -0.5130639), wk = 0.0045662 k( 132) = ( 0.1905468 -0.2715523 -0.5387171), wk = 0.0045662 k( 133) = ( 0.1996205 -0.2844834 -0.5643703), wk = 0.0045662 k( 134) = ( 0.2086941 -0.2974145 -0.5900235), wk = 0.0045662 k( 135) = ( 0.2177678 -0.3103455 -0.6156767), wk = 0.0045662 k( 136) = ( 0.2268414 -0.3232766 -0.6413299), wk = 0.0045662 k( 137) = ( 0.2359151 -0.3362077 -0.6669831), wk = 0.0045662 k( 138) = ( 0.2449887 -0.3491387 -0.6926362), wk = 0.0045662 k( 139) = ( 0.2540624 -0.3620698 -0.7182895), wk = 0.0045662 k( 140) = ( 0.2631361 -0.3750008 -0.7439427), wk = 0.0045662 k( 141) = ( 0.2722097 -0.3879319 -0.7695958), wk = 0.0045662 k( 142) = ( 0.2812834 -0.4008630 -0.7952490), wk = 0.0045662 k( 143) = ( 0.2903570 -0.4137940 -0.8209022), wk = 0.0045662 k( 144) = ( 0.2994307 -0.4267251 -0.8465554), wk = 0.0045662 k( 145) = ( 0.3085043 -0.4396561 -0.8722086), wk = 0.0045662 k( 146) = ( 0.3175780 -0.4525872 -0.8978618), wk = 0.0045662 k( 147) = ( 0.3266517 -0.4655183 -0.9235150), wk = 0.0045662 k( 148) = ( 0.3357253 -0.4784493 -0.9491682), wk = 0.0045662 k( 149) = ( 0.3447990 -0.4913804 -0.9748214), wk = 0.0045662 k( 150) = ( 0.6552010 -0.3334569 -0.8775739), wk = 0.0045662 k( 151) = ( 0.6460716 -0.3045522 -0.8775739), wk = 0.0045662 k( 152) = ( 0.6369421 -0.2756474 -0.8775739), wk = 0.0045662 k( 153) = ( 0.6278126 -0.2467427 -0.8775739), wk = 0.0045662 k( 154) = ( 0.6186831 -0.2178380 -0.8775739), wk = 0.0045662 k( 155) = ( 0.6095537 -0.1889333 -0.8775739), wk = 0.0045662 k( 156) = ( 0.6004242 -0.1600285 -0.8775739), wk = 0.0045662 k( 157) = ( 0.5912947 -0.1311238 -0.8775739), wk = 0.0045662 k( 158) = ( 0.5821652 -0.1022191 -0.8775739), wk = 0.0045662 k( 159) = ( 0.5730358 -0.0733143 -0.8775739), wk = 0.0045662 k( 160) = ( 0.5639063 -0.0444096 -0.8775739), wk = 0.0045662 k( 161) = ( 0.5547768 -0.0155049 -0.8775739), wk = 0.0045662 k( 162) = ( 0.5456474 0.0133999 -0.8775739), wk = 0.0045662 k( 163) = ( 0.5365179 0.0423046 -0.8775739), wk = 0.0045662 k( 164) = ( 0.5273884 0.0712093 -0.8775739), wk = 0.0045662 k( 165) = ( 0.5182589 0.1001141 -0.8775739), wk = 0.0045662 k( 166) = ( 0.5091295 0.1290188 -0.8775739), wk = 0.0045662 k( 167) = ( 0.5000000 0.1579235 -0.8775739), wk = 0.0045662 k( 168) = ( 0.5000000 0.1579235 -0.8775739), wk = 0.0045662 k( 169) = ( 0.5221716 0.1649263 -0.8636814), wk = 0.0045662 k( 170) = ( 0.5443431 0.1719292 -0.8497889), wk = 0.0045662 k( 171) = ( 0.5665147 0.1789320 -0.8358964), wk = 0.0045662 k( 172) = ( 0.5886863 0.1859348 -0.8220039), wk = 0.0045662 k( 173) = ( 0.6108579 0.1929376 -0.8081114), wk = 0.0045662 k( 174) = ( 0.6330294 0.1999405 -0.7942188), wk = 0.0045662 k( 175) = ( 0.6552010 0.2069433 -0.7803263), wk = 0.0045662 k( 176) = ( 0.6552010 0.2069433 -0.7803263), wk = 0.0045662 k( 177) = ( 0.6500277 0.2053093 -0.7510739), wk = 0.0045662 k( 178) = ( 0.6448543 0.2036753 -0.7218214), wk = 0.0045662 k( 179) = ( 0.6396809 0.2020413 -0.6925690), wk = 0.0045662 k( 180) = ( 0.6345076 0.2004073 -0.6633165), wk = 0.0045662 k( 181) = ( 0.6293342 0.1987733 -0.6340640), wk = 0.0045662 k( 182) = ( 0.6241608 0.1971393 -0.6048116), wk = 0.0045662 k( 183) = ( 0.6189875 0.1955053 -0.5755591), wk = 0.0045662 k( 184) = ( 0.6138141 0.1938713 -0.5463067), wk = 0.0045662 k( 185) = ( 0.6086407 0.1922373 -0.5170542), wk = 0.0045662 k( 186) = ( 0.6034673 0.1906034 -0.4878017), wk = 0.0045662 k( 187) = ( 0.5982940 0.1889694 -0.4585492), wk = 0.0045662 k( 188) = ( 0.5931206 0.1873354 -0.4292968), wk = 0.0045662 k( 189) = ( 0.5879473 0.1857014 -0.4000443), wk = 0.0045662 k( 190) = ( 0.5827739 0.1840674 -0.3707919), wk = 0.0045662 k( 191) = ( 0.5776005 0.1824334 -0.3415394), wk = 0.0045662 k( 192) = ( 0.5724271 0.1807994 -0.3122869), wk = 0.0045662 k( 193) = ( 0.5672538 0.1791654 -0.2830345), wk = 0.0045662 k( 194) = ( 0.5620804 0.1775314 -0.2537820), wk = 0.0045662 k( 195) = ( 0.5569070 0.1758974 -0.2245296), wk = 0.0045662 k( 196) = ( 0.5517337 0.1742634 -0.1952771), wk = 0.0045662 k( 197) = ( 0.5465603 0.1726294 -0.1660246), wk = 0.0045662 k( 198) = ( 0.5413869 0.1709954 -0.1367722), wk = 0.0045662 k( 199) = ( 0.5362136 0.1693614 -0.1075197), wk = 0.0045662 k( 200) = ( 0.5310402 0.1677275 -0.0782672), wk = 0.0045662 k( 201) = ( 0.5258668 0.1660935 -0.0490148), wk = 0.0045662 k( 202) = ( 0.5206935 0.1644595 -0.0197623), wk = 0.0045662 k( 203) = ( 0.5155201 0.1628255 0.0094901), wk = 0.0045662 k( 204) = ( 0.5103467 0.1611915 0.0387426), wk = 0.0045662 k( 205) = ( 0.5051734 0.1595575 0.0679951), wk = 0.0045662 k( 206) = ( 0.5000000 0.1579235 0.0972475), wk = 0.0045662 k( 207) = ( 0.5000000 -0.7125607 -0.4387869), wk = 0.0045662 k( 208) = ( 0.5258668 -0.6994004 -0.4306830), wk = 0.0045662 k( 209) = ( 0.5517337 -0.6862401 -0.4225790), wk = 0.0045662 k( 210) = ( 0.5776005 -0.6730798 -0.4144751), wk = 0.0045662 k( 211) = ( 0.6034673 -0.6599196 -0.4063711), wk = 0.0045662 k( 212) = ( 0.6293342 -0.6467593 -0.3982671), wk = 0.0045662 k( 213) = ( 0.6552010 -0.6335990 -0.3901632), wk = 0.0045662 k( 214) = ( 0.6810679 -0.6204387 -0.3820592), wk = 0.0045662 k( 215) = ( 0.7069347 -0.6072784 -0.3739552), wk = 0.0045662 k( 216) = ( 0.7328015 -0.5941181 -0.3658513), wk = 0.0045662 k( 217) = ( 0.7586684 -0.5809578 -0.3577473), wk = 0.0045662 k( 218) = ( 0.7845352 -0.5677975 -0.3496434), wk = 0.0045662 k( 219) = ( 0.8104021 -0.5546372 -0.3415394), wk = 0.0045662 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 2) = ( 0.0151515 -0.0000000 -0.0000000), wk = 0.0045662 k( 3) = ( 0.0303030 -0.0000000 -0.0000000), wk = 0.0045662 k( 4) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0045662 k( 5) = ( 0.0606061 -0.0000000 -0.0000000), wk = 0.0045662 k( 6) = ( 0.0757576 -0.0000000 -0.0000000), wk = 0.0045662 k( 7) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0045662 k( 8) = ( 0.1060606 -0.0000000 -0.0000000), wk = 0.0045662 k( 9) = ( 0.1212121 -0.0000000 -0.0000000), wk = 0.0045662 k( 10) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0045662 k( 11) = ( 0.1515151 -0.0000000 -0.0000000), wk = 0.0045662 k( 12) = ( 0.1666667 -0.0000000 0.0000000), wk = 0.0045662 k( 13) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0045662 k( 14) = ( 0.1969697 -0.0000000 -0.0000000), wk = 0.0045662 k( 15) = ( 0.2121212 -0.0000000 -0.0000000), wk = 0.0045662 k( 16) = ( 0.2272727 -0.0000000 -0.0000000), wk = 0.0045662 k( 17) = ( 0.2424242 -0.0000000 -0.0000000), wk = 0.0045662 k( 18) = ( 0.2575758 0.0000000 -0.0000000), wk = 0.0045662 k( 19) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0045662 k( 20) = ( 0.2878788 -0.0000000 -0.0000000), wk = 0.0045662 k( 21) = ( 0.3030303 -0.0000000 -0.0000000), wk = 0.0045662 k( 22) = ( 0.3181818 -0.0000000 0.0000000), wk = 0.0045662 k( 23) = ( 0.3333333 -0.0000000 0.0000000), wk = 0.0045662 k( 24) = ( 0.3484849 -0.0000000 -0.0000000), wk = 0.0045662 k( 25) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0045662 k( 26) = ( 0.3787879 0.0000000 0.0000000), wk = 0.0045662 k( 27) = ( 0.3939394 -0.0000000 -0.0000000), wk = 0.0045662 k( 28) = ( 0.4090909 -0.0000000 0.0000000), wk = 0.0045662 k( 29) = ( 0.4242424 -0.0000000 -0.0000000), wk = 0.0045662 k( 30) = ( 0.4393939 -0.0000000 -0.0000000), wk = 0.0045662 k( 31) = ( 0.4545455 -0.0000000 0.0000000), wk = 0.0045662 k( 32) = ( 0.4696970 -0.0000000 -0.0000000), wk = 0.0045662 k( 33) = ( 0.4848485 -0.0000000 -0.0000000), wk = 0.0045662 k( 34) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0045662 k( 35) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0045662 k( 36) = ( 0.5000000 0.0090285 -0.0090285), wk = 0.0045662 k( 37) = ( 0.5000000 0.0180570 -0.0180570), wk = 0.0045662 k( 38) = ( 0.5000000 0.0270854 -0.0270854), wk = 0.0045662 k( 39) = ( 0.5000000 0.0361139 -0.0361139), wk = 0.0045662 k( 40) = ( 0.5000000 0.0451424 -0.0451424), wk = 0.0045662 k( 41) = ( 0.5000000 0.0541708 -0.0541708), wk = 0.0045662 k( 42) = ( 0.5000000 0.0631993 -0.0631993), wk = 0.0045662 k( 43) = ( 0.5000000 0.0722278 -0.0722278), wk = 0.0045662 k( 44) = ( 0.5000000 0.0812563 -0.0812563), wk = 0.0045662 k( 45) = ( 0.5000000 0.0902847 -0.0902847), wk = 0.0045662 k( 46) = ( 0.5000000 0.0993132 -0.0993132), wk = 0.0045662 k( 47) = ( 0.5000000 0.1083417 -0.1083417), wk = 0.0045662 k( 48) = ( 0.5000000 0.1173702 -0.1173702), wk = 0.0045662 k( 49) = ( 0.5000000 0.1263986 -0.1263986), wk = 0.0045662 k( 50) = ( 0.5000000 0.1354271 -0.1354271), wk = 0.0045662 k( 51) = ( 0.5000000 0.1444556 -0.1444556), wk = 0.0045662 k( 52) = ( 0.5000000 0.1534840 -0.1534841), wk = 0.0045662 k( 53) = ( 0.5000000 0.1625125 -0.1625125), wk = 0.0045662 k( 54) = ( 0.5000000 0.1715410 -0.1715410), wk = 0.0045662 k( 55) = ( 0.5000000 0.1805695 -0.1805695), wk = 0.0045662 k( 56) = ( 0.5000000 0.1895979 -0.1895979), wk = 0.0045662 k( 57) = ( 0.8104021 0.5000000 0.1895979), wk = 0.0045662 k( 58) = ( 0.8012726 0.5000000 0.1987274), wk = 0.0045662 k( 59) = ( 0.7921431 0.5000000 0.2078569), wk = 0.0045662 k( 60) = ( 0.7830136 0.5000000 0.2169864), wk = 0.0045662 k( 61) = ( 0.7738842 0.5000000 0.2261158), wk = 0.0045662 k( 62) = ( 0.7647547 0.5000000 0.2352453), wk = 0.0045662 k( 63) = ( 0.7556252 0.5000000 0.2443748), wk = 0.0045662 k( 64) = ( 0.7464958 0.5000000 0.2535043), wk = 0.0045662 k( 65) = ( 0.7373663 0.5000000 0.2626337), wk = 0.0045662 k( 66) = ( 0.7282368 0.5000000 0.2717632), wk = 0.0045662 k( 67) = ( 0.7191073 0.5000000 0.2808927), wk = 0.0045662 k( 68) = ( 0.7099779 0.5000000 0.2900221), wk = 0.0045662 k( 69) = ( 0.7008484 0.5000000 0.2991516), wk = 0.0045662 k( 70) = ( 0.6917189 0.5000000 0.3082811), wk = 0.0045662 k( 71) = ( 0.6825895 0.5000000 0.3174106), wk = 0.0045662 k( 72) = ( 0.6734600 0.5000000 0.3265400), wk = 0.0045662 k( 73) = ( 0.6643305 0.5000000 0.3356695), wk = 0.0045662 k( 74) = ( 0.6552010 0.5000000 0.3447990), wk = 0.0045662 k( 75) = ( 0.6460716 0.5000000 0.3539284), wk = 0.0045662 k( 76) = ( 0.6369421 0.5000000 0.3630579), wk = 0.0045662 k( 77) = ( 0.6278126 0.5000000 0.3721874), wk = 0.0045662 k( 78) = ( 0.6186831 0.5000000 0.3813169), wk = 0.0045662 k( 79) = ( 0.6095537 0.5000000 0.3904463), wk = 0.0045662 k( 80) = ( 0.6004242 0.5000000 0.3995758), wk = 0.0045662 k( 81) = ( 0.5912947 0.5000000 0.4087053), wk = 0.0045662 k( 82) = ( 0.5821652 0.5000000 0.4178348), wk = 0.0045662 k( 83) = ( 0.5730358 0.5000000 0.4269642), wk = 0.0045662 k( 84) = ( 0.5639063 0.5000000 0.4360937), wk = 0.0045662 k( 85) = ( 0.5547768 0.5000000 0.4452232), wk = 0.0045662 k( 86) = ( 0.5456474 0.5000000 0.4543526), wk = 0.0045662 k( 87) = ( 0.5365179 0.5000000 0.4634821), wk = 0.0045662 k( 88) = ( 0.5273884 0.5000000 0.4726116), wk = 0.0045662 k( 89) = ( 0.5182589 0.5000000 0.4817411), wk = 0.0045662 k( 90) = ( 0.5091295 0.5000000 0.4908705), wk = 0.0045662 k( 91) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 92) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 93) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0045662 k( 94) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0045662 k( 95) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0045662 k( 96) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0045662 k( 97) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0045662 k( 98) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0045662 k( 99) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0045662 k( 100) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0045662 k( 101) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0045662 k( 102) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0045662 k( 103) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0045662 k( 104) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0045662 k( 105) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0045662 k( 106) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0045662 k( 107) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0045662 k( 108) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0045662 k( 109) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0045662 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0045662 k( 112) = ( 0.0090737 -0.0000000 -0.0090737), wk = 0.0045662 k( 113) = ( 0.0181473 -0.0000000 -0.0181473), wk = 0.0045662 k( 114) = ( 0.0272210 -0.0000000 -0.0272210), wk = 0.0045662 k( 115) = ( 0.0362946 0.0000000 -0.0362946), wk = 0.0045662 k( 116) = ( 0.0453683 -0.0000000 -0.0453683), wk = 0.0045662 k( 117) = ( 0.0544419 -0.0000000 -0.0544419), wk = 0.0045662 k( 118) = ( 0.0635156 -0.0000000 -0.0635156), wk = 0.0045662 k( 119) = ( 0.0725893 0.0000000 -0.0725893), wk = 0.0045662 k( 120) = ( 0.0816629 -0.0000000 -0.0816629), wk = 0.0045662 k( 121) = ( 0.0907366 -0.0000000 -0.0907366), wk = 0.0045662 k( 122) = ( 0.0998102 -0.0000000 -0.0998102), wk = 0.0045662 k( 123) = ( 0.1088839 -0.0000000 -0.1088839), wk = 0.0045662 k( 124) = ( 0.1179575 -0.0000000 -0.1179575), wk = 0.0045662 k( 125) = ( 0.1270312 -0.0000000 -0.1270312), wk = 0.0045662 k( 126) = ( 0.1361049 -0.0000000 -0.1361049), wk = 0.0045662 k( 127) = ( 0.1451785 -0.0000000 -0.1451785), wk = 0.0045662 k( 128) = ( 0.1542522 -0.0000000 -0.1542522), wk = 0.0045662 k( 129) = ( 0.1633258 -0.0000000 -0.1633258), wk = 0.0045662 k( 130) = ( 0.1723995 -0.0000000 -0.1723995), wk = 0.0045662 k( 131) = ( 0.1814731 -0.0000000 -0.1814731), wk = 0.0045662 k( 132) = ( 0.1905468 -0.0000000 -0.1905468), wk = 0.0045662 k( 133) = ( 0.1996205 -0.0000000 -0.1996205), wk = 0.0045662 k( 134) = ( 0.2086941 -0.0000000 -0.2086941), wk = 0.0045662 k( 135) = ( 0.2177678 -0.0000000 -0.2177678), wk = 0.0045662 k( 136) = ( 0.2268414 -0.0000000 -0.2268414), wk = 0.0045662 k( 137) = ( 0.2359151 -0.0000000 -0.2359151), wk = 0.0045662 k( 138) = ( 0.2449887 -0.0000000 -0.2449887), wk = 0.0045662 k( 139) = ( 0.2540624 -0.0000000 -0.2540624), wk = 0.0045662 k( 140) = ( 0.2631361 -0.0000000 -0.2631361), wk = 0.0045662 k( 141) = ( 0.2722097 -0.0000000 -0.2722097), wk = 0.0045662 k( 142) = ( 0.2812834 -0.0000000 -0.2812834), wk = 0.0045662 k( 143) = ( 0.2903570 -0.0000000 -0.2903570), wk = 0.0045662 k( 144) = ( 0.2994307 0.0000000 -0.2994307), wk = 0.0045662 k( 145) = ( 0.3085043 -0.0000000 -0.3085043), wk = 0.0045662 k( 146) = ( 0.3175780 -0.0000000 -0.3175780), wk = 0.0045662 k( 147) = ( 0.3266517 -0.0000000 -0.3266517), wk = 0.0045662 k( 148) = ( 0.3357253 -0.0000000 -0.3357253), wk = 0.0045662 k( 149) = ( 0.3447990 -0.0000000 -0.3447990), wk = 0.0045662 k( 150) = ( 0.6552010 0.3447990 -0.0000000), wk = 0.0045662 k( 151) = ( 0.6460716 0.3539284 -0.0000000), wk = 0.0045662 k( 152) = ( 0.6369421 0.3630579 -0.0000000), wk = 0.0045662 k( 153) = ( 0.6278126 0.3721874 -0.0000000), wk = 0.0045662 k( 154) = ( 0.6186831 0.3813169 -0.0000000), wk = 0.0045662 k( 155) = ( 0.6095537 0.3904463 -0.0000000), wk = 0.0045662 k( 156) = ( 0.6004242 0.3995758 -0.0000000), wk = 0.0045662 k( 157) = ( 0.5912947 0.4087053 -0.0000000), wk = 0.0045662 k( 158) = ( 0.5821652 0.4178348 -0.0000000), wk = 0.0045662 k( 159) = ( 0.5730358 0.4269642 -0.0000000), wk = 0.0045662 k( 160) = ( 0.5639063 0.4360937 -0.0000000), wk = 0.0045662 k( 161) = ( 0.5547768 0.4452232 -0.0000000), wk = 0.0045662 k( 162) = ( 0.5456474 0.4543526 -0.0000000), wk = 0.0045662 k( 163) = ( 0.5365179 0.4634821 -0.0000000), wk = 0.0045662 k( 164) = ( 0.5273884 0.4726116 -0.0000000), wk = 0.0045662 k( 165) = ( 0.5182589 0.4817411 -0.0000000), wk = 0.0045662 k( 166) = ( 0.5091295 0.4908705 -0.0000000), wk = 0.0045662 k( 167) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045662 k( 168) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0045662 k( 169) = ( 0.5221716 0.5221716 0.0270854), wk = 0.0045662 k( 170) = ( 0.5443431 0.5443432 0.0541708), wk = 0.0045662 k( 171) = ( 0.5665147 0.5665147 0.0812563), wk = 0.0045662 k( 172) = ( 0.5886863 0.5886863 0.1083417), wk = 0.0045662 k( 173) = ( 0.6108579 0.6108579 0.1354271), wk = 0.0045662 k( 174) = ( 0.6330294 0.6330294 0.1625125), wk = 0.0045662 k( 175) = ( 0.6552010 0.6552010 0.1895979), wk = 0.0045662 k( 176) = ( 0.6552010 0.6552010 0.1895979), wk = 0.0045662 k( 177) = ( 0.6500277 0.6500277 0.1999447), wk = 0.0045662 k( 178) = ( 0.6448543 0.6448543 0.2102914), wk = 0.0045662 k( 179) = ( 0.6396809 0.6396809 0.2206382), wk = 0.0045662 k( 180) = ( 0.6345076 0.6345076 0.2309849), wk = 0.0045662 k( 181) = ( 0.6293342 0.6293342 0.2413316), wk = 0.0045662 k( 182) = ( 0.6241608 0.6241608 0.2516784), wk = 0.0045662 k( 183) = ( 0.6189875 0.6189875 0.2620251), wk = 0.0045662 k( 184) = ( 0.6138141 0.6138141 0.2723718), wk = 0.0045662 k( 185) = ( 0.6086407 0.6086407 0.2827186), wk = 0.0045662 k( 186) = ( 0.6034673 0.6034673 0.2930653), wk = 0.0045662 k( 187) = ( 0.5982940 0.5982940 0.3034120), wk = 0.0045662 k( 188) = ( 0.5931206 0.5931206 0.3137588), wk = 0.0045662 k( 189) = ( 0.5879473 0.5879473 0.3241055), wk = 0.0045662 k( 190) = ( 0.5827739 0.5827739 0.3344522), wk = 0.0045662 k( 191) = ( 0.5776005 0.5776005 0.3447990), wk = 0.0045662 k( 192) = ( 0.5724271 0.5724271 0.3551457), wk = 0.0045662 k( 193) = ( 0.5672538 0.5672538 0.3654924), wk = 0.0045662 k( 194) = ( 0.5620804 0.5620804 0.3758392), wk = 0.0045662 k( 195) = ( 0.5569070 0.5569070 0.3861859), wk = 0.0045662 k( 196) = ( 0.5517337 0.5517337 0.3965327), wk = 0.0045662 k( 197) = ( 0.5465603 0.5465603 0.4068794), wk = 0.0045662 k( 198) = ( 0.5413869 0.5413869 0.4172261), wk = 0.0045662 k( 199) = ( 0.5362136 0.5362136 0.4275729), wk = 0.0045662 k( 200) = ( 0.5310402 0.5310402 0.4379196), wk = 0.0045662 k( 201) = ( 0.5258668 0.5258668 0.4482663), wk = 0.0045662 k( 202) = ( 0.5206935 0.5206935 0.4586131), wk = 0.0045662 k( 203) = ( 0.5155201 0.5155201 0.4689598), wk = 0.0045662 k( 204) = ( 0.5103467 0.5103467 0.4793065), wk = 0.0045662 k( 205) = ( 0.5051734 0.5051734 0.4896533), wk = 0.0045662 k( 206) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0045662 k( 207) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0045662 k( 208) = ( 0.5258668 0.0287332 0.0287333), wk = 0.0045662 k( 209) = ( 0.5517337 0.0574665 0.0574665), wk = 0.0045662 k( 210) = ( 0.5776005 0.0861997 0.0861997), wk = 0.0045662 k( 211) = ( 0.6034673 0.1149330 0.1149330), wk = 0.0045662 k( 212) = ( 0.6293342 0.1436662 0.1436662), wk = 0.0045662 k( 213) = ( 0.6552010 0.1723995 0.1723995), wk = 0.0045662 k( 214) = ( 0.6810679 0.2011327 0.2011327), wk = 0.0045662 k( 215) = ( 0.7069347 0.2298660 0.2298660), wk = 0.0045662 k( 216) = ( 0.7328015 0.2585992 0.2585992), wk = 0.0045662 k( 217) = ( 0.7586684 0.2873325 0.2873325), wk = 0.0045662 k( 218) = ( 0.7845352 0.3160657 0.3160657), wk = 0.0045662 k( 219) = ( 0.8104021 0.3447990 0.3447990), wk = 0.0045662 Dense grid: 135413 G-vectors FFT dimensions: ( 96, 96, 96) Smooth grid: 70741 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 516, 70) NL pseudopotentials 0.78 Mb ( 258, 198) Each V/rho on FFT grid 0.42 Mb ( 27648) Each G-vector array 0.03 Mb ( 3763) G-vector shells 0.02 Mb ( 3107) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.20 Mb ( 516, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.42 Mb ( 198, 2, 70) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./K4ZnAs2.save/charge-density.dat Starting wfc are 98 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.9 secs Computing kpt #: 2 total cpu time spent up to now is 8.9 secs Computing kpt #: 3 total cpu time spent up to now is 11.7 secs Computing kpt #: 4 total cpu time spent up to now is 14.4 secs Computing kpt #: 5 total cpu time spent up to now is 17.1 secs Computing kpt #: 6 total cpu time spent up to now is 19.5 secs Computing kpt #: 7 total cpu time spent up to now is 21.9 secs Computing kpt #: 8 total cpu time spent up to now is 24.2 secs Computing kpt #: 9 total cpu time spent up to now is 26.6 secs Computing kpt #: 10 total cpu time spent up to now is 28.8 secs Computing kpt #: 11 total cpu time spent up to now is 31.1 secs Computing kpt #: 12 total cpu time spent up to now is 33.4 secs Computing kpt #: 13 total cpu time spent up to now is 35.6 secs Computing kpt #: 14 total cpu time spent up to now is 37.8 secs Computing kpt #: 15 total cpu time spent up to now is 40.0 secs Computing kpt #: 16 total cpu time spent up to now is 42.2 secs Computing kpt #: 17 total cpu time spent up to now is 44.4 secs Computing kpt #: 18 total cpu time spent up to now is 46.3 secs Computing kpt #: 19 total cpu time spent up to now is 48.4 secs Computing kpt #: 20 total cpu time spent up to now is 50.6 secs Computing kpt #: 21 total cpu time spent up to now is 52.8 secs Computing kpt #: 22 total cpu time spent up to now is 54.9 secs Computing kpt #: 23 total cpu time spent up to now is 57.1 secs Computing kpt #: 24 total cpu time spent up to now is 59.2 secs Computing kpt #: 25 total cpu time spent up to now is 61.9 secs Computing kpt #: 26 total cpu time spent up to now is 63.8 secs Computing kpt #: 27 total cpu time spent up to now is 66.1 secs Computing kpt #: 28 total cpu time spent up to now is 68.0 secs Computing kpt #: 29 total cpu time spent up to now is 69.8 secs Computing kpt #: 30 total cpu time spent up to now is 71.6 secs Computing kpt #: 31 total cpu time spent up to now is 73.5 secs Computing kpt #: 32 total cpu time spent up to now is 75.3 secs Computing kpt #: 33 total cpu time spent up to now is 77.2 secs Computing kpt #: 34 total cpu time spent up to now is 79.0 secs Computing kpt #: 35 total cpu time spent up to now is 80.8 secs Computing kpt #: 36 total cpu time spent up to now is 82.6 secs Computing kpt #: 37 total cpu time spent up to now is 84.5 secs Computing kpt #: 38 total cpu time spent up to now is 86.3 secs Computing kpt #: 39 total cpu time spent up to now is 88.2 secs Computing kpt #: 40 total cpu time spent up to now is 90.0 secs Computing kpt #: 41 total cpu time spent up to now is 91.9 secs Computing kpt #: 42 total cpu time spent up to now is 93.7 secs Computing kpt #: 43 total cpu time spent up to now is 95.6 secs Computing kpt #: 44 total cpu time spent up to now is 97.8 secs Computing kpt #: 45 total cpu time spent up to now is 99.9 secs Computing kpt #: 46 total cpu time spent up to now is 102.1 secs Computing kpt #: 47 total cpu time spent up to now is 104.2 secs Computing kpt #: 48 total cpu time spent up to now is 106.4 secs Computing kpt #: 49 total cpu time spent up to now is 108.5 secs Computing kpt #: 50 total cpu time spent up to now is 110.7 secs Computing kpt #: 51 total cpu time spent up to now is 112.8 secs Computing kpt #: 52 total cpu time spent up to now is 115.0 secs Computing kpt #: 53 total cpu time spent up to now is 116.8 secs Computing kpt #: 54 total cpu time spent up to now is 118.7 secs Computing kpt #: 55 total cpu time spent up to now is 120.6 secs Computing kpt #: 56 total cpu time spent up to now is 122.4 secs Computing kpt #: 57 total cpu time spent up to now is 124.2 secs Computing kpt #: 58 total cpu time spent up to now is 126.1 secs Computing kpt #: 59 total cpu time spent up to now is 127.9 secs Computing kpt #: 60 total cpu time spent up to now is 129.7 secs Computing kpt #: 61 total cpu time spent up to now is 131.5 secs Computing kpt #: 62 total cpu time spent up to now is 133.3 secs Computing kpt #: 63 total cpu time spent up to now is 135.1 secs Computing kpt #: 64 total cpu time spent up to now is 137.0 secs Computing kpt #: 65 total cpu time spent up to now is 138.8 secs Computing kpt #: 66 total cpu time spent up to now is 140.6 secs Computing kpt #: 67 total cpu time spent up to now is 142.4 secs Computing kpt #: 68 total cpu time spent up to now is 144.3 secs Computing kpt #: 69 total cpu time spent up to now is 146.1 secs Computing kpt #: 70 total cpu time spent up to now is 148.0 secs Computing kpt #: 71 total cpu time spent up to now is 149.8 secs Computing kpt #: 72 total cpu time spent up to now is 151.6 secs Computing kpt #: 73 total cpu time spent up to now is 153.5 secs Computing kpt #: 74 total cpu time spent up to now is 155.3 secs Computing kpt #: 75 total cpu time spent up to now is 157.2 secs Computing kpt #: 76 total cpu time spent up to now is 159.0 secs Computing kpt #: 77 total cpu time spent up to now is 160.9 secs Computing kpt #: 78 total cpu time spent up to now is 162.7 secs Computing kpt #: 79 total cpu time spent up to now is 164.6 secs Computing kpt #: 80 total cpu time spent up to now is 166.4 secs Computing kpt #: 81 total cpu time spent up to now is 168.3 secs Computing kpt #: 82 total cpu time spent up to now is 170.1 secs Computing kpt #: 83 total cpu time spent up to now is 172.0 secs Computing kpt #: 84 total cpu time spent up to now is 173.8 secs Computing kpt #: 85 total cpu time spent up to now is 175.7 secs Computing kpt #: 86 total cpu time spent up to now is 177.6 secs Computing kpt #: 87 total cpu time spent up to now is 179.4 secs Computing kpt #: 88 total cpu time spent up to now is 181.3 secs Computing kpt #: 89 total cpu time spent up to now is 183.5 secs Computing kpt #: 90 total cpu time spent up to now is 185.6 secs Computing kpt #: 91 total cpu time spent up to now is 187.5 secs Computing kpt #: 92 total cpu time spent up to now is 189.6 secs Computing kpt #: 93 total cpu time spent up to now is 191.7 secs Computing kpt #: 94 total cpu time spent up to now is 193.9 secs Computing kpt #: 95 total cpu time spent up to now is 195.7 secs Computing kpt #: 96 total cpu time spent up to now is 197.9 secs Computing kpt #: 97 total cpu time spent up to now is 200.1 secs Computing kpt #: 98 total cpu time spent up to now is 202.2 secs Computing kpt #: 99 total cpu time spent up to now is 204.4 secs Computing kpt #: 100 total cpu time spent up to now is 206.6 secs Computing kpt #: 101 total cpu time spent up to now is 208.8 secs Computing kpt #: 102 total cpu time spent up to now is 211.7 secs Computing kpt #: 103 total cpu time spent up to now is 214.7 secs Computing kpt #: 104 total cpu time spent up to now is 218.0 secs Computing kpt #: 105 total cpu time spent up to now is 220.9 secs Computing kpt #: 106 total cpu time spent up to now is 223.9 secs Computing kpt #: 107 total cpu time spent up to now is 226.9 secs Computing kpt #: 108 total cpu time spent up to now is 229.7 secs Computing kpt #: 109 total cpu time spent up to now is 232.6 secs Computing kpt #: 110 total cpu time spent up to now is 235.4 secs Computing kpt #: 111 total cpu time spent up to now is 238.7 secs Computing kpt #: 112 total cpu time spent up to now is 241.5 secs Computing kpt #: 113 total cpu time spent up to now is 244.4 secs Computing kpt #: 114 total cpu time spent up to now is 247.1 secs Computing kpt #: 115 total cpu time spent up to now is 249.4 secs Computing kpt #: 116 total cpu time spent up to now is 251.6 secs Computing kpt #: 117 total cpu time spent up to now is 253.9 secs Computing kpt #: 118 total cpu time spent up to now is 256.1 secs Computing kpt #: 119 total cpu time spent up to now is 258.3 secs Computing kpt #: 120 total cpu time spent up to now is 260.6 secs Computing kpt #: 121 total cpu time spent up to now is 262.8 secs Computing kpt #: 122 total cpu time spent up to now is 265.0 secs Computing kpt #: 123 total cpu time spent up to now is 267.2 secs Computing kpt #: 124 total cpu time spent up to now is 269.4 secs Computing kpt #: 125 total cpu time spent up to now is 271.7 secs Computing kpt #: 126 total cpu time spent up to now is 273.9 secs Computing kpt #: 127 total cpu time spent up to now is 276.2 secs Computing kpt #: 128 total cpu time spent up to now is 278.4 secs Computing kpt #: 129 total cpu time spent up to now is 280.7 secs Computing kpt #: 130 total cpu time spent up to now is 282.9 secs Computing kpt #: 131 total cpu time spent up to now is 285.1 secs Computing kpt #: 132 total cpu time spent up to now is 287.3 secs Computing kpt #: 133 total cpu time spent up to now is 289.6 secs Computing kpt #: 134 total cpu time spent up to now is 293.5 secs Computing kpt #: 135 total cpu time spent up to now is 296.2 secs Computing kpt #: 136 total cpu time spent up to now is 298.6 secs Computing kpt #: 137 total cpu time spent up to now is 301.0 secs Computing kpt #: 138 total cpu time spent up to now is 303.4 secs Computing kpt #: 139 total cpu time spent up to now is 305.7 secs Computing kpt #: 140 total cpu time spent up to now is 308.0 secs Computing kpt #: 141 total cpu time spent up to now is 310.2 secs Computing kpt #: 142 total cpu time spent up to now is 312.4 secs Computing kpt #: 143 total cpu time spent up to now is 314.5 secs Computing kpt #: 144 total cpu time spent up to now is 316.7 secs Computing kpt #: 145 total cpu time spent up to now is 318.9 secs Computing kpt #: 146 total cpu time spent up to now is 321.0 secs Computing kpt #: 147 total cpu time spent up to now is 323.2 secs Computing kpt #: 148 total cpu time spent up to now is 325.3 secs Computing kpt #: 149 total cpu time spent up to now is 327.2 secs Computing kpt #: 150 total cpu time spent up to now is 329.4 secs Computing kpt #: 151 total cpu time spent up to now is 331.2 secs Computing kpt #: 152 total cpu time spent up to now is 333.1 secs Computing kpt #: 153 total cpu time spent up to now is 334.9 secs Computing kpt #: 154 total cpu time spent up to now is 336.8 secs Computing kpt #: 155 total cpu time spent up to now is 338.6 secs Computing kpt #: 156 total cpu time spent up to now is 340.5 secs Computing kpt #: 157 total cpu time spent up to now is 342.3 secs Computing kpt #: 158 total cpu time spent up to now is 344.1 secs Computing kpt #: 159 total cpu time spent up to now is 346.0 secs Computing kpt #: 160 total cpu time spent up to now is 347.8 secs Computing kpt #: 161 total cpu time spent up to now is 349.6 secs Computing kpt #: 162 total cpu time spent up to now is 351.4 secs Computing kpt #: 163 total cpu time spent up to now is 353.4 secs Computing kpt #: 164 total cpu time spent up to now is 355.3 secs Computing kpt #: 165 total cpu time spent up to now is 357.1 secs Computing kpt #: 166 total cpu time spent up to now is 358.9 secs Computing kpt #: 167 total cpu time spent up to now is 360.9 secs Computing kpt #: 168 total cpu time spent up to now is 363.0 secs Computing kpt #: 169 total cpu time spent up to now is 364.8 secs Computing kpt #: 170 total cpu time spent up to now is 366.6 secs Computing kpt #: 171 total cpu time spent up to now is 368.5 secs Computing kpt #: 172 total cpu time spent up to now is 370.3 secs Computing kpt #: 173 total cpu time spent up to now is 372.2 secs Computing kpt #: 174 total cpu time spent up to now is 374.3 secs Computing kpt #: 175 total cpu time spent up to now is 376.5 secs Computing kpt #: 176 total cpu time spent up to now is 378.6 secs Computing kpt #: 177 total cpu time spent up to now is 380.8 secs Computing kpt #: 178 total cpu time spent up to now is 382.6 secs Computing kpt #: 179 total cpu time spent up to now is 384.5 secs Computing kpt #: 180 total cpu time spent up to now is 386.3 secs Computing kpt #: 181 total cpu time spent up to now is 388.2 secs Computing kpt #: 182 total cpu time spent up to now is 390.0 secs Computing kpt #: 183 total cpu time spent up to now is 391.9 secs Computing kpt #: 184 total cpu time spent up to now is 393.7 secs Computing kpt #: 185 total cpu time spent up to now is 395.5 secs Computing kpt #: 186 total cpu time spent up to now is 397.4 secs Computing kpt #: 187 total cpu time spent up to now is 399.2 secs Computing kpt #: 188 total cpu time spent up to now is 401.0 secs Computing kpt #: 189 total cpu time spent up to now is 402.9 secs Computing kpt #: 190 total cpu time spent up to now is 404.7 secs Computing kpt #: 191 total cpu time spent up to now is 406.6 secs Computing kpt #: 192 total cpu time spent up to now is 408.4 secs Computing kpt #: 193 total cpu time spent up to now is 410.3 secs Computing kpt #: 194 total cpu time spent up to now is 412.1 secs Computing kpt #: 195 total cpu time spent up to now is 413.9 secs Computing kpt #: 196 total cpu time spent up to now is 415.8 secs Computing kpt #: 197 total cpu time spent up to now is 417.6 secs Computing kpt #: 198 total cpu time spent up to now is 419.5 secs Computing kpt #: 199 total cpu time spent up to now is 421.3 secs Computing kpt #: 200 total cpu time spent up to now is 423.2 secs Computing kpt #: 201 total cpu time spent up to now is 425.1 secs Computing kpt #: 202 total cpu time spent up to now is 426.9 secs Computing kpt #: 203 total cpu time spent up to now is 429.1 secs Computing kpt #: 204 total cpu time spent up to now is 431.2 secs Computing kpt #: 205 total cpu time spent up to now is 433.4 secs Computing kpt #: 206 total cpu time spent up to now is 435.5 secs Computing kpt #: 207 total cpu time spent up to now is 437.3 secs Computing kpt #: 208 total cpu time spent up to now is 439.5 secs Computing kpt #: 209 total cpu time spent up to now is 441.6 secs Computing kpt #: 210 total cpu time spent up to now is 443.8 secs Computing kpt #: 211 total cpu time spent up to now is 446.0 secs Computing kpt #: 212 total cpu time spent up to now is 448.2 secs Computing kpt #: 213 total cpu time spent up to now is 450.3 secs Computing kpt #: 214 total cpu time spent up to now is 452.5 secs Computing kpt #: 215 total cpu time spent up to now is 454.8 secs Computing kpt #: 216 total cpu time spent up to now is 457.0 secs Computing kpt #: 217 total cpu time spent up to now is 459.2 secs Computing kpt #: 218 total cpu time spent up to now is 461.3 secs Computing kpt #: 219 total cpu time spent up to now is 463.5 secs ethr = 1.72E-08, avg # of iterations = 24.3 total cpu time spent up to now is 463.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8923 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8095 -10.8095 -10.7435 -10.7435 -10.6653 -10.6653 -10.6411 -10.6411 -10.6266 -10.6266 -10.5907 -10.5907 -10.5486 -10.5486 -10.5192 -10.5192 -10.4863 -10.4863 -10.4600 -10.4600 -6.1404 -6.1404 -5.4799 -5.4799 -3.2829 -3.2829 -3.2799 -3.2799 -2.9652 -2.9652 -2.9120 -2.9120 -2.9071 -2.9071 0.1221 0.1221 2.3925 2.3925 2.6378 2.6378 2.7381 2.7381 3.2058 3.2058 3.3505 3.3505 4.1116 4.1116 6.3985 6.3985 6.4427 6.4427 6.4444 6.4444 6.7271 6.7271 7.5734 7.5734 k = 0.0152-0.0216-0.0133 ( 8913 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8096 -10.8096 -10.7436 -10.7436 -10.6653 -10.6653 -10.6412 -10.6412 -10.6265 -10.6265 -10.5909 -10.5909 -10.5484 -10.5484 -10.5192 -10.5192 -10.4862 -10.4862 -10.4601 -10.4601 -6.1402 -6.1402 -5.4798 -5.4798 -3.2829 -3.2829 -3.2799 -3.2799 -2.9652 -2.9652 -2.9119 -2.9119 -2.9070 -2.9070 0.1224 0.1224 2.3923 2.3923 2.6362 2.6362 2.7363 2.7363 3.2052 3.2052 3.3497 3.3497 4.1174 4.1174 6.3884 6.3884 6.4358 6.4358 6.4459 6.4459 6.7463 6.7463 7.5688 7.5688 k = 0.0303-0.0432-0.0266 ( 8894 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8909 -10.8909 -10.8098 -10.8098 -10.7440 -10.7440 -10.6652 -10.6652 -10.6414 -10.6414 -10.6261 -10.6261 -10.5912 -10.5912 -10.5479 -10.5479 -10.5193 -10.5193 -10.4859 -10.4859 -10.4602 -10.4602 -6.1395 -6.1395 -5.4794 -5.4794 -3.2828 -3.2828 -3.2799 -3.2799 -2.9652 -2.9652 -2.9117 -2.9117 -2.9070 -2.9070 0.1236 0.1236 2.3918 2.3918 2.6313 2.6313 2.7312 2.7312 3.2031 3.2031 3.3476 3.3476 4.1345 4.1345 6.3509 6.3509 6.4270 6.4270 6.4555 6.4555 6.7936 6.7936 7.5504 7.5504 k = 0.0455-0.0648-0.0399 ( 8885 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0998 -27.0998 -27.0847 -27.0847 -10.9200 -10.9200 -10.8911 -10.8911 -10.8102 -10.8102 -10.7446 -10.7446 -10.6652 -10.6652 -10.6418 -10.6418 -10.6254 -10.6254 -10.5918 -10.5918 -10.5470 -10.5470 -10.5196 -10.5196 -10.4856 -10.4856 -10.4605 -10.4605 -6.1383 -6.1383 -5.4788 -5.4788 -3.2827 -3.2827 -3.2799 -3.2799 -2.9652 -2.9652 -2.9114 -2.9114 -2.9070 -2.9070 0.1254 0.1254 2.3907 2.3907 2.6221 2.6221 2.7245 2.7245 3.1996 3.1996 3.3441 3.3441 4.1623 4.1623 6.2941 6.2941 6.4241 6.4241 6.4719 6.4719 6.8538 6.8538 7.5214 7.5214 k = 0.0606-0.0864-0.0532 ( 8873 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0998 -27.0998 -27.0848 -27.0848 -10.9199 -10.9199 -10.8914 -10.8914 -10.8107 -10.8107 -10.7455 -10.7455 -10.6651 -10.6651 -10.6423 -10.6423 -10.6246 -10.6246 -10.5926 -10.5926 -10.5458 -10.5458 -10.5199 -10.5199 -10.4851 -10.4851 -10.4609 -10.4609 -6.1367 -6.1367 -5.4780 -5.4780 -3.2825 -3.2825 -3.2799 -3.2799 -2.9652 -2.9652 -2.9109 -2.9109 -2.9069 -2.9069 0.1280 0.1280 2.3891 2.3891 2.6078 2.6078 2.7180 2.7180 3.1944 3.1944 3.3397 3.3397 4.2000 4.2000 6.2299 6.2299 6.4230 6.4230 6.4949 6.4949 6.9179 6.9179 7.4862 7.4862 k = 0.0758-0.1080-0.0665 ( 8867 PWs) bands (ev): -27.1947 -27.1947 -27.1882 -27.1882 -27.0998 -27.0998 -27.0849 -27.0849 -10.9197 -10.9197 -10.8918 -10.8918 -10.8113 -10.8113 -10.7466 -10.7466 -10.6651 -10.6651 -10.6428 -10.6428 -10.6235 -10.6235 -10.5935 -10.5935 -10.5444 -10.5444 -10.5204 -10.5204 -10.4845 -10.4845 -10.4614 -10.4614 -6.1346 -6.1346 -5.4770 -5.4770 -3.2823 -3.2823 -3.2799 -3.2799 -2.9652 -2.9652 -2.9103 -2.9103 -2.9068 -2.9068 0.1313 0.1313 2.3865 2.3865 2.5886 2.5886 2.7130 2.7130 3.1873 3.1873 3.3347 3.3347 4.2463 4.2463 6.1631 6.1631 6.4224 6.4224 6.5242 6.5242 6.9801 6.9801 7.4494 7.4494 k = 0.0909-0.1296-0.0798 ( 8861 PWs) bands (ev): -27.1946 -27.1946 -27.1881 -27.1881 -27.0997 -27.0997 -27.0850 -27.0850 -10.9195 -10.9195 -10.8922 -10.8922 -10.8121 -10.8121 -10.7480 -10.7480 -10.6650 -10.6650 -10.6435 -10.6435 -10.6224 -10.6224 -10.5945 -10.5945 -10.5428 -10.5428 -10.5209 -10.5209 -10.4839 -10.4839 -10.4619 -10.4619 -6.1321 -6.1321 -5.4757 -5.4757 -3.2820 -3.2820 -3.2799 -3.2799 -2.9653 -2.9653 -2.9097 -2.9097 -2.9067 -2.9067 0.1353 0.1353 2.3826 2.3826 2.5652 2.5652 2.7099 2.7099 3.1782 3.1782 3.3295 3.3295 4.3000 4.3000 6.0958 6.0958 6.4218 6.4218 6.5594 6.5594 7.0342 7.0342 7.4168 7.4168 k = 0.1061-0.1511-0.0931 ( 8856 PWs) bands (ev): -27.1945 -27.1945 -27.1881 -27.1881 -27.0996 -27.0996 -27.0851 -27.0851 -10.9193 -10.9193 -10.8927 -10.8927 -10.8129 -10.8129 -10.7496 -10.7496 -10.6649 -10.6649 -10.6441 -10.6441 -10.6212 -10.6212 -10.5955 -10.5955 -10.5410 -10.5410 -10.5214 -10.5214 -10.4831 -10.4831 -10.4625 -10.4625 -6.1292 -6.1292 -5.4743 -5.4743 -3.2818 -3.2818 -3.2799 -3.2799 -2.9653 -2.9653 -2.9090 -2.9090 -2.9065 -2.9065 0.1399 0.1399 2.3766 2.3766 2.5398 2.5398 2.7085 2.7085 3.1668 3.1668 3.3245 3.3245 4.3601 4.3601 6.0291 6.0291 6.4213 6.4213 6.6000 6.6000 7.0719 7.0719 7.3965 7.3965 k = 0.1212-0.1727-0.1064 ( 8853 PWs) bands (ev): -27.1944 -27.1944 -27.1881 -27.1881 -27.0996 -27.0996 -27.0853 -27.0853 -10.9191 -10.9191 -10.8933 -10.8933 -10.8138 -10.8138 -10.7514 -10.7514 -10.6648 -10.6648 -10.6448 -10.6448 -10.6199 -10.6199 -10.5965 -10.5965 -10.5391 -10.5391 -10.5220 -10.5220 -10.4824 -10.4824 -10.4631 -10.4631 -6.1260 -6.1260 -5.4727 -5.4727 -3.2815 -3.2815 -3.2799 -3.2799 -2.9653 -2.9653 -2.9084 -2.9084 -2.9060 -2.9060 0.1451 0.1451 2.3675 2.3675 2.5147 2.5147 2.7085 2.7085 3.1532 3.1532 3.3199 3.3199 4.4254 4.4254 5.9635 5.9635 6.4207 6.4207 6.6454 6.6454 7.0844 7.0844 7.3963 7.3963 k = 0.1364-0.1943-0.1197 ( 8859 PWs) bands (ev): -27.1943 -27.1943 -27.1882 -27.1882 -27.0995 -27.0995 -27.0854 -27.0854 -10.9189 -10.9189 -10.8939 -10.8939 -10.8149 -10.8149 -10.7534 -10.7534 -10.6647 -10.6647 -10.6455 -10.6455 -10.6186 -10.6186 -10.5975 -10.5975 -10.5372 -10.5372 -10.5227 -10.5227 -10.4817 -10.4817 -10.4637 -10.4637 -6.1224 -6.1224 -5.4709 -5.4709 -3.2811 -3.2811 -3.2799 -3.2799 -2.9653 -2.9653 -2.9081 -2.9081 -2.9053 -2.9053 0.1509 0.1509 2.3537 2.3537 2.4923 2.4923 2.7096 2.7096 3.1374 3.1374 3.3160 3.3160 4.4948 4.4948 5.8996 5.8996 6.4200 6.4200 6.6947 6.6947 7.0712 7.0712 7.4149 7.4149 k = 0.1515-0.2159-0.1330 ( 8851 PWs) bands (ev): -27.1942 -27.1942 -27.1882 -27.1882 -27.0994 -27.0994 -27.0856 -27.0856 -10.9186 -10.9186 -10.8946 -10.8946 -10.8159 -10.8159 -10.7556 -10.7556 -10.6646 -10.6646 -10.6462 -10.6462 -10.6173 -10.6173 -10.5983 -10.5983 -10.5352 -10.5352 -10.5233 -10.5233 -10.4810 -10.4810 -10.4643 -10.4643 -6.1185 -6.1185 -5.4689 -5.4689 -3.2808 -3.2808 -3.2799 -3.2799 -2.9654 -2.9654 -2.9078 -2.9078 -2.9042 -2.9042 0.1572 0.1572 2.3344 2.3344 2.4746 2.4746 2.7114 2.7114 3.1196 3.1196 3.3128 3.3128 4.5674 4.5674 5.8375 5.8375 6.4193 6.4193 6.7462 6.7462 7.0415 7.0415 7.4394 7.4394 k = 0.1667-0.2375-0.1463 ( 8854 PWs) bands (ev): -27.1941 -27.1941 -27.1882 -27.1882 -27.0993 -27.0993 -27.0858 -27.0858 -10.9183 -10.9183 -10.8953 -10.8953 -10.8170 -10.8170 -10.7580 -10.7580 -10.6645 -10.6645 -10.6470 -10.6470 -10.6160 -10.6160 -10.5991 -10.5991 -10.5332 -10.5332 -10.5240 -10.5240 -10.4804 -10.4804 -10.4647 -10.4647 -6.1144 -6.1144 -5.4668 -5.4668 -3.2804 -3.2804 -3.2799 -3.2799 -2.9654 -2.9654 -2.9077 -2.9077 -2.9030 -2.9030 0.1640 0.1640 2.3097 2.3097 2.4620 2.4620 2.7138 2.7138 3.1002 3.1002 3.3103 3.3103 4.6424 4.6424 5.7775 5.7775 6.4185 6.4185 6.7963 6.7963 7.0069 7.0069 7.4551 7.4552 k = 0.1818-0.2591-0.1596 ( 8857 PWs) bands (ev): -27.1939 -27.1939 -27.1882 -27.1882 -27.0992 -27.0992 -27.0860 -27.0860 -10.9181 -10.9181 -10.8961 -10.8961 -10.8181 -10.8181 -10.7605 -10.7605 -10.6645 -10.6645 -10.6477 -10.6477 -10.6148 -10.6148 -10.5998 -10.5998 -10.5312 -10.5312 -10.5246 -10.5246 -10.4799 -10.4799 -10.4651 -10.4651 -6.1100 -6.1100 -5.4646 -5.4646 -3.2802 -3.2802 -3.2797 -3.2797 -2.9655 -2.9655 -2.9077 -2.9077 -2.9017 -2.9017 0.1712 0.1712 2.2810 2.2810 2.4537 2.4537 2.7167 2.7167 3.0794 3.0794 3.3084 3.3084 4.7188 4.7188 5.7199 5.7199 6.4175 6.4175 6.8341 6.8341 6.9824 6.9824 7.4534 7.4534 k = 0.1970-0.2807-0.1729 ( 8858 PWs) bands (ev): -27.1938 -27.1938 -27.1882 -27.1882 -27.0991 -27.0991 -27.0863 -27.0863 -10.9178 -10.9178 -10.8968 -10.8968 -10.8193 -10.8193 -10.7632 -10.7632 -10.6644 -10.6644 -10.6484 -10.6484 -10.6136 -10.6136 -10.6003 -10.6003 -10.5294 -10.5294 -10.5252 -10.5252 -10.4796 -10.4796 -10.4653 -10.4653 -6.1054 -6.1054 -5.4623 -5.4623 -3.2802 -3.2802 -3.2794 -3.2794 -2.9655 -2.9655 -2.9076 -2.9076 -2.9002 -2.9002 0.1787 0.1787 2.2500 2.2500 2.4484 2.4484 2.7199 2.7199 3.0576 3.0576 3.3070 3.3070 4.7958 4.7958 5.6647 5.6647 6.4165 6.4165 6.8367 6.8367 6.9923 6.9923 7.4354 7.4354 k = 0.2121-0.3023-0.1862 ( 8856 PWs) bands (ev): -27.1936 -27.1936 -27.1882 -27.1882 -27.0989 -27.0989 -27.0865 -27.0865 -10.9175 -10.9175 -10.8976 -10.8976 -10.8204 -10.8204 -10.7660 -10.7660 -10.6643 -10.6643 -10.6492 -10.6492 -10.6126 -10.6126 -10.6006 -10.6006 -10.5276 -10.5276 -10.5257 -10.5257 -10.4794 -10.4794 -10.4653 -10.4653 -6.1007 -6.1007 -5.4599 -5.4599 -3.2802 -3.2802 -3.2790 -3.2790 -2.9656 -2.9656 -2.9076 -2.9076 -2.8987 -2.8987 0.1866 0.1866 2.2180 2.2180 2.4452 2.4452 2.7234 2.7234 3.0352 3.0352 3.3061 3.3061 4.8725 4.8725 5.6124 5.6124 6.4153 6.4153 6.8067 6.8067 7.0337 7.0337 7.4077 7.4077 k = 0.2273-0.3239-0.1994 ( 8860 PWs) bands (ev): -27.1934 -27.1934 -27.1882 -27.1882 -27.0988 -27.0988 -27.0868 -27.0868 -10.9172 -10.9172 -10.8984 -10.8984 -10.8214 -10.8214 -10.7689 -10.7689 -10.6643 -10.6643 -10.6498 -10.6498 -10.6116 -10.6116 -10.6007 -10.6007 -10.5268 -10.5268 -10.5254 -10.5254 -10.4794 -10.4794 -10.4651 -10.4651 -6.0959 -6.0959 -5.4574 -5.4574 -3.2802 -3.2802 -3.2786 -3.2786 -2.9656 -2.9656 -2.9076 -2.9076 -2.8971 -2.8971 0.1946 0.1946 2.1860 2.1860 2.4434 2.4434 2.7271 2.7271 3.0124 3.0124 3.3056 3.3056 4.9480 4.9480 5.5632 5.5632 6.4140 6.4140 6.7655 6.7655 7.0818 7.0818 7.3780 7.3780 k = 0.2424-0.3455-0.2127 ( 8853 PWs) bands (ev): -27.1933 -27.1933 -27.1882 -27.1882 -27.0987 -27.0987 -27.0870 -27.0870 -10.9169 -10.9169 -10.8992 -10.8992 -10.8224 -10.8224 -10.7718 -10.7718 -10.6644 -10.6644 -10.6505 -10.6505 -10.6108 -10.6108 -10.6007 -10.6007 -10.5271 -10.5271 -10.5240 -10.5240 -10.4794 -10.4794 -10.4648 -10.4648 -6.0911 -6.0911 -5.4549 -5.4549 -3.2802 -3.2802 -3.2781 -3.2781 -2.9657 -2.9657 -2.9076 -2.9076 -2.8955 -2.8955 0.2028 0.2028 2.1546 2.1546 2.4424 2.4424 2.7309 2.7309 2.9895 2.9895 3.3054 3.3054 5.0210 5.0210 5.5177 5.5177 6.4125 6.4125 6.7221 6.7221 7.1207 7.1207 7.3558 7.3558 k = 0.2576-0.3671-0.2260 ( 8845 PWs) bands (ev): -27.1931 -27.1931 -27.1883 -27.1883 -27.0985 -27.0985 -27.0873 -27.0873 -10.9167 -10.9167 -10.9000 -10.9000 -10.8234 -10.8234 -10.7748 -10.7748 -10.6645 -10.6645 -10.6511 -10.6511 -10.6101 -10.6101 -10.6005 -10.6005 -10.5275 -10.5275 -10.5226 -10.5226 -10.4796 -10.4796 -10.4644 -10.4644 -6.0862 -6.0862 -5.4524 -5.4524 -3.2802 -3.2802 -3.2777 -3.2777 -2.9657 -2.9657 -2.9076 -2.9076 -2.8938 -2.8938 0.2111 0.2111 2.1242 2.1242 2.4422 2.4422 2.7348 2.7348 2.9668 2.9668 3.3054 3.3054 5.0899 5.0899 5.4770 5.4770 6.4109 6.4109 6.6795 6.6795 7.1358 7.1358 7.3530 7.3530 k = 0.2727-0.3887-0.2393 ( 8854 PWs) bands (ev): -27.1929 -27.1929 -27.1883 -27.1883 -27.0984 -27.0984 -27.0876 -27.0876 -10.9165 -10.9165 -10.9008 -10.9008 -10.8242 -10.8242 -10.7779 -10.7779 -10.6646 -10.6646 -10.6517 -10.6517 -10.6095 -10.6095 -10.6002 -10.6002 -10.5279 -10.5279 -10.5214 -10.5214 -10.4798 -10.4798 -10.4638 -10.4638 -6.0814 -6.0814 -5.4500 -5.4500 -3.2803 -3.2803 -3.2772 -3.2772 -2.9658 -2.9658 -2.9076 -2.9076 -2.8922 -2.8922 0.2194 0.2194 2.0951 2.0951 2.4424 2.4424 2.7388 2.7388 2.9445 2.9445 3.3056 3.3056 5.1518 5.1518 5.4431 5.4431 6.4092 6.4092 6.6393 6.6393 7.1226 7.1226 7.3718 7.3718 k = 0.2879-0.4103-0.2526 ( 8838 PWs) bands (ev): -27.1927 -27.1927 -27.1883 -27.1883 -27.0982 -27.0982 -27.0879 -27.0879 -10.9163 -10.9163 -10.9016 -10.9016 -10.8249 -10.8249 -10.7810 -10.7810 -10.6649 -10.6649 -10.6521 -10.6521 -10.6090 -10.6090 -10.5998 -10.5998 -10.5282 -10.5282 -10.5203 -10.5203 -10.4799 -10.4799 -10.4632 -10.4632 -6.0766 -6.0766 -5.4475 -5.4475 -3.2803 -3.2803 -3.2768 -3.2768 -2.9658 -2.9658 -2.9076 -2.9076 -2.8905 -2.8905 0.2276 0.2276 2.0676 2.0676 2.4429 2.4429 2.7427 2.7427 2.9227 2.9227 3.3060 3.3060 5.2012 5.2012 5.4210 5.4210 6.4073 6.4073 6.6025 6.6025 7.0915 7.0915 7.3990 7.3990 k = 0.3030-0.4319-0.2659 ( 8839 PWs) bands (ev): -27.1925 -27.1925 -27.1883 -27.1883 -27.0980 -27.0980 -27.0881 -27.0881 -10.9161 -10.9161 -10.9023 -10.9023 -10.8255 -10.8255 -10.7841 -10.7841 -10.6652 -10.6652 -10.6525 -10.6525 -10.6086 -10.6086 -10.5994 -10.5994 -10.5284 -10.5284 -10.5194 -10.5194 -10.4801 -10.4801 -10.4626 -10.4626 -6.0720 -6.0720 -5.4451 -5.4451 -3.2803 -3.2803 -3.2763 -3.2763 -2.9659 -2.9659 -2.9076 -2.9076 -2.8889 -2.8889 0.2357 0.2357 2.0418 2.0418 2.4438 2.4438 2.7466 2.7466 2.9017 2.9017 3.3064 3.3064 5.2290 5.2290 5.4190 5.4190 6.4053 6.4053 6.5699 6.5699 7.0528 7.0528 7.4218 7.4218 k = 0.3182-0.4534-0.2792 ( 8844 PWs) bands (ev): -27.1924 -27.1924 -27.1884 -27.1884 -27.0978 -27.0978 -27.0884 -27.0884 -10.9159 -10.9159 -10.9030 -10.9030 -10.8260 -10.8260 -10.7871 -10.7871 -10.6655 -10.6655 -10.6529 -10.6529 -10.6083 -10.6083 -10.5989 -10.5989 -10.5286 -10.5286 -10.5187 -10.5187 -10.4801 -10.4801 -10.4620 -10.4620 -6.0676 -6.0676 -5.4428 -5.4428 -3.2804 -3.2804 -3.2759 -3.2759 -2.9659 -2.9659 -2.9076 -2.9076 -2.8874 -2.8874 0.2435 0.2435 2.0178 2.0178 2.4449 2.4449 2.7504 2.7504 2.8816 2.8816 3.3069 3.3069 5.2311 5.2311 5.4404 5.4404 6.4031 6.4031 6.5422 6.5422 7.0117 7.0117 7.4344 7.4344 k = 0.3333-0.4750-0.2925 ( 8848 PWs) bands (ev): -27.1922 -27.1922 -27.1884 -27.1884 -27.0976 -27.0976 -27.0887 -27.0887 -10.9158 -10.9158 -10.9036 -10.9036 -10.8263 -10.8263 -10.7902 -10.7902 -10.6659 -10.6659 -10.6531 -10.6531 -10.6079 -10.6079 -10.5985 -10.5985 -10.5286 -10.5286 -10.5182 -10.5182 -10.4802 -10.4802 -10.4614 -10.4614 -6.0633 -6.0633 -5.4406 -5.4406 -3.2804 -3.2804 -3.2756 -3.2756 -2.9660 -2.9660 -2.9077 -2.9077 -2.8859 -2.8859 0.2511 0.2511 1.9956 1.9956 2.4461 2.4461 2.7540 2.7540 2.8625 2.8625 3.3075 3.3075 5.2169 5.2169 5.4752 5.4752 6.4009 6.4009 6.5201 6.5201 6.9708 6.9708 7.4354 7.4354 k = 0.3485-0.4966-0.3058 ( 8838 PWs) bands (ev): -27.1920 -27.1920 -27.1885 -27.1885 -27.0975 -27.0975 -27.0890 -27.0890 -10.9158 -10.9158 -10.9042 -10.9042 -10.8264 -10.8264 -10.7932 -10.7932 -10.6664 -10.6664 -10.6533 -10.6533 -10.6076 -10.6076 -10.5981 -10.5981 -10.5285 -10.5285 -10.5180 -10.5180 -10.4801 -10.4801 -10.4608 -10.4608 -6.0593 -6.0593 -5.4385 -5.4385 -3.2804 -3.2804 -3.2752 -3.2752 -2.9660 -2.9660 -2.9077 -2.9077 -2.8844 -2.8844 0.2583 0.2583 1.9753 1.9753 2.4475 2.4475 2.7575 2.7575 2.8446 2.8446 3.3081 3.3081 5.1965 5.1965 5.5129 5.5129 6.3986 6.3986 6.5039 6.5039 6.9314 6.9314 7.4263 7.4263 k = 0.3636-0.5182-0.3191 ( 8830 PWs) bands (ev): -27.1918 -27.1918 -27.1885 -27.1885 -27.0973 -27.0973 -27.0893 -27.0893 -10.9157 -10.9157 -10.9047 -10.9047 -10.8264 -10.8264 -10.7961 -10.7961 -10.6668 -10.6668 -10.6535 -10.6535 -10.6073 -10.6073 -10.5977 -10.5977 -10.5283 -10.5283 -10.5178 -10.5178 -10.4800 -10.4800 -10.4602 -10.4602 -6.0555 -6.0555 -5.4365 -5.4365 -3.2805 -3.2805 -3.2748 -3.2748 -2.9660 -2.9660 -2.9077 -2.9077 -2.8831 -2.8831 0.2650 0.2650 1.9570 1.9570 2.4490 2.4490 2.7607 2.7607 2.8281 2.8281 3.3087 3.3087 5.1748 5.1748 5.5480 5.5480 6.3962 6.3962 6.4939 6.4939 6.8945 6.8945 7.4092 7.4092 k = 0.3788-0.5398-0.3324 ( 8829 PWs) bands (ev): -27.1917 -27.1917 -27.1885 -27.1885 -27.0971 -27.0971 -27.0896 -27.0896 -10.9157 -10.9157 -10.9051 -10.9051 -10.8262 -10.8262 -10.7989 -10.7989 -10.6673 -10.6673 -10.6535 -10.6535 -10.6071 -10.6071 -10.5974 -10.5974 -10.5280 -10.5280 -10.5179 -10.5179 -10.4798 -10.4798 -10.4597 -10.4597 -6.0521 -6.0521 -5.4347 -5.4347 -3.2805 -3.2805 -3.2745 -3.2745 -2.9661 -2.9661 -2.9077 -2.9077 -2.8818 -2.8818 0.2712 0.2712 1.9406 1.9406 2.4505 2.4505 2.7636 2.7636 2.8130 2.8130 3.3092 3.3092 5.1537 5.1537 5.5785 5.5785 6.3940 6.3940 6.4899 6.4899 6.8606 6.8606 7.3865 7.3865 k = 0.3939-0.5614-0.3457 ( 8825 PWs) bands (ev): -27.1915 -27.1915 -27.1886 -27.1886 -27.0969 -27.0969 -27.0898 -27.0898 -10.9157 -10.9157 -10.9055 -10.9055 -10.8258 -10.8258 -10.8017 -10.8017 -10.6677 -10.6677 -10.6536 -10.6536 -10.6068 -10.6068 -10.5971 -10.5971 -10.5277 -10.5277 -10.5181 -10.5181 -10.4796 -10.4796 -10.4592 -10.4592 -6.0490 -6.0490 -5.4331 -5.4331 -3.2805 -3.2805 -3.2742 -3.2742 -2.9661 -2.9661 -2.9077 -2.9077 -2.8807 -2.8807 0.2769 0.2769 1.9261 1.9261 2.4520 2.4520 2.7661 2.7661 2.7994 2.7994 3.3098 3.3098 5.1344 5.1344 5.6035 5.6035 6.3919 6.3919 6.4914 6.4914 6.8302 6.8302 7.3602 7.3602 k = 0.4091-0.5830-0.3590 ( 8829 PWs) bands (ev): -27.1914 -27.1914 -27.1886 -27.1886 -27.0967 -27.0967 -27.0901 -27.0901 -10.9158 -10.9158 -10.9059 -10.9059 -10.8252 -10.8252 -10.8044 -10.8044 -10.6681 -10.6681 -10.6536 -10.6536 -10.6066 -10.6066 -10.5969 -10.5969 -10.5272 -10.5272 -10.5184 -10.5184 -10.4794 -10.4794 -10.4588 -10.4588 -6.0462 -6.0462 -5.4316 -5.4316 -3.2806 -3.2806 -3.2740 -3.2740 -2.9661 -2.9661 -2.9077 -2.9077 -2.8796 -2.8796 0.2819 0.2819 1.9136 1.9136 2.4535 2.4535 2.7681 2.7681 2.7877 2.7877 3.3102 3.3102 5.1172 5.1172 5.6232 5.6232 6.3901 6.3901 6.4974 6.4974 6.8035 6.8035 7.3324 7.3324 k = 0.4242-0.6046-0.3723 ( 8825 PWs) bands (ev): -27.1913 -27.1913 -27.1887 -27.1887 -27.0966 -27.0966 -27.0903 -27.0903 -10.9158 -10.9158 -10.9061 -10.9061 -10.8244 -10.8244 -10.8070 -10.8070 -10.6685 -10.6685 -10.6537 -10.6537 -10.6064 -10.6064 -10.5968 -10.5968 -10.5267 -10.5267 -10.5189 -10.5189 -10.4791 -10.4791 -10.4585 -10.4585 -6.0438 -6.0438 -5.4304 -5.4304 -3.2806 -3.2806 -3.2738 -3.2738 -2.9662 -2.9662 -2.9077 -2.9077 -2.8788 -2.8788 0.2863 0.2863 1.9030 1.9030 2.4548 2.4548 2.7685 2.7685 2.7789 2.7789 3.3107 3.3107 5.1024 5.1024 5.6379 5.6379 6.3886 6.3886 6.5065 6.5065 6.7809 6.7809 7.3047 7.3047 k = 0.4394-0.6262-0.3856 ( 8825 PWs) bands (ev): -27.1912 -27.1912 -27.1887 -27.1887 -27.0964 -27.0964 -27.0905 -27.0905 -10.9159 -10.9159 -10.9064 -10.9064 -10.8235 -10.8235 -10.8094 -10.8094 -10.6688 -10.6688 -10.6537 -10.6537 -10.6062 -10.6062 -10.5967 -10.5967 -10.5262 -10.5262 -10.5194 -10.5194 -10.4789 -10.4789 -10.4582 -10.4582 -6.0419 -6.0419 -5.4293 -5.4293 -3.2806 -3.2806 -3.2736 -3.2736 -2.9662 -2.9662 -2.9077 -2.9077 -2.8780 -2.8780 0.2899 0.2899 1.8944 1.8944 2.4560 2.4560 2.7649 2.7649 2.7756 2.7756 3.3110 3.3110 5.0902 5.0902 5.6484 5.6484 6.3874 6.3874 6.5172 6.5172 6.7626 6.7626 7.2788 7.2788 k = 0.4545-0.6478-0.3989 ( 8816 PWs) bands (ev): -27.1911 -27.1911 -27.1888 -27.1888 -27.0963 -27.0963 -27.0906 -27.0906 -10.9159 -10.9159 -10.9065 -10.9065 -10.8224 -10.8224 -10.8117 -10.8117 -10.6690 -10.6690 -10.6537 -10.6537 -10.6061 -10.6061 -10.5966 -10.5966 -10.5256 -10.5256 -10.5199 -10.5199 -10.4787 -10.4787 -10.4579 -10.4579 -6.0403 -6.0403 -5.4285 -5.4285 -3.2806 -3.2806 -3.2735 -3.2735 -2.9662 -2.9662 -2.9077 -2.9077 -2.8775 -2.8775 0.2927 0.2927 1.8876 1.8876 2.4571 2.4571 2.7592 2.7592 2.7758 2.7758 3.3113 3.3113 5.0806 5.0806 5.6556 5.6556 6.3864 6.3864 6.5278 6.5278 6.7486 6.7486 7.2563 7.2563 k = 0.4697-0.6694-0.4122 ( 8813 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9160 -10.9160 -10.9066 -10.9066 -10.8211 -10.8211 -10.8138 -10.8138 -10.6692 -10.6692 -10.6537 -10.6537 -10.6060 -10.6060 -10.5965 -10.5965 -10.5251 -10.5251 -10.5204 -10.5204 -10.4786 -10.4786 -10.4578 -10.4578 -6.0392 -6.0392 -5.4279 -5.4279 -3.2806 -3.2806 -3.2734 -3.2734 -2.9662 -2.9662 -2.9077 -2.9077 -2.8770 -2.8770 0.2948 0.2948 1.8829 1.8829 2.4578 2.4578 2.7546 2.7546 2.7764 2.7764 3.3115 3.3115 5.0737 5.0737 5.6601 5.6601 6.3856 6.3856 6.5366 6.5366 6.7388 6.7388 7.2388 7.2388 k = 0.4848-0.6910-0.4255 ( 8828 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9160 -10.9160 -10.9067 -10.9067 -10.8197 -10.8197 -10.8157 -10.8157 -10.6694 -10.6694 -10.6537 -10.6537 -10.6059 -10.6059 -10.5965 -10.5965 -10.5247 -10.5247 -10.5208 -10.5208 -10.4785 -10.4785 -10.4577 -10.4577 -6.0385 -6.0385 -5.4276 -5.4276 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8768 -2.8768 0.2960 0.2960 1.8800 1.8800 2.4583 2.4583 2.7518 2.7518 2.7769 2.7769 3.3116 3.3116 5.0696 5.0696 5.6626 5.6626 6.3852 6.3852 6.5425 6.5425 6.7331 6.7331 7.2277 7.2277 k = 0.5000-0.7126-0.4388 ( 8826 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8187 -10.8187 -10.8169 -10.8169 -10.6694 -10.6694 -10.6537 -10.6537 -10.6059 -10.6059 -10.5965 -10.5965 -10.5246 -10.5246 -10.5209 -10.5209 -10.4785 -10.4785 -10.4577 -10.4577 -6.0383 -6.0383 -5.4275 -5.4275 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8767 -2.8767 0.2965 0.2965 1.8790 1.8790 2.4584 2.4584 2.7508 2.7508 2.7770 2.7770 3.3117 3.3117 5.0682 5.0682 5.6634 5.6634 6.3851 6.3851 6.5446 6.5446 6.7312 6.7312 7.2239 7.2239 k = 0.5000-0.7126-0.4388 ( 8826 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8187 -10.8187 -10.8169 -10.8169 -10.6694 -10.6694 -10.6537 -10.6537 -10.6059 -10.6059 -10.5965 -10.5965 -10.5246 -10.5246 -10.5209 -10.5209 -10.4785 -10.4785 -10.4577 -10.4577 -6.0383 -6.0383 -5.4275 -5.4275 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8767 -2.8767 0.2965 0.2965 1.8790 1.8790 2.4584 2.4584 2.7508 2.7508 2.7770 2.7770 3.3117 3.3117 5.0682 5.0682 5.6634 5.6634 6.3851 6.3851 6.5446 6.5446 6.7312 6.7312 7.2239 7.2239 k = 0.5000-0.6968-0.4643 ( 8830 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8189 -10.8189 -10.8167 -10.8167 -10.6696 -10.6696 -10.6534 -10.6534 -10.6062 -10.6062 -10.5961 -10.5961 -10.5261 -10.5261 -10.5194 -10.5194 -10.4785 -10.4785 -10.4577 -10.4577 -6.0382 -6.0382 -5.4274 -5.4274 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8767 -2.8767 0.2967 0.2967 1.8801 1.8801 2.4583 2.4583 2.7515 2.7515 2.7747 2.7747 3.3100 3.3100 5.0692 5.0692 5.6660 5.6660 6.3761 6.3761 6.5432 6.5432 6.7414 6.7414 7.2237 7.2237 k = 0.5000-0.6811-0.4898 ( 8832 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8195 -10.8195 -10.8164 -10.8164 -10.6704 -10.6704 -10.6525 -10.6525 -10.6070 -10.6070 -10.5952 -10.5952 -10.5287 -10.5287 -10.5168 -10.5168 -10.4784 -10.4784 -10.4579 -10.4579 -6.0380 -6.0380 -5.4274 -5.4274 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8766 -2.8766 0.2974 0.2974 1.8833 1.8833 2.4580 2.4580 2.7536 2.7536 2.7677 2.7677 3.3051 3.3051 5.0723 5.0723 5.6738 5.6738 6.3519 6.3519 6.5391 6.5391 6.7691 6.7691 7.2234 7.2234 k = 0.5000-0.6654-0.5154 ( 8816 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8202 -10.8202 -10.8160 -10.8160 -10.6714 -10.6714 -10.6513 -10.6513 -10.6082 -10.6082 -10.5939 -10.5939 -10.5314 -10.5314 -10.5142 -10.5142 -10.4784 -10.4784 -10.4581 -10.4581 -6.0376 -6.0376 -5.4272 -5.4272 -3.2806 -3.2806 -3.2732 -3.2732 -2.9662 -2.9662 -2.9077 -2.9077 -2.8765 -2.8765 0.2986 0.2986 1.8886 1.8886 2.4575 2.4575 2.7546 2.7546 2.7586 2.7586 3.2969 3.2969 5.0773 5.0773 5.6862 5.6862 6.3181 6.3181 6.5324 6.5324 6.8085 6.8085 7.2237 7.2237 k = 0.5000-0.6497-0.5409 ( 8816 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0960 -27.0960 -27.0910 -27.0910 -10.9161 -10.9161 -10.9067 -10.9067 -10.8210 -10.8210 -10.8157 -10.8157 -10.6726 -10.6726 -10.6498 -10.6498 -10.6095 -10.6095 -10.5923 -10.5923 -10.5341 -10.5341 -10.5115 -10.5115 -10.4783 -10.4783 -10.4584 -10.4584 -6.0371 -6.0371 -5.4270 -5.4270 -3.2806 -3.2806 -3.2732 -3.2732 -2.9662 -2.9662 -2.9077 -2.9077 -2.8763 -2.8763 0.3002 0.3002 1.8959 1.8959 2.4567 2.4567 2.7399 2.7399 2.7626 2.7626 3.2858 3.2858 5.0844 5.0844 5.7028 5.7028 6.2797 6.2797 6.5225 6.5225 6.8546 6.8546 7.2256 7.2256 k = 0.5000-0.6340-0.5664 ( 8816 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0959 -27.0959 -27.0911 -27.0911 -10.9161 -10.9161 -10.9066 -10.9066 -10.8218 -10.8218 -10.8155 -10.8155 -10.6739 -10.6739 -10.6482 -10.6482 -10.6109 -10.6109 -10.5906 -10.5906 -10.5368 -10.5368 -10.5089 -10.5089 -10.4782 -10.4782 -10.4589 -10.4589 -6.0364 -6.0364 -5.4268 -5.4268 -3.2806 -3.2806 -3.2731 -3.2731 -2.9662 -2.9662 -2.9077 -2.9077 -2.8760 -2.8760 0.3023 0.3023 1.9053 1.9053 2.4555 2.4555 2.7203 2.7203 2.7689 2.7689 3.2718 3.2718 5.0934 5.0934 5.7223 5.7223 6.2405 6.2405 6.5090 6.5090 6.9045 6.9045 7.2301 7.2301 k = 0.5000-0.6183-0.5919 ( 8814 PWs) bands (ev): -27.1908 -27.1908 -27.1889 -27.1889 -27.0959 -27.0959 -27.0912 -27.0912 -10.9161 -10.9161 -10.9066 -10.9066 -10.8227 -10.8227 -10.8153 -10.8153 -10.6753 -10.6753 -10.6464 -10.6464 -10.6123 -10.6123 -10.5889 -10.5889 -10.5394 -10.5394 -10.5064 -10.5064 -10.4782 -10.4782 -10.4594 -10.4594 -6.0356 -6.0356 -5.4266 -5.4266 -3.2806 -3.2806 -3.2731 -3.2731 -2.9662 -2.9662 -2.9077 -2.9077 -2.8758 -2.8758 0.3047 0.3047 1.9166 1.9166 2.4540 2.4540 2.6973 2.6973 2.7767 2.7767 3.2555 3.2555 5.1044 5.1044 5.7435 5.7435 6.2030 6.2030 6.4914 6.4914 6.9562 6.9562 7.2380 7.2380 k = 0.5000-0.6025-0.6175 ( 8822 PWs) bands (ev): -27.1907 -27.1907 -27.1889 -27.1889 -27.0958 -27.0958 -27.0913 -27.0913 -10.9162 -10.9162 -10.9065 -10.9065 -10.8236 -10.8236 -10.8152 -10.8152 -10.6766 -10.6766 -10.6446 -10.6446 -10.6137 -10.6137 -10.5871 -10.5871 -10.5420 -10.5420 -10.5039 -10.5039 -10.4781 -10.4781 -10.4599 -10.4599 -6.0348 -6.0348 -5.4263 -5.4263 -3.2806 -3.2806 -3.2730 -3.2730 -2.9663 -2.9663 -2.9077 -2.9077 -2.8754 -2.8754 0.3074 0.3074 1.9297 1.9297 2.4520 2.4520 2.6715 2.6715 2.7857 2.7857 3.2370 3.2370 5.1174 5.1174 5.7641 5.7641 6.1699 6.1699 6.4698 6.4698 7.0083 7.0083 7.2498 7.2498 k = 0.5000-0.5868-0.6430 ( 8826 PWs) bands (ev): -27.1907 -27.1907 -27.1889 -27.1889 -27.0957 -27.0957 -27.0915 -27.0915 -10.9162 -10.9162 -10.9065 -10.9065 -10.8245 -10.8245 -10.8152 -10.8152 -10.6779 -10.6779 -10.6428 -10.6428 -10.6151 -10.6151 -10.5853 -10.5853 -10.5444 -10.5444 -10.5016 -10.5016 -10.4780 -10.4780 -10.4605 -10.4605 -6.0338 -6.0338 -5.4261 -5.4261 -3.2806 -3.2806 -3.2729 -3.2729 -2.9663 -2.9663 -2.9077 -2.9077 -2.8751 -2.8751 0.3105 0.3105 1.9447 1.9447 2.4493 2.4493 2.6434 2.6434 2.7960 2.7960 3.2167 3.2167 5.1323 5.1323 5.7813 5.7813 6.1443 6.1443 6.4441 6.4441 7.0599 7.0599 7.2652 7.2652 k = 0.5000-0.5711-0.6685 ( 8826 PWs) bands (ev): -27.1906 -27.1906 -27.1890 -27.1890 -27.0955 -27.0955 -27.0916 -27.0916 -10.9162 -10.9162 -10.9064 -10.9064 -10.8254 -10.8254 -10.8153 -10.8153 -10.6792 -10.6792 -10.6410 -10.6410 -10.6164 -10.6164 -10.5835 -10.5835 -10.5468 -10.5468 -10.4994 -10.4994 -10.4779 -10.4779 -10.4612 -10.4612 -6.0327 -6.0327 -5.4258 -5.4258 -3.2806 -3.2806 -3.2728 -3.2728 -2.9663 -2.9663 -2.9077 -2.9077 -2.8747 -2.8747 0.3138 0.3138 1.9613 1.9613 2.4458 2.4458 2.6140 2.6140 2.8074 2.8074 3.1951 3.1951 5.1491 5.1491 5.7918 5.7918 6.1292 6.1292 6.4150 6.4150 7.1102 7.1102 7.2839 7.2839 k = 0.5000-0.5554-0.6940 ( 8820 PWs) bands (ev): -27.1905 -27.1905 -27.1890 -27.1890 -27.0954 -27.0954 -27.0918 -27.0918 -10.9163 -10.9163 -10.9064 -10.9064 -10.8262 -10.8262 -10.8154 -10.8154 -10.6803 -10.6803 -10.6393 -10.6393 -10.6177 -10.6177 -10.5817 -10.5817 -10.5490 -10.5490 -10.4972 -10.4972 -10.4779 -10.4779 -10.4619 -10.4619 -6.0316 -6.0316 -5.4256 -5.4256 -3.2806 -3.2806 -3.2727 -3.2727 -2.9663 -2.9663 -2.9077 -2.9077 -2.8743 -2.8743 0.3172 0.3172 1.9794 1.9794 2.4411 2.4411 2.5838 2.5838 2.8200 2.8200 3.1726 3.1726 5.1678 5.1678 5.7927 5.7927 6.1272 6.1272 6.3828 6.3828 7.1585 7.1585 7.3047 7.3047 k = 0.5000-0.5397-0.7196 ( 8806 PWs) bands (ev): -27.1904 -27.1904 -27.1891 -27.1891 -27.0952 -27.0952 -27.0920 -27.0920 -10.9163 -10.9163 -10.9063 -10.9063 -10.8270 -10.8270 -10.8155 -10.8155 -10.6813 -10.6813 -10.6376 -10.6376 -10.6190 -10.6190 -10.5799 -10.5799 -10.5511 -10.5511 -10.4952 -10.4952 -10.4779 -10.4779 -10.4625 -10.4625 -6.0304 -6.0304 -5.4255 -5.4255 -3.2806 -3.2806 -3.2726 -3.2726 -2.9663 -2.9663 -2.9077 -2.9077 -2.8738 -2.8738 0.3208 0.3208 1.9988 1.9988 2.4345 2.4345 2.5541 2.5541 2.8334 2.8334 3.1496 3.1496 5.1882 5.1882 5.7836 5.7836 6.1385 6.1385 6.3485 6.3485 7.2041 7.2041 7.3265 7.3265 k = 0.5000-0.5239-0.7451 ( 8808 PWs) bands (ev): -27.1904 -27.1904 -27.1891 -27.1891 -27.0951 -27.0951 -27.0921 -27.0921 -10.9162 -10.9162 -10.9063 -10.9063 -10.8277 -10.8277 -10.8157 -10.8157 -10.6823 -10.6823 -10.6361 -10.6361 -10.6202 -10.6202 -10.5782 -10.5782 -10.5530 -10.5530 -10.4934 -10.4934 -10.4780 -10.4780 -10.4631 -10.4631 -6.0292 -6.0292 -5.4254 -5.4254 -3.2806 -3.2806 -3.2725 -3.2725 -2.9663 -2.9663 -2.9077 -2.9077 -2.8734 -2.8734 0.3244 0.3244 2.0193 2.0193 2.4252 2.4252 2.5263 2.5263 2.8476 2.8476 3.1267 3.1267 5.2105 5.2105 5.7663 5.7663 6.1606 6.1606 6.3126 6.3126 7.2462 7.2462 7.3478 7.3478 k = 0.5000-0.5082-0.7706 ( 8806 PWs) bands (ev): -27.1903 -27.1903 -27.1892 -27.1892 -27.0949 -27.0949 -27.0923 -27.0923 -10.9162 -10.9162 -10.9063 -10.9063 -10.8284 -10.8284 -10.8159 -10.8159 -10.6831 -10.6831 -10.6347 -10.6347 -10.6213 -10.6213 -10.5766 -10.5766 -10.5548 -10.5548 -10.4917 -10.4917 -10.4782 -10.4782 -10.4637 -10.4637 -6.0280 -6.0280 -5.4254 -5.4254 -3.2806 -3.2806 -3.2724 -3.2724 -2.9663 -2.9663 -2.9077 -2.9077 -2.8729 -2.8729 0.3280 0.3280 2.0408 2.0408 2.4120 2.4120 2.5021 2.5021 2.8623 2.8623 3.1043 3.1043 5.2345 5.2345 5.7438 5.7438 6.1904 6.1904 6.2759 6.2759 7.2840 7.2840 7.3670 7.3670 k = 0.5000-0.4925-0.7961 ( 8806 PWs) bands (ev): -27.1902 -27.1902 -27.1893 -27.1893 -27.0947 -27.0947 -27.0926 -27.0926 -10.9161 -10.9161 -10.9063 -10.9063 -10.8290 -10.8290 -10.8162 -10.8162 -10.6838 -10.6838 -10.6335 -10.6335 -10.6222 -10.6222 -10.5750 -10.5750 -10.5565 -10.5565 -10.4901 -10.4901 -10.4786 -10.4786 -10.4641 -10.4641 -6.0268 -6.0268 -5.4255 -5.4255 -3.2806 -3.2806 -3.2723 -3.2723 -2.9663 -2.9663 -2.9077 -2.9077 -2.8724 -2.8724 0.3315 0.3315 2.0627 2.0627 2.3939 2.3939 2.4829 2.4829 2.8772 2.8772 3.0831 3.0831 5.2601 5.2601 5.7185 5.7185 6.2230 6.2230 6.2408 6.2408 7.3168 7.3168 7.3828 7.3828 k = 0.5000-0.4768-0.8217 ( 8798 PWs) bands (ev): -27.1900 -27.1900 -27.1893 -27.1893 -27.0945 -27.0945 -27.0928 -27.0928 -10.9160 -10.9160 -10.9063 -10.9063 -10.8295 -10.8295 -10.8164 -10.8164 -10.6844 -10.6844 -10.6326 -10.6326 -10.6230 -10.6230 -10.5735 -10.5735 -10.5580 -10.5580 -10.4887 -10.4887 -10.4790 -10.4790 -10.4644 -10.4644 -6.0257 -6.0257 -5.4258 -5.4258 -3.2806 -3.2806 -3.2722 -3.2722 -2.9663 -2.9663 -2.9077 -2.9077 -2.8720 -2.8720 0.3348 0.3348 2.0848 2.0848 2.3717 2.3717 2.4687 2.4687 2.8916 2.8916 3.0638 3.0638 5.2874 5.2874 5.6923 5.6923 6.2009 6.2009 6.2635 6.2635 7.3434 7.3434 7.3942 7.3942 k = 0.5000-0.4611-0.8472 ( 8808 PWs) bands (ev): -27.1899 -27.1899 -27.1894 -27.1894 -27.0942 -27.0942 -27.0930 -27.0930 -10.9159 -10.9159 -10.9064 -10.9064 -10.8298 -10.8298 -10.8167 -10.8167 -10.6848 -10.6848 -10.6320 -10.6320 -10.6235 -10.6235 -10.5721 -10.5721 -10.5593 -10.5593 -10.4876 -10.4876 -10.4795 -10.4795 -10.4647 -10.4647 -6.0247 -6.0247 -5.4262 -5.4262 -3.2806 -3.2806 -3.2721 -3.2721 -2.9663 -2.9663 -2.9077 -2.9077 -2.8716 -2.8716 0.3379 0.3379 2.1063 2.1063 2.3475 2.3475 2.4581 2.4581 2.9046 2.9046 3.0477 3.0477 5.3161 5.3161 5.6663 5.6663 6.1653 6.1653 6.3018 6.3018 7.3626 7.3626 7.4009 7.4009 k = 0.5000-0.4453-0.8727 ( 8820 PWs) bands (ev): -27.1899 -27.1899 -27.1895 -27.1895 -27.0940 -27.0940 -27.0933 -27.0933 -10.9158 -10.9158 -10.9064 -10.9064 -10.8301 -10.8301 -10.8169 -10.8169 -10.6852 -10.6852 -10.6318 -10.6318 -10.6236 -10.6236 -10.5709 -10.5709 -10.5605 -10.5605 -10.4869 -10.4869 -10.4799 -10.4799 -10.4647 -10.4647 -6.0238 -6.0238 -5.4268 -5.4268 -3.2806 -3.2806 -3.2720 -3.2720 -2.9664 -2.9664 -2.9077 -2.9077 -2.8712 -2.8712 0.3406 0.3406 2.1264 2.1264 2.3234 2.3234 2.4500 2.4500 2.9149 2.9149 3.0362 3.0362 5.3463 5.3463 5.6414 5.6414 6.1307 6.1307 6.3405 6.3405 7.3722 7.3722 7.4047 7.4047 k = 0.5000-0.4296-0.8982 ( 8814 PWs) bands (ev): -27.1897 -27.1897 -27.1896 -27.1896 -27.0938 -27.0938 -27.0935 -27.0935 -10.9156 -10.9156 -10.9065 -10.9065 -10.8302 -10.8302 -10.8171 -10.8171 -10.6854 -10.6854 -10.6320 -10.6320 -10.6234 -10.6234 -10.5698 -10.5698 -10.5614 -10.5614 -10.4867 -10.4867 -10.4800 -10.4800 -10.4647 -10.4647 -6.0229 -6.0229 -5.4276 -5.4276 -3.2806 -3.2806 -3.2719 -3.2719 -2.9664 -2.9664 -2.9077 -2.9077 -2.8708 -2.8708 0.3430 0.3430 2.1438 2.1438 2.3016 2.3016 2.4437 2.4437 2.9204 2.9204 3.0313 3.0313 5.3779 5.3779 5.6180 5.6180 6.0976 6.0976 6.3789 6.3789 7.3702 7.3702 7.4077 7.4077 k = 0.5000-0.4139-0.9238 ( 8816 PWs) bands (ev): -27.1897 -27.1897 -27.1896 -27.1896 -27.0938 -27.0938 -27.0935 -27.0935 -10.9154 -10.9154 -10.9066 -10.9066 -10.8303 -10.8303 -10.8172 -10.8172 -10.6854 -10.6854 -10.6324 -10.6324 -10.6230 -10.6230 -10.5690 -10.5690 -10.5619 -10.5619 -10.4870 -10.4870 -10.4799 -10.4799 -10.4646 -10.4646 -6.0223 -6.0223 -5.4286 -5.4286 -3.2806 -3.2806 -3.2718 -3.2718 -2.9664 -2.9664 -2.9077 -2.9077 -2.8705 -2.8705 0.3450 0.3450 2.1563 2.1563 2.2841 2.2841 2.4394 2.4394 2.9201 2.9201 3.0340 3.0340 5.4106 5.4106 5.5966 5.5966 6.0666 6.0666 6.4163 6.4163 7.3585 7.3585 7.4089 7.4089 k = 0.5000-0.3982-0.9493 ( 8822 PWs) bands (ev): -27.1899 -27.1899 -27.1895 -27.1895 -27.0941 -27.0941 -27.0932 -27.0932 -10.9152 -10.9152 -10.9067 -10.9067 -10.8302 -10.8302 -10.8173 -10.8173 -10.6854 -10.6854 -10.6331 -10.6331 -10.6225 -10.6225 -10.5686 -10.5686 -10.5620 -10.5620 -10.4879 -10.4879 -10.4794 -10.4794 -10.4645 -10.4645 -6.0217 -6.0217 -5.4299 -5.4299 -3.2806 -3.2806 -3.2718 -3.2718 -2.9664 -2.9664 -2.9077 -2.9077 -2.8703 -2.8703 0.3465 0.3465 2.1616 2.1616 2.2730 2.2730 2.4374 2.4374 2.9153 2.9153 3.0432 3.0432 5.4442 5.4442 5.5777 5.5777 6.0378 6.0378 6.4524 6.4524 7.3400 7.3400 7.4069 7.4069 k = 0.5000-0.3825-0.9748 ( 8808 PWs) bands (ev): -27.1900 -27.1900 -27.1894 -27.1894 -27.0943 -27.0943 -27.0930 -27.0930 -10.9149 -10.9149 -10.9067 -10.9067 -10.8300 -10.8300 -10.8172 -10.8172 -10.6852 -10.6852 -10.6338 -10.6338 -10.6219 -10.6219 -10.5686 -10.5686 -10.5617 -10.5617 -10.4892 -10.4892 -10.4788 -10.4788 -10.4642 -10.4642 -6.0214 -6.0214 -5.4314 -5.4314 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8701 -2.8701 0.3475 0.3475 2.1590 2.1590 2.2682 2.2682 2.4387 2.4387 2.9080 2.9080 3.0567 3.0567 5.4782 5.4782 5.5618 5.5618 6.0116 6.0116 6.4870 6.4870 7.3169 7.3169 7.4011 7.4011 k = 0.8104-0.2844-0.7803 ( 8808 PWs) bands (ev): -27.1900 -27.1900 -27.1894 -27.1894 -27.0943 -27.0943 -27.0930 -27.0930 -10.9149 -10.9149 -10.9067 -10.9067 -10.8300 -10.8300 -10.8172 -10.8172 -10.6852 -10.6852 -10.6338 -10.6338 -10.6219 -10.6219 -10.5686 -10.5686 -10.5617 -10.5617 -10.4892 -10.4892 -10.4788 -10.4788 -10.4642 -10.4642 -6.0214 -6.0214 -5.4314 -5.4314 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8701 -2.8701 0.3475 0.3475 2.1590 2.1590 2.2682 2.2682 2.4387 2.4387 2.9080 2.9080 3.0567 3.0567 5.4782 5.4782 5.5618 5.5618 6.0116 6.0116 6.4870 6.4870 7.3169 7.3169 7.4011 7.4011 k = 0.8013-0.2714-0.7545 ( 8810 PWs) bands (ev): -27.1901 -27.1901 -27.1893 -27.1893 -27.0946 -27.0946 -27.0927 -27.0927 -10.9147 -10.9147 -10.9067 -10.9067 -10.8297 -10.8297 -10.8171 -10.8171 -10.6849 -10.6849 -10.6346 -10.6346 -10.6213 -10.6213 -10.5691 -10.5691 -10.5609 -10.5609 -10.4906 -10.4906 -10.4781 -10.4781 -10.4640 -10.4640 -6.0213 -6.0213 -5.4331 -5.4331 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8699 -2.8699 0.3479 0.3479 2.1505 2.1505 2.2671 2.2671 2.4439 2.4439 2.9000 2.9000 3.0728 3.0728 5.5094 5.5094 5.5523 5.5523 5.9880 5.9880 6.5204 6.5204 7.2900 7.2900 7.3916 7.3916 k = 0.7921-0.2584-0.7287 ( 8812 PWs) bands (ev): -27.1902 -27.1902 -27.1892 -27.1892 -27.0949 -27.0949 -27.0924 -27.0924 -10.9145 -10.9145 -10.9066 -10.9066 -10.8293 -10.8293 -10.8167 -10.8167 -10.6845 -10.6845 -10.6354 -10.6354 -10.6208 -10.6208 -10.5697 -10.5697 -10.5599 -10.5599 -10.4923 -10.4923 -10.4775 -10.4775 -10.4638 -10.4638 -6.0214 -6.0214 -5.4352 -5.4352 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8699 -2.8699 0.3477 0.3477 2.1396 2.1396 2.2659 2.2659 2.4535 2.4535 2.8922 2.8922 3.0900 3.0900 5.5207 5.5207 5.5660 5.5660 5.9676 5.9676 6.5519 6.5519 7.2605 7.2605 7.3788 7.3788 k = 0.7830-0.2454-0.7029 ( 8822 PWs) bands (ev): -27.1904 -27.1904 -27.1891 -27.1891 -27.0952 -27.0952 -27.0921 -27.0921 -10.9144 -10.9144 -10.9065 -10.9065 -10.8289 -10.8289 -10.8161 -10.8161 -10.6840 -10.6840 -10.6362 -10.6362 -10.6203 -10.6203 -10.5705 -10.5705 -10.5588 -10.5588 -10.4941 -10.4941 -10.4769 -10.4769 -10.4635 -10.4635 -6.0217 -6.0217 -5.4375 -5.4375 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8699 -2.8699 0.3469 0.3469 2.1286 2.1286 2.2628 2.2628 2.4671 2.4671 2.8853 2.8853 3.1077 3.1077 5.5153 5.5153 5.5998 5.5998 5.9505 5.9505 6.5815 6.5815 7.2290 7.2290 7.3629 7.3629 k = 0.7739-0.2324-0.6771 ( 8826 PWs) bands (ev): -27.1905 -27.1905 -27.1891 -27.1891 -27.0954 -27.0954 -27.0917 -27.0917 -10.9144 -10.9144 -10.9062 -10.9062 -10.8285 -10.8285 -10.8153 -10.8153 -10.6834 -10.6834 -10.6370 -10.6370 -10.6198 -10.6198 -10.5714 -10.5714 -10.5576 -10.5576 -10.4959 -10.4959 -10.4763 -10.4763 -10.4633 -10.4633 -6.0223 -6.0223 -5.4401 -5.4401 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8700 -2.8700 0.3455 0.3455 2.1188 2.1188 2.2574 2.2574 2.4839 2.4839 2.8796 2.8796 3.1254 3.1254 5.5089 5.5089 5.6377 5.6377 5.9369 5.9369 6.6090 6.6090 7.1960 7.1960 7.3442 7.3442 k = 0.7648-0.2194-0.6513 ( 8826 PWs) bands (ev): -27.1907 -27.1907 -27.1890 -27.1890 -27.0957 -27.0957 -27.0914 -27.0914 -10.9145 -10.9145 -10.9058 -10.9058 -10.8281 -10.8281 -10.8142 -10.8142 -10.6827 -10.6827 -10.6378 -10.6378 -10.6193 -10.6193 -10.5723 -10.5723 -10.5564 -10.5564 -10.4978 -10.4978 -10.4758 -10.4758 -10.4631 -10.4631 -6.0231 -6.0231 -5.4429 -5.4429 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8703 -2.8703 0.3435 0.3435 2.1109 2.1109 2.2501 2.2501 2.5028 2.5028 2.8752 2.8752 3.1426 3.1426 5.5042 5.5042 5.6769 5.6769 5.9269 5.9269 6.6342 6.6342 7.1616 7.1616 7.3228 7.3228 k = 0.7556-0.2064-0.6255 ( 8830 PWs) bands (ev): -27.1909 -27.1909 -27.1889 -27.1889 -27.0960 -27.0960 -27.0911 -27.0911 -10.9147 -10.9147 -10.9053 -10.9053 -10.8277 -10.8277 -10.8128 -10.8128 -10.6819 -10.6819 -10.6386 -10.6386 -10.6189 -10.6189 -10.5734 -10.5734 -10.5551 -10.5551 -10.4997 -10.4997 -10.4754 -10.4754 -10.4630 -10.4630 -6.0242 -6.0242 -5.4461 -5.4461 -3.2806 -3.2806 -3.2718 -3.2718 -2.9663 -2.9663 -2.9076 -2.9076 -2.8706 -2.8706 0.3409 0.3409 2.1053 2.1053 2.2415 2.2415 2.5228 2.5228 2.8721 2.8721 3.1592 3.1592 5.5015 5.5015 5.7166 5.7166 5.9208 5.9208 6.6567 6.6567 7.1258 7.1258 7.2993 7.2993 k = 0.7465-0.1934-0.5996 ( 8834 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9149 -10.9149 -10.9046 -10.9046 -10.8273 -10.8273 -10.8112 -10.8112 -10.6810 -10.6810 -10.6393 -10.6393 -10.6185 -10.6185 -10.5744 -10.5744 -10.5539 -10.5539 -10.5016 -10.5016 -10.4750 -10.4750 -10.4628 -10.4628 -6.0255 -6.0255 -5.4495 -5.4495 -3.2806 -3.2806 -3.2719 -3.2719 -2.9662 -2.9662 -2.9076 -2.9076 -2.8710 -2.8710 0.3378 0.3378 2.1020 2.1020 2.2322 2.2322 2.5434 2.5434 2.8704 2.8704 3.1749 3.1749 5.5009 5.5009 5.7565 5.7565 5.9187 5.9187 6.6761 6.6761 7.0885 7.0885 7.2740 7.2740 k = 0.7374-0.1804-0.5738 ( 8832 PWs) bands (ev): -27.1912 -27.1912 -27.1887 -27.1887 -27.0965 -27.0965 -27.0904 -27.0904 -10.9152 -10.9152 -10.9039 -10.9039 -10.8268 -10.8268 -10.8093 -10.8093 -10.6801 -10.6801 -10.6400 -10.6400 -10.6181 -10.6181 -10.5755 -10.5755 -10.5526 -10.5526 -10.5035 -10.5035 -10.4747 -10.4747 -10.4628 -10.4628 -6.0271 -6.0271 -5.4532 -5.4532 -3.2806 -3.2806 -3.2720 -3.2720 -2.9662 -2.9662 -2.9076 -2.9076 -2.8714 -2.8714 0.3341 0.3341 2.1009 2.1009 2.2228 2.2228 2.5639 2.5639 2.8701 2.8701 3.1895 3.1895 5.5023 5.5023 5.7960 5.7960 5.9208 5.9208 6.6917 6.6917 7.0496 7.0496 7.2476 7.2476 k = 0.7282-0.1673-0.5480 ( 8836 PWs) bands (ev): -27.1914 -27.1914 -27.1887 -27.1887 -27.0967 -27.0967 -27.0901 -27.0901 -10.9155 -10.9155 -10.9031 -10.9031 -10.8263 -10.8263 -10.8071 -10.8071 -10.6792 -10.6792 -10.6407 -10.6407 -10.6177 -10.6177 -10.5767 -10.5767 -10.5514 -10.5514 -10.5055 -10.5055 -10.4745 -10.4745 -10.4627 -10.4627 -6.0289 -6.0289 -5.4571 -5.4571 -3.2805 -3.2805 -3.2721 -3.2721 -2.9662 -2.9662 -2.9076 -2.9076 -2.8720 -2.8720 0.3300 0.3300 2.1018 2.1018 2.2141 2.2141 2.5839 2.5839 2.8711 2.8711 3.2030 3.2030 5.5056 5.5056 5.8344 5.8344 5.9276 5.9276 6.7028 6.7028 7.0087 7.0087 7.2213 7.2213 k = 0.7191-0.1543-0.5222 ( 8830 PWs) bands (ev): -27.1915 -27.1915 -27.1886 -27.1886 -27.0970 -27.0970 -27.0897 -27.0897 -10.9159 -10.9159 -10.9023 -10.9023 -10.8257 -10.8257 -10.8048 -10.8048 -10.6782 -10.6782 -10.6413 -10.6413 -10.6174 -10.6174 -10.5780 -10.5780 -10.5501 -10.5501 -10.5074 -10.5074 -10.4743 -10.4743 -10.4628 -10.4628 -6.0310 -6.0310 -5.4613 -5.4613 -3.2805 -3.2805 -3.2723 -3.2723 -2.9661 -2.9661 -2.9076 -2.9076 -2.8727 -2.8727 0.3254 0.3254 2.1040 2.1040 2.2070 2.2070 2.6031 2.6031 2.8735 2.8735 3.2153 3.2153 5.5104 5.5104 5.8704 5.8704 5.9399 5.9399 6.7080 6.7080 6.9657 6.9657 7.1964 7.1964 k = 0.7100-0.1413-0.4964 ( 8824 PWs) bands (ev): -27.1917 -27.1917 -27.1886 -27.1886 -27.0972 -27.0972 -27.0894 -27.0894 -10.9163 -10.9163 -10.9015 -10.9015 -10.8250 -10.8250 -10.8023 -10.8023 -10.6772 -10.6772 -10.6419 -10.6419 -10.6170 -10.6170 -10.5793 -10.5793 -10.5489 -10.5489 -10.5092 -10.5092 -10.4741 -10.4741 -10.4628 -10.4628 -6.0334 -6.0334 -5.4657 -5.4657 -3.2805 -3.2805 -3.2724 -3.2724 -2.9661 -2.9661 -2.9076 -2.9076 -2.8734 -2.8734 0.3204 0.3204 2.1064 2.1064 2.2025 2.2025 2.6213 2.6213 2.8774 2.8774 3.2263 3.2263 5.5164 5.5164 5.9019 5.9019 5.9594 5.9594 6.7063 6.7063 6.9205 6.9205 7.1745 7.1745 k = 0.7008-0.1283-0.4706 ( 8834 PWs) bands (ev): -27.1919 -27.1919 -27.1885 -27.1885 -27.0975 -27.0975 -27.0891 -27.0891 -10.9167 -10.9167 -10.9007 -10.9007 -10.8242 -10.8242 -10.7996 -10.7996 -10.6763 -10.6763 -10.6424 -10.6424 -10.6166 -10.6166 -10.5807 -10.5807 -10.5476 -10.5476 -10.5111 -10.5111 -10.4740 -10.4740 -10.4630 -10.4630 -6.0359 -6.0359 -5.4702 -5.4702 -3.2804 -3.2804 -3.2726 -3.2726 -2.9660 -2.9660 -2.9075 -2.9075 -2.8743 -2.8743 0.3151 0.3151 2.1077 2.1077 2.2020 2.2020 2.6383 2.6383 2.8827 2.8827 3.2360 3.2360 5.5233 5.5233 5.9273 5.9273 5.9868 5.9868 6.6967 6.6967 6.8734 6.8734 7.1573 7.1573 k = 0.6917-0.1153-0.4448 ( 8824 PWs) bands (ev): -27.1921 -27.1921 -27.1885 -27.1885 -27.0977 -27.0977 -27.0887 -27.0887 -10.9170 -10.9170 -10.8999 -10.8999 -10.8233 -10.8233 -10.7968 -10.7968 -10.6753 -10.6753 -10.6429 -10.6429 -10.6163 -10.6163 -10.5822 -10.5822 -10.5464 -10.5464 -10.5129 -10.5129 -10.4739 -10.4739 -10.4632 -10.4632 -6.0387 -6.0387 -5.4749 -5.4749 -3.2804 -3.2804 -3.2728 -3.2728 -2.9660 -2.9660 -2.9075 -2.9075 -2.8752 -2.8752 0.3096 0.3096 2.1068 2.1068 2.2069 2.2069 2.6538 2.6538 2.8895 2.8895 3.2443 3.2443 5.5306 5.5306 5.9483 5.9483 6.0197 6.0197 6.6788 6.6788 6.8248 6.8248 7.1457 7.1457 k = 0.6826-0.1023-0.4190 ( 8820 PWs) bands (ev): -27.1923 -27.1923 -27.1884 -27.1884 -27.0979 -27.0979 -27.0884 -27.0884 -10.9174 -10.9174 -10.8991 -10.8991 -10.8223 -10.8223 -10.7939 -10.7939 -10.6744 -10.6744 -10.6433 -10.6433 -10.6160 -10.6160 -10.5837 -10.5837 -10.5451 -10.5451 -10.5147 -10.5147 -10.4739 -10.4739 -10.4634 -10.4634 -6.0416 -6.0416 -5.4798 -5.4798 -3.2804 -3.2804 -3.2731 -3.2731 -2.9659 -2.9659 -2.9075 -2.9075 -2.8761 -2.8761 0.3039 0.3039 2.1031 2.1031 2.2175 2.2175 2.6679 2.6679 2.8980 2.8980 3.2514 3.2514 5.5377 5.5377 5.9668 5.9668 6.0548 6.0548 6.6532 6.6532 6.7758 6.7758 7.1400 7.1400 k = 0.6735-0.0893-0.3932 ( 8824 PWs) bands (ev): -27.1925 -27.1925 -27.1884 -27.1884 -27.0981 -27.0981 -27.0881 -27.0881 -10.9177 -10.9177 -10.8984 -10.8984 -10.8211 -10.8211 -10.7910 -10.7910 -10.6735 -10.6735 -10.6436 -10.6436 -10.6157 -10.6157 -10.5853 -10.5853 -10.5439 -10.5439 -10.5164 -10.5164 -10.4739 -10.4739 -10.4637 -10.4637 -6.0447 -6.0447 -5.4847 -5.4847 -3.2803 -3.2803 -3.2733 -3.2733 -2.9659 -2.9659 -2.9075 -2.9075 -2.8771 -2.8771 0.2981 0.2981 2.0972 2.0972 2.2331 2.2331 2.6803 2.6803 2.9081 2.9081 3.2572 3.2572 5.5438 5.5438 5.9830 5.9830 6.0903 6.0903 6.6214 6.6214 6.7278 6.7278 7.1396 7.1396 k = 0.6643-0.0763-0.3674 ( 8818 PWs) bands (ev): -27.1926 -27.1926 -27.1884 -27.1884 -27.0983 -27.0983 -27.0877 -27.0877 -10.9180 -10.9180 -10.8978 -10.8978 -10.8199 -10.8199 -10.7880 -10.7880 -10.6727 -10.6727 -10.6438 -10.6438 -10.6154 -10.6154 -10.5869 -10.5869 -10.5426 -10.5426 -10.5181 -10.5181 -10.4740 -10.4740 -10.4640 -10.4640 -6.0479 -6.0479 -5.4898 -5.4898 -3.2803 -3.2803 -3.2736 -3.2736 -2.9658 -2.9658 -2.9075 -2.9075 -2.8782 -2.8782 0.2922 0.2922 2.0899 2.0899 2.2529 2.2529 2.6911 2.6911 2.9201 2.9201 3.2619 3.2619 5.5481 5.5481 5.9954 5.9954 6.1253 6.1253 6.5856 6.5856 6.6832 6.6832 7.1436 7.1436 k = 0.6552-0.0633-0.3415 ( 8826 PWs) bands (ev): -27.1928 -27.1928 -27.1884 -27.1884 -27.0984 -27.0984 -27.0874 -27.0874 -10.9183 -10.9183 -10.8972 -10.8972 -10.8185 -10.8185 -10.7849 -10.7849 -10.6720 -10.6720 -10.6439 -10.6439 -10.6151 -10.6151 -10.5885 -10.5885 -10.5414 -10.5414 -10.5197 -10.5197 -10.4741 -10.4741 -10.4644 -10.4644 -6.0512 -6.0512 -5.4948 -5.4948 -3.2802 -3.2802 -3.2738 -3.2738 -2.9658 -2.9658 -2.9075 -2.9075 -2.8793 -2.8793 0.2863 0.2863 2.0817 2.0817 2.2761 2.2761 2.7001 2.7001 2.9338 2.9338 3.2655 3.2655 5.5498 5.5498 6.0017 6.0017 6.1594 6.1594 6.5481 6.5481 6.6451 6.6451 7.1509 7.1509 k = 0.6461-0.0502-0.3157 ( 8824 PWs) bands (ev): -27.1930 -27.1930 -27.1884 -27.1884 -27.0986 -27.0986 -27.0871 -27.0871 -10.9185 -10.9185 -10.8966 -10.8966 -10.8170 -10.8170 -10.7819 -10.7819 -10.6713 -10.6713 -10.6439 -10.6439 -10.6149 -10.6149 -10.5901 -10.5901 -10.5401 -10.5401 -10.5212 -10.5212 -10.4744 -10.4744 -10.4647 -10.4647 -6.0545 -6.0545 -5.4999 -5.4999 -3.2802 -3.2802 -3.2741 -3.2741 -2.9657 -2.9657 -2.9074 -2.9074 -2.8804 -2.8804 0.2805 0.2805 2.0731 2.0731 2.3019 2.3019 2.7076 2.7076 2.9492 2.9492 3.2682 3.2682 5.5478 5.5478 5.9992 5.9992 6.1922 6.1922 6.5110 6.5110 6.6170 6.6170 7.1603 7.1603 k = 0.6369-0.0372-0.2899 ( 8840 PWs) bands (ev): -27.1932 -27.1932 -27.1884 -27.1884 -27.0988 -27.0988 -27.0869 -27.0869 -10.9187 -10.9187 -10.8962 -10.8962 -10.8155 -10.8155 -10.7790 -10.7790 -10.6707 -10.6707 -10.6438 -10.6438 -10.6147 -10.6147 -10.5918 -10.5918 -10.5388 -10.5388 -10.5227 -10.5227 -10.4748 -10.4748 -10.4649 -10.4649 -6.0579 -6.0579 -5.5049 -5.5049 -3.2802 -3.2802 -3.2744 -3.2744 -2.9657 -2.9657 -2.9074 -2.9074 -2.8815 -2.8815 0.2748 0.2748 2.0645 2.0645 2.3299 2.3299 2.7137 2.7137 2.9662 2.9662 3.2702 3.2702 5.5411 5.5411 5.9855 5.9855 6.2235 6.2235 6.4763 6.4763 6.6021 6.6021 7.1711 7.1711 k = 0.6278-0.0242-0.2641 ( 8842 PWs) bands (ev): -27.1933 -27.1933 -27.1884 -27.1884 -27.0989 -27.0989 -27.0866 -27.0866 -10.9188 -10.9188 -10.8958 -10.8958 -10.8138 -10.8138 -10.7761 -10.7761 -10.6702 -10.6702 -10.6437 -10.6437 -10.6146 -10.6146 -10.5935 -10.5935 -10.5375 -10.5375 -10.5240 -10.5240 -10.4754 -10.4754 -10.4651 -10.4651 -6.0613 -6.0613 -5.5098 -5.5098 -3.2801 -3.2801 -3.2747 -3.2747 -2.9656 -2.9656 -2.9074 -2.9074 -2.8826 -2.8826 0.2692 0.2692 2.0559 2.0559 2.3596 2.3596 2.7184 2.7184 2.9844 2.9844 3.2715 3.2715 5.5290 5.5290 5.9599 5.9599 6.2526 6.2526 6.4458 6.4458 6.6020 6.6020 7.1826 7.1826 k = 0.6187-0.0112-0.2383 ( 8848 PWs) bands (ev): -27.1935 -27.1935 -27.1884 -27.1884 -27.0991 -27.0991 -27.0863 -27.0863 -10.9190 -10.9190 -10.8954 -10.8954 -10.8122 -10.8122 -10.7733 -10.7733 -10.6697 -10.6697 -10.6435 -10.6435 -10.6145 -10.6145 -10.5951 -10.5951 -10.5363 -10.5363 -10.5251 -10.5251 -10.4762 -10.4762 -10.4652 -10.4652 -6.0647 -6.0647 -5.5145 -5.5145 -3.2801 -3.2801 -3.2749 -3.2749 -2.9656 -2.9656 -2.9074 -2.9074 -2.8837 -2.8837 0.2638 0.2638 2.0475 2.0475 2.3904 2.3904 2.7221 2.7221 3.0038 3.0038 3.2724 3.2724 5.5109 5.5109 5.9236 5.9236 6.2793 6.2793 6.4211 6.4211 6.6164 6.6164 7.1942 7.1942 k = 0.6096 0.0018-0.2125 ( 8842 PWs) bands (ev): -27.1936 -27.1936 -27.1884 -27.1884 -27.0992 -27.0992 -27.0861 -27.0861 -10.9191 -10.9191 -10.8951 -10.8951 -10.8105 -10.8105 -10.7706 -10.7706 -10.6693 -10.6693 -10.6432 -10.6432 -10.6145 -10.6145 -10.5966 -10.5966 -10.5353 -10.5353 -10.5259 -10.5259 -10.4772 -10.4772 -10.4651 -10.4651 -6.0679 -6.0679 -5.5192 -5.5192 -3.2801 -3.2801 -3.2752 -3.2752 -2.9655 -2.9655 -2.9074 -2.9074 -2.8847 -2.8847 0.2587 0.2587 2.0395 2.0395 2.4220 2.4220 2.7250 2.7250 3.0238 3.0238 3.2731 3.2731 5.4868 5.4868 5.8789 5.8789 6.3029 6.3029 6.4031 6.4031 6.6434 6.6434 7.2057 7.2057 k = 0.6004 0.0148-0.1867 ( 8846 PWs) bands (ev): -27.1938 -27.1938 -27.1884 -27.1884 -27.0993 -27.0993 -27.0859 -27.0859 -10.9191 -10.9191 -10.8948 -10.8948 -10.8088 -10.8088 -10.7680 -10.7680 -10.6689 -10.6689 -10.6429 -10.6429 -10.6145 -10.6145 -10.5981 -10.5981 -10.5347 -10.5347 -10.5261 -10.5261 -10.4784 -10.4784 -10.4650 -10.4650 -6.0711 -6.0711 -5.5236 -5.5236 -3.2800 -3.2800 -3.2755 -3.2755 -2.9655 -2.9655 -2.9074 -2.9074 -2.8857 -2.8857 0.2539 0.2539 2.0319 2.0319 2.4537 2.4537 2.7274 2.7274 3.0440 3.0440 3.2737 3.2737 5.4573 5.4573 5.8287 5.8287 6.3231 6.3231 6.3925 6.3925 6.6806 6.6806 7.2166 7.2166 k = 0.5913 0.0278-0.1609 ( 8854 PWs) bands (ev): -27.1939 -27.1939 -27.1884 -27.1884 -27.0994 -27.0994 -27.0856 -27.0856 -10.9192 -10.9192 -10.8946 -10.8946 -10.8072 -10.8072 -10.7657 -10.7657 -10.6685 -10.6685 -10.6426 -10.6426 -10.6146 -10.6146 -10.5994 -10.5994 -10.5346 -10.5346 -10.5257 -10.5257 -10.4798 -10.4798 -10.4648 -10.4648 -6.0741 -6.0741 -5.5277 -5.5277 -3.2800 -3.2800 -3.2757 -3.2757 -2.9655 -2.9655 -2.9074 -2.9074 -2.8867 -2.8867 0.2493 0.2493 2.0247 2.0247 2.4850 2.4850 2.7295 2.7295 3.0641 3.0641 3.2746 3.2746 5.4233 5.4233 5.7757 5.7757 6.3391 6.3391 6.3894 6.3894 6.7258 6.7258 7.2269 7.2269 k = 0.5822 0.0408-0.1351 ( 8856 PWs) bands (ev): -27.1940 -27.1940 -27.1884 -27.1884 -27.0995 -27.0995 -27.0854 -27.0854 -10.9192 -10.9192 -10.8944 -10.8944 -10.8056 -10.8056 -10.7635 -10.7635 -10.6682 -10.6682 -10.6423 -10.6423 -10.6148 -10.6148 -10.6007 -10.6007 -10.5349 -10.5349 -10.5247 -10.5247 -10.4813 -10.4813 -10.4646 -10.4646 -6.0770 -6.0770 -5.5316 -5.5316 -3.2800 -3.2800 -3.2760 -3.2760 -2.9654 -2.9654 -2.9074 -2.9074 -2.8876 -2.8876 0.2451 0.2451 2.0180 2.0180 2.5152 2.5152 2.7317 2.7317 3.0835 3.0835 3.2759 3.2759 5.3861 5.3861 5.7222 5.7222 6.3511 6.3511 6.3932 6.3932 6.7770 6.7770 7.2364 7.2364 k = 0.5730 0.0538-0.1092 ( 8856 PWs) bands (ev): -27.1941 -27.1941 -27.1884 -27.1884 -27.0996 -27.0996 -27.0853 -27.0853 -10.9192 -10.9192 -10.8942 -10.8942 -10.8041 -10.8041 -10.7614 -10.7614 -10.6679 -10.6679 -10.6420 -10.6420 -10.6150 -10.6150 -10.6018 -10.6018 -10.5355 -10.5355 -10.5233 -10.5233 -10.4830 -10.4830 -10.4643 -10.4643 -6.0796 -6.0796 -5.5352 -5.5352 -3.2800 -3.2800 -3.2762 -3.2762 -2.9654 -2.9654 -2.9073 -2.9073 -2.8884 -2.8884 0.2413 0.2413 2.0119 2.0119 2.5436 2.5436 2.7343 2.7343 3.1015 3.1015 3.2779 3.2779 5.3474 5.3474 5.6699 5.6699 6.3603 6.3603 6.4015 6.4015 6.8327 6.8327 7.2449 7.2449 k = 0.5639 0.0668-0.0834 ( 8844 PWs) bands (ev): -27.1942 -27.1942 -27.1884 -27.1884 -27.0997 -27.0997 -27.0851 -27.0851 -10.9192 -10.9192 -10.8941 -10.8941 -10.8027 -10.8027 -10.7596 -10.7596 -10.6676 -10.6676 -10.6417 -10.6417 -10.6152 -10.6152 -10.6028 -10.6028 -10.5362 -10.5362 -10.5216 -10.5216 -10.4847 -10.4847 -10.4641 -10.4641 -6.0820 -6.0820 -5.5385 -5.5385 -3.2799 -3.2799 -3.2764 -3.2764 -2.9653 -2.9653 -2.9073 -2.9073 -2.8892 -2.8892 0.2379 0.2379 2.0064 2.0064 2.5693 2.5693 2.7376 2.7376 3.1178 3.1178 3.2808 3.2808 5.3088 5.3088 5.6203 5.6203 6.3687 6.3687 6.4115 6.4115 6.8914 6.8914 7.2525 7.2525 k = 0.5548 0.0799-0.0576 ( 8824 PWs) bands (ev): -27.1943 -27.1943 -27.1884 -27.1884 -27.0997 -27.0997 -27.0849 -27.0849 -10.9192 -10.9192 -10.8940 -10.8940 -10.8014 -10.8014 -10.7581 -10.7581 -10.6673 -10.6673 -10.6415 -10.6415 -10.6154 -10.6154 -10.6037 -10.6037 -10.5369 -10.5369 -10.5197 -10.5197 -10.4865 -10.4865 -10.4638 -10.4638 -6.0842 -6.0842 -5.5413 -5.5413 -3.2799 -3.2799 -3.2765 -3.2765 -2.9653 -2.9653 -2.9073 -2.9073 -2.8898 -2.8898 0.2349 0.2349 2.0016 2.0016 2.5917 2.5917 2.7420 2.7420 3.1318 3.1318 3.2846 3.2846 5.2718 5.2718 5.5748 5.5748 6.3769 6.3769 6.4214 6.4214 6.9520 6.9520 7.2590 7.2590 k = 0.5456 0.0929-0.0318 ( 8834 PWs) bands (ev): -27.1944 -27.1944 -27.1885 -27.1885 -27.0998 -27.0998 -27.0848 -27.0848 -10.9192 -10.9192 -10.8939 -10.8939 -10.8003 -10.8003 -10.7567 -10.7567 -10.6670 -10.6670 -10.6413 -10.6413 -10.6156 -10.6156 -10.6044 -10.6044 -10.5376 -10.5376 -10.5178 -10.5178 -10.4884 -10.4884 -10.4635 -10.4635 -6.0860 -6.0860 -5.5438 -5.5438 -3.2799 -3.2799 -3.2767 -3.2767 -2.9653 -2.9653 -2.9073 -2.9073 -2.8904 -2.8904 0.2323 0.2323 1.9974 1.9974 2.6101 2.6101 2.7474 2.7474 3.1433 3.1433 3.2891 3.2891 5.2378 5.2378 5.5344 5.5344 6.3848 6.3848 6.4304 6.4304 7.0130 7.0130 7.2645 7.2645 k = 0.5365 0.1059-0.0060 ( 8834 PWs) bands (ev): -27.1944 -27.1944 -27.1885 -27.1885 -27.0998 -27.0998 -27.0847 -27.0847 -10.9192 -10.9192 -10.8939 -10.8939 -10.7993 -10.7993 -10.7556 -10.7556 -10.6668 -10.6668 -10.6412 -10.6412 -10.6158 -10.6158 -10.6050 -10.6050 -10.5382 -10.5382 -10.5160 -10.5160 -10.4902 -10.4902 -10.4633 -10.4633 -6.0876 -6.0876 -5.5459 -5.5459 -3.2799 -3.2799 -3.2768 -3.2768 -2.9652 -2.9652 -2.9073 -2.9073 -2.8909 -2.8909 0.2302 0.2302 1.9940 1.9940 2.6243 2.6243 2.7536 2.7536 3.1522 3.1522 3.2940 3.2940 5.2082 5.2082 5.5000 5.5000 6.3919 6.3919 6.4383 6.4383 7.0728 7.0728 7.2690 7.2690 k = 0.5274 0.1189 0.0198 ( 8838 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0847 -27.0847 -10.9192 -10.9192 -10.8938 -10.8938 -10.7986 -10.7986 -10.7548 -10.7548 -10.6666 -10.6666 -10.6411 -10.6411 -10.6159 -10.6159 -10.6055 -10.6055 -10.5387 -10.5387 -10.5142 -10.5142 -10.4919 -10.4919 -10.4631 -10.4631 -6.0888 -6.0888 -5.5475 -5.5475 -3.2798 -3.2798 -3.2769 -3.2769 -2.9652 -2.9652 -2.9073 -2.9073 -2.8913 -2.8913 0.2285 0.2285 1.9913 1.9913 2.6345 2.6345 2.7599 2.7599 3.1588 3.1588 3.2987 3.2987 5.1839 5.1839 5.4724 5.4724 6.3979 6.3979 6.4447 6.4447 7.1289 7.1289 7.2724 7.2724 k = 0.5183 0.1319 0.0456 ( 8836 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7980 -10.7980 -10.7541 -10.7541 -10.6664 -10.6664 -10.6410 -10.6410 -10.6160 -10.6160 -10.6058 -10.6058 -10.5390 -10.5390 -10.5127 -10.5127 -10.4934 -10.4934 -10.4630 -10.4630 -6.0897 -6.0897 -5.5486 -5.5486 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8916 -2.8916 0.2273 0.2273 1.9893 1.9893 2.6411 2.6411 2.7654 2.7654 3.1631 3.1631 3.3027 3.3027 5.1659 5.1659 5.4523 5.4523 6.4023 6.4023 6.4495 6.4495 7.1775 7.1775 7.2749 7.2749 k = 0.5091 0.1449 0.0714 ( 8816 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7977 -10.7977 -10.7537 -10.7537 -10.6663 -10.6663 -10.6410 -10.6410 -10.6161 -10.6161 -10.6060 -10.6060 -10.5392 -10.5392 -10.5116 -10.5116 -10.4944 -10.4944 -10.4629 -10.4629 -6.0902 -6.0902 -5.5493 -5.5493 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8917 -2.8917 0.2266 0.2266 1.9881 1.9881 2.6448 2.6448 2.7691 2.7691 3.1656 3.1656 3.3053 3.3053 5.1548 5.1548 5.4400 5.4400 6.4050 6.4050 6.4525 6.4525 7.2123 7.2123 7.2764 7.2764 k = 0.5000 0.1579 0.0972 ( 8814 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7976 -10.7976 -10.7536 -10.7536 -10.6663 -10.6663 -10.6410 -10.6410 -10.6161 -10.6161 -10.6061 -10.6061 -10.5393 -10.5393 -10.5113 -10.5113 -10.4948 -10.4948 -10.4629 -10.4629 -6.0904 -6.0904 -5.5496 -5.5496 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8918 -2.8918 0.2264 0.2264 1.9878 1.9878 2.6460 2.6460 2.7704 2.7704 3.1664 3.1664 3.3062 3.3062 5.1511 5.1511 5.4358 5.4358 6.4060 6.4060 6.4535 6.4535 7.2252 7.2252 7.2769 7.2769 k = 0.5000 0.1579 0.0972 ( 8814 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7976 -10.7976 -10.7536 -10.7536 -10.6663 -10.6663 -10.6410 -10.6410 -10.6161 -10.6161 -10.6061 -10.6061 -10.5393 -10.5393 -10.5113 -10.5113 -10.4948 -10.4948 -10.4629 -10.4629 -6.0904 -6.0904 -5.5496 -5.5496 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8918 -2.8918 0.2264 0.2264 1.9878 1.9878 2.6460 2.6460 2.7704 2.7704 3.1664 3.1664 3.3062 3.3062 5.1511 5.1511 5.4358 5.4358 6.4060 6.4060 6.4535 6.4535 7.2252 7.2252 7.2769 7.2769 k = 0.4722 0.1491 0.0918 ( 8817 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7977 -10.7977 -10.7535 -10.7535 -10.6663 -10.6663 -10.6410 -10.6410 -10.6163 -10.6163 -10.6059 -10.6059 -10.5394 -10.5394 -10.5113 -10.5113 -10.4947 -10.4947 -10.4629 -10.4629 -6.0908 -6.0908 -5.5490 -5.5490 -3.2798 -3.2798 -3.2771 -3.2771 -2.9652 -2.9652 -2.9073 -2.9073 -2.8919 -2.8919 0.2255 0.2255 1.9905 1.9905 2.6458 2.6458 2.7701 2.7701 3.1667 3.1667 3.3066 3.3066 5.1308 5.1308 5.4535 5.4535 6.4059 6.4059 6.4534 6.4534 7.2196 7.2196 7.2867 7.2867 k = 0.4444 0.1404 0.0864 ( 8817 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8937 -10.8937 -10.7980 -10.7980 -10.7532 -10.7532 -10.6663 -10.6663 -10.6410 -10.6410 -10.6168 -10.6168 -10.6052 -10.6052 -10.5396 -10.5396 -10.5115 -10.5115 -10.4945 -10.4945 -10.4628 -10.4628 -6.0921 -6.0921 -5.5473 -5.5473 -3.2798 -3.2798 -3.2772 -3.2772 -2.9652 -2.9652 -2.9073 -2.9073 -2.8924 -2.8924 0.2229 0.2229 1.9986 1.9986 2.6452 2.6452 2.7693 2.7693 3.1676 3.1676 3.3076 3.3076 5.0801 5.0801 5.4965 5.4965 6.4057 6.4057 6.4531 6.4531 7.2091 7.2091 7.3095 7.3095 k = 0.4167 0.1316 0.0810 ( 8829 PWs) bands (ev): -27.1946 -27.1946 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9192 -10.9192 -10.8936 -10.8936 -10.7985 -10.7985 -10.7528 -10.7528 -10.6663 -10.6663 -10.6410 -10.6410 -10.6175 -10.6175 -10.6044 -10.6044 -10.5400 -10.5400 -10.5118 -10.5118 -10.4941 -10.4941 -10.4627 -10.4627 -6.0941 -6.0941 -5.5446 -5.5446 -3.2798 -3.2798 -3.2774 -3.2774 -2.9652 -2.9652 -2.9073 -2.9073 -2.8931 -2.8931 0.2186 0.2186 2.0120 2.0120 2.6443 2.6443 2.7680 2.7680 3.1692 3.1692 3.3093 3.3093 5.0136 5.0136 5.5509 5.5509 6.4054 6.4054 6.4527 6.4527 7.1987 7.1987 7.3392 7.3392 k = 0.3889 0.1228 0.0756 ( 8826 PWs) bands (ev): -27.1946 -27.1946 -27.1884 -27.1884 -27.0999 -27.0999 -27.0846 -27.0846 -10.9192 -10.9192 -10.8934 -10.8934 -10.7992 -10.7992 -10.7522 -10.7522 -10.6662 -10.6662 -10.6410 -10.6410 -10.6184 -10.6184 -10.6033 -10.6033 -10.5405 -10.5405 -10.5121 -10.5121 -10.4936 -10.4936 -10.4625 -10.4625 -6.0969 -6.0969 -5.5409 -5.5409 -3.2798 -3.2798 -3.2777 -3.2777 -2.9652 -2.9652 -2.9073 -2.9073 -2.8941 -2.8941 0.2129 0.2129 2.0302 2.0302 2.6431 2.6431 2.7663 2.7663 3.1712 3.1712 3.3116 3.3116 4.9390 4.9390 5.6097 5.6097 6.4050 6.4050 6.4522 6.4522 7.1892 7.1892 7.3731 7.3731 k = 0.3611 0.1141 0.0702 ( 8838 PWs) bands (ev): -27.1946 -27.1946 -27.1884 -27.1884 -27.0999 -27.0999 -27.0846 -27.0846 -10.9193 -10.9193 -10.8933 -10.8933 -10.8000 -10.8000 -10.7515 -10.7515 -10.6661 -10.6661 -10.6410 -10.6410 -10.6194 -10.6194 -10.6021 -10.6021 -10.5412 -10.5412 -10.5126 -10.5126 -10.4930 -10.4930 -10.4623 -10.4623 -6.1002 -6.1002 -5.5363 -5.5363 -3.2798 -3.2798 -3.2780 -3.2780 -2.9652 -2.9652 -2.9073 -2.9073 -2.8953 -2.8953 0.2060 0.2060 2.0530 2.0530 2.6416 2.6416 2.7642 2.7642 3.1737 3.1737 3.3145 3.3145 4.8601 4.8601 5.6703 5.6703 6.4046 6.4046 6.4515 6.4515 7.1798 7.1798 7.4098 7.4098 k = 0.3333 0.1053 0.0648 ( 8832 PWs) bands (ev): -27.1946 -27.1946 -27.1884 -27.1884 -27.0999 -27.0999 -27.0846 -27.0846 -10.9194 -10.9194 -10.8930 -10.8930 -10.8010 -10.8010 -10.7507 -10.7507 -10.6661 -10.6661 -10.6410 -10.6410 -10.6203 -10.6203 -10.6008 -10.6008 -10.5419 -10.5419 -10.5132 -10.5132 -10.4924 -10.4924 -10.4621 -10.4621 -6.1040 -6.1040 -5.5312 -5.5312 -3.2798 -3.2798 -3.2784 -3.2784 -2.9652 -2.9652 -2.9073 -2.9073 -2.8967 -2.8967 0.1980 0.1980 2.0797 2.0797 2.6400 2.6400 2.7618 2.7618 3.1766 3.1766 3.3177 3.3177 4.7790 4.7790 5.7318 5.7318 6.4041 6.4041 6.4508 6.4508 7.1691 7.1691 7.4478 7.4478 k = 0.3056 0.0965 0.0594 ( 8841 PWs) bands (ev): -27.1947 -27.1947 -27.1884 -27.1884 -27.0999 -27.0999 -27.0846 -27.0846 -10.9195 -10.9195 -10.8928 -10.8928 -10.8019 -10.8019 -10.7498 -10.7498 -10.6660 -10.6660 -10.6410 -10.6410 -10.6212 -10.6212 -10.5995 -10.5995 -10.5427 -10.5427 -10.5138 -10.5138 -10.4916 -10.4916 -10.4619 -10.4619 -6.1081 -6.1081 -5.5255 -5.5255 -3.2798 -3.2798 -3.2789 -3.2789 -2.9652 -2.9652 -2.9073 -2.9073 -2.8983 -2.8983 0.1894 0.1894 2.1097 2.1097 2.6384 2.6384 2.7592 2.7592 3.1798 3.1798 3.3213 3.3213 4.6972 4.6972 5.7939 5.7939 6.4035 6.4035 6.4500 6.4500 7.1558 7.1558 7.4858 7.4858 k = 0.2778 0.0877 0.0540 ( 8832 PWs) bands (ev): -27.1947 -27.1947 -27.1883 -27.1883 -27.0999 -27.0999 -27.0846 -27.0846 -10.9195 -10.9195 -10.8926 -10.8926 -10.8029 -10.8029 -10.7489 -10.7489 -10.6659 -10.6659 -10.6410 -10.6410 -10.6221 -10.6221 -10.5983 -10.5983 -10.5434 -10.5434 -10.5144 -10.5144 -10.4909 -10.4909 -10.4616 -10.4616 -6.1124 -6.1124 -5.5195 -5.5195 -3.2798 -3.2798 -3.2793 -3.2793 -2.9652 -2.9652 -2.9074 -2.9074 -2.8999 -2.8999 0.1804 0.1804 2.1424 2.1424 2.6368 2.6368 2.7565 2.7565 3.1832 3.1832 3.3251 3.3251 4.6161 4.6161 5.8568 5.8568 6.4030 6.4030 6.4492 6.4492 7.1383 7.1383 7.5229 7.5229 k = 0.2500 0.0790 0.0486 ( 8841 PWs) bands (ev): -27.1947 -27.1947 -27.1883 -27.1883 -27.0999 -27.0999 -27.0846 -27.0846 -10.9196 -10.9196 -10.8923 -10.8923 -10.8040 -10.8040 -10.7480 -10.7480 -10.6658 -10.6658 -10.6410 -10.6410 -10.6229 -10.6229 -10.5970 -10.5970 -10.5443 -10.5443 -10.5151 -10.5151 -10.4901 -10.4901 -10.4614 -10.4614 -6.1168 -6.1168 -5.5135 -5.5135 -3.2798 -3.2798 -3.2798 -3.2798 -2.9652 -2.9652 -2.9074 -2.9074 -2.9016 -2.9016 0.1713 0.1713 2.1768 2.1768 2.6353 2.6353 2.7536 2.7536 3.1866 3.1866 3.3289 3.3289 4.5367 4.5367 5.9207 5.9207 6.4025 6.4025 6.4484 6.4484 7.1151 7.1151 7.5581 7.5581 k = 0.2222 0.0702 0.0432 ( 8838 PWs) bands (ev): -27.1947 -27.1947 -27.1883 -27.1883 -27.0999 -27.0999 -27.0846 -27.0846 -10.9197 -10.9197 -10.8920 -10.8920 -10.8050 -10.8050 -10.7472 -10.7472 -10.6657 -10.6657 -10.6410 -10.6410 -10.6236 -10.6236 -10.5958 -10.5958 -10.5451 -10.5451 -10.5158 -10.5158 -10.4894 -10.4894 -10.4611 -10.4611 -6.1210 -6.1210 -5.5075 -5.5075 -3.2803 -3.2803 -3.2798 -3.2798 -2.9652 -2.9652 -2.9075 -2.9075 -2.9032 -2.9032 0.1624 0.1624 2.2121 2.2121 2.6342 2.6342 2.7509 2.7509 3.1900 3.1900 3.3327 3.3327 4.4604 4.4604 5.9855 5.9855 6.4020 6.4020 6.4476 6.4476 7.0852 7.0852 7.5835 7.5835 k = 0.1944 0.0614 0.0378 ( 8838 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0999 -27.0999 -27.0846 -27.0846 -10.9198 -10.9198 -10.8917 -10.8917 -10.8059 -10.8059 -10.7464 -10.7464 -10.6656 -10.6656 -10.6410 -10.6410 -10.6243 -10.6243 -10.5947 -10.5947 -10.5458 -10.5458 -10.5165 -10.5165 -10.4887 -10.4887 -10.4609 -10.4609 -6.1251 -6.1251 -5.5018 -5.5018 -3.2808 -3.2808 -3.2798 -3.2798 -2.9652 -2.9652 -2.9077 -2.9077 -2.9047 -2.9047 0.1539 0.1539 2.2471 2.2471 2.6334 2.6334 2.7482 2.7482 3.1933 3.1933 3.3364 3.3364 4.3883 4.3883 6.0514 6.0514 6.4016 6.4016 6.4469 6.4469 7.0480 7.0480 7.5829 7.5829 k = 0.1667 0.0526 0.0324 ( 8847 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0999 -27.0999 -27.0846 -27.0846 -10.9199 -10.9199 -10.8915 -10.8915 -10.8068 -10.8068 -10.7456 -10.7456 -10.6655 -10.6655 -10.6410 -10.6410 -10.6249 -10.6249 -10.5937 -10.5937 -10.5465 -10.5465 -10.5171 -10.5171 -10.4881 -10.4881 -10.4607 -10.4607 -6.1289 -6.1289 -5.4964 -5.4964 -3.2813 -3.2813 -3.2798 -3.2798 -2.9652 -2.9652 -2.9081 -2.9081 -2.9059 -2.9059 0.1461 0.1461 2.2808 2.2808 2.6331 2.6331 2.7457 2.7457 3.1963 3.1963 3.3398 3.3398 4.3217 4.3217 6.1181 6.1181 6.4013 6.4013 6.4463 6.4463 7.0039 7.0039 7.5809 7.5809 k = 0.1389 0.0439 0.0270 ( 8859 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0999 -27.0999 -27.0846 -27.0846 -10.9200 -10.9200 -10.8913 -10.8913 -10.8076 -10.8076 -10.7450 -10.7450 -10.6654 -10.6654 -10.6410 -10.6410 -10.6254 -10.6254 -10.5929 -10.5929 -10.5471 -10.5471 -10.5177 -10.5177 -10.4876 -10.4876 -10.4605 -10.4605 -6.1322 -6.1322 -5.4917 -5.4917 -3.2817 -3.2817 -3.2798 -3.2798 -2.9652 -2.9652 -2.9088 -2.9088 -2.9066 -2.9066 0.1391 0.1391 2.3120 2.3120 2.6334 2.6334 2.7435 2.7435 3.1991 3.1991 3.3429 3.3429 4.2618 4.2618 6.1853 6.1853 6.4010 6.4010 6.4457 6.4457 6.9536 6.9536 7.5789 7.5789 k = 0.1111 0.0351 0.0216 ( 8859 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0999 -27.0999 -27.0846 -27.0846 -10.9200 -10.9200 -10.8911 -10.8911 -10.8083 -10.8083 -10.7444 -10.7444 -10.6654 -10.6654 -10.6410 -10.6410 -10.6258 -10.6258 -10.5921 -10.5921 -10.5476 -10.5476 -10.5182 -10.5182 -10.4871 -10.4871 -10.4603 -10.4603 -6.1351 -6.1351 -5.4876 -5.4876 -3.2821 -3.2821 -3.2798 -3.2798 -2.9652 -2.9652 -2.9098 -2.9098 -2.9068 -2.9068 0.1332 0.1332 2.3394 2.3394 2.6342 2.6342 2.7417 2.7417 3.2014 3.2014 3.3455 3.3455 4.2103 4.2103 6.2520 6.2520 6.4009 6.4009 6.4453 6.4453 6.8989 6.8989 7.5771 7.5771 k = 0.0833 0.0263 0.0162 ( 8898 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8910 -10.8910 -10.8088 -10.8088 -10.7440 -10.7440 -10.6653 -10.6653 -10.6410 -10.6410 -10.6262 -10.6262 -10.5915 -10.5915 -10.5481 -10.5481 -10.5186 -10.5186 -10.4867 -10.4867 -10.4602 -10.4602 -6.1374 -6.1374 -5.4843 -5.4843 -3.2824 -3.2824 -3.2799 -3.2799 -2.9652 -2.9652 -2.9107 -2.9107 -2.9070 -2.9070 0.1284 0.1284 2.3620 2.3620 2.6353 2.6353 2.7401 2.7401 3.2033 3.2033 3.3477 3.3477 4.1683 4.1683 6.3164 6.3164 6.4010 6.4010 6.4449 6.4449 6.8423 6.8423 7.5755 7.5755 k = 0.0556 0.0175 0.0108 ( 8893 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8092 -10.8092 -10.7437 -10.7437 -10.6653 -10.6653 -10.6410 -10.6410 -10.6264 -10.6264 -10.5911 -10.5911 -10.5484 -10.5484 -10.5189 -10.5189 -10.4865 -10.4865 -10.4601 -10.4601 -6.1391 -6.1391 -5.4819 -5.4819 -3.2827 -3.2827 -3.2799 -3.2799 -2.9652 -2.9652 -2.9114 -2.9114 -2.9070 -2.9070 0.1249 0.1249 2.3787 2.3787 2.6365 2.6365 2.7390 2.7390 3.2047 3.2047 3.3492 3.3492 4.1372 4.1372 6.3741 6.3741 6.4025 6.4025 6.4446 6.4446 6.7882 6.7882 7.5744 7.5744 k = 0.0278 0.0088 0.0054 ( 8920 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8095 -10.8095 -10.7436 -10.7436 -10.6653 -10.6653 -10.6411 -10.6411 -10.6266 -10.6266 -10.5908 -10.5908 -10.5486 -10.5486 -10.5191 -10.5191 -10.4863 -10.4863 -10.4601 -10.4601 -6.1401 -6.1401 -5.4804 -5.4804 -3.2828 -3.2828 -3.2799 -3.2799 -2.9652 -2.9652 -2.9118 -2.9118 -2.9070 -2.9070 0.1228 0.1228 2.3890 2.3890 2.6374 2.6374 2.7383 2.7383 3.2055 3.2055 3.3502 3.3502 4.1180 4.1180 6.3976 6.3976 6.4250 6.4250 6.4445 6.4445 6.7449 6.7449 7.5736 7.5736 k = 0.0000 0.0000 0.0000 ( 8923 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8095 -10.8095 -10.7435 -10.7435 -10.6653 -10.6653 -10.6411 -10.6411 -10.6266 -10.6266 -10.5907 -10.5907 -10.5486 -10.5486 -10.5192 -10.5192 -10.4863 -10.4863 -10.4600 -10.4600 -6.1404 -6.1404 -5.4799 -5.4799 -3.2829 -3.2829 -3.2799 -3.2799 -2.9652 -2.9652 -2.9120 -2.9120 -2.9071 -2.9071 0.1221 0.1221 2.3925 2.3925 2.6378 2.6378 2.7381 2.7381 3.2058 3.2058 3.3505 3.3505 4.1116 4.1116 6.3985 6.3985 6.4427 6.4427 6.4444 6.4444 6.7271 6.7271 7.5734 7.5734 k = 0.0000 0.0000 0.0000 ( 8923 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8095 -10.8095 -10.7435 -10.7435 -10.6653 -10.6653 -10.6411 -10.6411 -10.6266 -10.6266 -10.5907 -10.5907 -10.5486 -10.5486 -10.5192 -10.5192 -10.4863 -10.4863 -10.4600 -10.4600 -6.1404 -6.1404 -5.4799 -5.4799 -3.2829 -3.2829 -3.2799 -3.2799 -2.9652 -2.9652 -2.9120 -2.9120 -2.9071 -2.9071 0.1221 0.1221 2.3925 2.3925 2.6378 2.6378 2.7381 2.7381 3.2058 3.2058 3.3505 3.3505 4.1116 4.1116 6.3985 6.3985 6.4427 6.4427 6.4444 6.4444 6.7271 6.7271 7.5734 7.5734 k = 0.0091-0.0129-0.0257 ( 8913 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8908 -10.8908 -10.8096 -10.8096 -10.7436 -10.7436 -10.6653 -10.6653 -10.6412 -10.6412 -10.6265 -10.6265 -10.5909 -10.5909 -10.5484 -10.5484 -10.5192 -10.5192 -10.4862 -10.4862 -10.4601 -10.4601 -6.1402 -6.1402 -5.4798 -5.4798 -3.2829 -3.2829 -3.2799 -3.2799 -2.9652 -2.9652 -2.9119 -2.9119 -2.9070 -2.9070 0.1224 0.1224 2.3924 2.3924 2.6361 2.6361 2.7361 2.7361 3.2051 3.2051 3.3497 3.3497 4.1176 4.1176 6.3878 6.3878 6.4355 6.4355 6.4463 6.4463 6.7471 6.7471 7.5682 7.5682 k = 0.0181-0.0259-0.0513 ( 8893 PWs) bands (ev): -27.1949 -27.1949 -27.1882 -27.1882 -27.0999 -27.0999 -27.0847 -27.0847 -10.9201 -10.9201 -10.8909 -10.8909 -10.8099 -10.8099 -10.7440 -10.7440 -10.6652 -10.6652 -10.6414 -10.6414 -10.6260 -10.6260 -10.5913 -10.5913 -10.5478 -10.5478 -10.5194 -10.5194 -10.4859 -10.4859 -10.4602 -10.4602 -6.1395 -6.1395 -5.4793 -5.4793 -3.2828 -3.2828 -3.2799 -3.2799 -2.9652 -2.9652 -2.9117 -2.9117 -2.9070 -2.9070 0.1236 0.1236 2.3922 2.3922 2.6308 2.6308 2.7307 2.7307 3.2030 3.2030 3.3474 3.3474 4.1353 4.1353 6.3489 6.3489 6.4259 6.4259 6.4571 6.4571 6.7964 6.7964 7.5475 7.5475 k = 0.0272-0.0388-0.0770 ( 8881 PWs) bands (ev): -27.1948 -27.1948 -27.1882 -27.1882 -27.0998 -27.0998 -27.0847 -27.0847 -10.9200 -10.9200 -10.8912 -10.8912 -10.8103 -10.8103 -10.7447 -10.7447 -10.6652 -10.6652 -10.6418 -10.6418 -10.6253 -10.6253 -10.5919 -10.5919 -10.5469 -10.5469 -10.5196 -10.5196 -10.4855 -10.4855 -10.4605 -10.4605 -6.1382 -6.1382 -5.4786 -5.4786 -3.2826 -3.2826 -3.2799 -3.2799 -2.9652 -2.9652 -2.9113 -2.9113 -2.9070 -2.9070 0.1255 0.1255 2.3917 2.3917 2.6208 2.6208 2.7236 2.7236 3.1992 3.1992 3.3439 3.3439 4.1641 4.1641 6.2909 6.2909 6.4212 6.4212 6.4755 6.4755 6.8596 6.8596 7.5149 7.5149 k = 0.0363-0.0517-0.1026 ( 8877 PWs) bands (ev): -27.1948 -27.1948 -27.1881 -27.1881 -27.0998 -27.0998 -27.0848 -27.0848 -10.9198 -10.9198 -10.8915 -10.8915 -10.8108 -10.8108 -10.7456 -10.7456 -10.6651 -10.6651 -10.6424 -10.6424 -10.6244 -10.6244 -10.5927 -10.5927 -10.5457 -10.5457 -10.5200 -10.5200 -10.4850 -10.4850 -10.4609 -10.4609 -6.1366 -6.1366 -5.4776 -5.4776 -3.2825 -3.2825 -3.2799 -3.2799 -2.9652 -2.9652 -2.9109 -2.9109 -2.9069 -2.9069 0.1281 0.1281 2.3908 2.3908 2.6053 2.6053 2.7167 2.7167 3.1937 3.1937 3.3394 3.3394 4.2029 4.2029 6.2257 6.2257 6.4172 6.4172 6.5010 6.5010 6.9284 6.9284 7.4745 7.4745 k = 0.0454-0.0647-0.1283 ( 8869 PWs) bands (ev): -27.1947 -27.1947 -27.1881 -27.1881 -27.0998 -27.0998 -27.0849 -27.0849 -10.9197 -10.9197 -10.8919 -10.8919 -10.8115 -10.8115 -10.7468 -10.7468 -10.6651 -10.6651 -10.6430 -10.6430 -10.6233 -10.6233 -10.5936 -10.5936 -10.5442 -10.5442 -10.5205 -10.5205 -10.4844 -10.4844 -10.4614 -10.4614 -6.1345 -6.1345 -5.4764 -5.4764 -3.2823 -3.2823 -3.2799 -3.2799 -2.9652 -2.9652 -2.9103 -2.9103 -2.9068 -2.9068 0.1314 0.1314 2.3893 2.3893 2.5843 2.5843 2.7114 2.7114 3.1861 3.1861 3.3344 3.3344 4.2504 4.2504 6.1582 6.1582 6.4124 6.4124 6.5333 6.5333 6.9988 6.9988 7.4296 7.4296 k = 0.0544-0.0776-0.1539 ( 8861 PWs) bands (ev): -27.1946 -27.1946 -27.1881 -27.1881 -27.0997 -27.0997 -27.0850 -27.0850 -10.9195 -10.9195 -10.8923 -10.8923 -10.8123 -10.8123 -10.7483 -10.7483 -10.6650 -10.6650 -10.6436 -10.6436 -10.6221 -10.6221 -10.5947 -10.5947 -10.5425 -10.5425 -10.5210 -10.5210 -10.4837 -10.4837 -10.4620 -10.4620 -6.1319 -6.1319 -5.4748 -5.4748 -3.2820 -3.2820 -3.2799 -3.2799 -2.9653 -2.9653 -2.9097 -2.9097 -2.9067 -2.9067 0.1354 0.1354 2.3867 2.3867 2.5589 2.5589 2.7079 2.7079 3.1765 3.1765 3.3293 3.3293 4.3056 4.3056 6.0906 6.0906 6.4062 6.4062 6.5717 6.5717 7.0684 7.0684 7.3830 7.3830 k = 0.0635-0.0905-0.1796 ( 8857 PWs) bands (ev): -27.1945 -27.1945 -27.1882 -27.1882 -27.0996 -27.0996 -27.0852 -27.0852 -10.9193 -10.9193 -10.8928 -10.8928 -10.8133 -10.8133 -10.7499 -10.7499 -10.6649 -10.6649 -10.6443 -10.6443 -10.6209 -10.6209 -10.5957 -10.5957 -10.5407 -10.5407 -10.5216 -10.5216 -10.4829 -10.4829 -10.4626 -10.4626 -6.1290 -6.1290 -5.4731 -5.4731 -3.2818 -3.2818 -3.2799 -3.2799 -2.9653 -2.9653 -2.9090 -2.9090 -2.9065 -2.9065 0.1401 0.1401 2.3821 2.3821 2.5313 2.5313 2.7061 2.7061 3.1646 3.1646 3.3245 3.3245 4.3670 4.3670 6.0240 6.0240 6.3981 6.3981 6.6153 6.6153 7.1354 7.1354 7.3369 7.3369 k = 0.0726-0.1034-0.2052 ( 8841 PWs) bands (ev): -27.1944 -27.1944 -27.1881 -27.1881 -27.0995 -27.0995 -27.0853 -27.0853 -10.9191 -10.9191 -10.8934 -10.8934 -10.8143 -10.8143 -10.7519 -10.7519 -10.6648 -10.6648 -10.6450 -10.6450 -10.6195 -10.6195 -10.5968 -10.5968 -10.5388 -10.5388 -10.5221 -10.5221 -10.4822 -10.4822 -10.4632 -10.4632 -6.1256 -6.1256 -5.4711 -5.4711 -3.2814 -3.2814 -3.2799 -3.2799 -2.9653 -2.9653 -2.9084 -2.9084 -2.9060 -2.9060 0.1454 0.1454 2.3743 2.3743 2.5042 2.5042 2.7053 2.7053 3.1506 3.1506 3.3201 3.3201 4.4337 4.4337 5.9590 5.9590 6.3876 6.3876 6.6632 6.6632 7.1983 7.1983 7.2936 7.2936 k = 0.0817-0.1164-0.2309 ( 8845 PWs) bands (ev): -27.1943 -27.1943 -27.1881 -27.1881 -27.0994 -27.0994 -27.0855 -27.0855 -10.9188 -10.9188 -10.8940 -10.8940 -10.8154 -10.8154 -10.7540 -10.7540 -10.6647 -10.6647 -10.6456 -10.6456 -10.6182 -10.6182 -10.5977 -10.5977 -10.5369 -10.5369 -10.5227 -10.5227 -10.4814 -10.4814 -10.4637 -10.4637 -6.1220 -6.1220 -5.4690 -5.4690 -3.2811 -3.2811 -3.2799 -3.2799 -2.9653 -2.9653 -2.9081 -2.9081 -2.9052 -2.9052 0.1514 0.1514 2.3615 2.3615 2.4805 2.4805 2.7052 2.7052 3.1347 3.1347 3.3162 3.3162 4.5045 4.5045 5.8961 5.8961 6.3743 6.3743 6.7141 6.7141 7.2523 7.2523 7.2578 7.2578 k = 0.0907-0.1293-0.2565 ( 8845 PWs) bands (ev): -27.1942 -27.1942 -27.1881 -27.1881 -27.0994 -27.0994 -27.0857 -27.0857 -10.9186 -10.9186 -10.8947 -10.8947 -10.8165 -10.8165 -10.7564 -10.7564 -10.6646 -10.6646 -10.6462 -10.6462 -10.6170 -10.6170 -10.5986 -10.5986 -10.5352 -10.5352 -10.5231 -10.5231 -10.4807 -10.4807 -10.4643 -10.4643 -6.1180 -6.1180 -5.4667 -5.4667 -3.2808 -3.2808 -3.2799 -3.2799 -2.9654 -2.9654 -2.9078 -2.9078 -2.9042 -2.9042 0.1579 0.1579 2.3422 2.3422 2.4627 2.4627 2.7053 2.7053 3.1173 3.1173 3.3127 3.3127 4.5785 4.5785 5.8358 5.8358 6.3579 6.3579 6.7660 6.7660 7.2233 7.2233 7.3039 7.3039 k = 0.0998-0.1422-0.2822 ( 8843 PWs) bands (ev): -27.1940 -27.1940 -27.1882 -27.1882 -27.0992 -27.0992 -27.0859 -27.0859 -10.9184 -10.9184 -10.8954 -10.8954 -10.8177 -10.8177 -10.7589 -10.7589 -10.6645 -10.6645 -10.6468 -10.6468 -10.6159 -10.6159 -10.5992 -10.5992 -10.5337 -10.5337 -10.5233 -10.5233 -10.4801 -10.4801 -10.4647 -10.4647 -6.1138 -6.1138 -5.4642 -5.4642 -3.2804 -3.2804 -3.2799 -3.2799 -2.9654 -2.9654 -2.9077 -2.9077 -2.9030 -2.9030 0.1649 0.1649 2.3168 2.3168 2.4509 2.4509 2.7054 2.7054 3.0989 3.0989 3.3095 3.3095 4.6548 4.6548 5.7783 5.7783 6.3379 6.3379 6.8162 6.8162 7.2018 7.2018 7.3408 7.3408 k = 0.1089-0.1552-0.3078 ( 8847 PWs) bands (ev): -27.1939 -27.1939 -27.1882 -27.1882 -27.0991 -27.0991 -27.0861 -27.0861 -10.9181 -10.9181 -10.8962 -10.8962 -10.8189 -10.8189 -10.7616 -10.7616 -10.6645 -10.6645 -10.6473 -10.6473 -10.6150 -10.6150 -10.5996 -10.5996 -10.5327 -10.5327 -10.5231 -10.5231 -10.4796 -10.4796 -10.4651 -10.4651 -6.1093 -6.1093 -5.4616 -5.4616 -3.2802 -3.2802 -3.2797 -3.2797 -2.9655 -2.9655 -2.9077 -2.9077 -2.9016 -2.9016 0.1724 0.1724 2.2876 2.2876 2.4436 2.4436 2.7053 2.7053 3.0797 3.0797 3.3064 3.3064 4.7326 4.7326 5.7239 5.7239 6.3143 6.3143 6.8607 6.8607 7.1941 7.1941 7.3608 7.3608 k = 0.1180-0.1681-0.3335 ( 8849 PWs) bands (ev): -27.1937 -27.1937 -27.1882 -27.1882 -27.0990 -27.0990 -27.0864 -27.0864 -10.9179 -10.9179 -10.8970 -10.8970 -10.8201 -10.8201 -10.7644 -10.7644 -10.6647 -10.6647 -10.6476 -10.6476 -10.6143 -10.6143 -10.5996 -10.5996 -10.5324 -10.5324 -10.5223 -10.5223 -10.4791 -10.4791 -10.4653 -10.4653 -6.1046 -6.1046 -5.4589 -5.4589 -3.2802 -3.2802 -3.2793 -3.2793 -2.9655 -2.9655 -2.9076 -2.9076 -2.9002 -2.9002 0.1803 0.1803 2.2568 2.2568 2.4391 2.4391 2.7047 2.7047 3.0603 3.0603 3.3032 3.3032 4.8112 4.8112 5.6731 5.6731 6.2872 6.2872 6.8950 6.8950 7.2043 7.2043 7.3586 7.3586 k = 0.1270-0.1810-0.3591 ( 8853 PWs) bands (ev): -27.1935 -27.1935 -27.1882 -27.1882 -27.0989 -27.0989 -27.0867 -27.0867 -10.9177 -10.9177 -10.8977 -10.8977 -10.8212 -10.8212 -10.7674 -10.7674 -10.6649 -10.6649 -10.6478 -10.6478 -10.6140 -10.6140 -10.5992 -10.5992 -10.5326 -10.5326 -10.5211 -10.5211 -10.4788 -10.4788 -10.4654 -10.4654 -6.0998 -6.0998 -5.4562 -5.4562 -3.2802 -3.2802 -3.2789 -3.2789 -2.9656 -2.9656 -2.9076 -2.9076 -2.8986 -2.8986 0.1885 0.1885 2.2258 2.2258 2.4360 2.4360 2.7035 2.7035 3.0410 3.0410 3.2996 3.2996 4.8895 4.8895 5.6262 5.6262 6.2568 6.2568 6.9167 6.9167 7.2339 7.2339 7.3343 7.3343 k = 0.1361-0.1940-0.3848 ( 8851 PWs) bands (ev): -27.1933 -27.1933 -27.1882 -27.1882 -27.0987 -27.0987 -27.0869 -27.0869 -10.9174 -10.9174 -10.8985 -10.8985 -10.8223 -10.8223 -10.7705 -10.7705 -10.6653 -10.6653 -10.6478 -10.6478 -10.6140 -10.6140 -10.5985 -10.5985 -10.5333 -10.5333 -10.5195 -10.5195 -10.4785 -10.4785 -10.4653 -10.4653 -6.0949 -6.0949 -5.4534 -5.4534 -3.2802 -3.2802 -3.2785 -3.2785 -2.9656 -2.9656 -2.9076 -2.9076 -2.8970 -2.8970 0.1971 0.1971 2.1958 2.1958 2.4338 2.4338 2.7014 2.7014 3.0222 3.0222 3.2956 3.2956 4.9667 4.9667 5.5838 5.5838 6.2235 6.2235 6.9278 6.9278 7.2796 7.2796 7.2944 7.2944 k = 0.1452-0.2069-0.4105 ( 8851 PWs) bands (ev): -27.1932 -27.1932 -27.1882 -27.1882 -27.0986 -27.0986 -27.0872 -27.0872 -10.9173 -10.9173 -10.8993 -10.8993 -10.8233 -10.8233 -10.7736 -10.7736 -10.6658 -10.6658 -10.6476 -10.6476 -10.6143 -10.6143 -10.5974 -10.5974 -10.5342 -10.5342 -10.5178 -10.5178 -10.4783 -10.4783 -10.4652 -10.4652 -6.0899 -6.0899 -5.4507 -5.4507 -3.2802 -3.2802 -3.2781 -3.2781 -2.9657 -2.9657 -2.9076 -2.9076 -2.8954 -2.8954 0.2059 0.2059 2.1673 2.1673 2.4319 2.4319 2.6984 2.6984 3.0042 3.0042 3.2908 3.2908 5.0413 5.0413 5.5471 5.5471 6.1881 6.1881 6.9326 6.9326 7.2440 7.2440 7.3375 7.3375 k = 0.1543-0.2198-0.4361 ( 8855 PWs) bands (ev): -27.1930 -27.1930 -27.1883 -27.1883 -27.0984 -27.0984 -27.0875 -27.0875 -10.9171 -10.9171 -10.9000 -10.9000 -10.8243 -10.8243 -10.7768 -10.7768 -10.6666 -10.6666 -10.6472 -10.6472 -10.6148 -10.6148 -10.5961 -10.5961 -10.5354 -10.5354 -10.5159 -10.5159 -10.4781 -10.4781 -10.4650 -10.4650 -6.0849 -6.0849 -5.4479 -5.4479 -3.2803 -3.2803 -3.2776 -3.2776 -2.9657 -2.9657 -2.9076 -2.9076 -2.8937 -2.8937 0.2149 0.2149 2.1410 2.1410 2.4300 2.4300 2.6942 2.6942 2.9872 2.9872 3.2853 3.2853 5.1111 5.1111 5.5178 5.5178 6.1510 6.1510 6.9347 6.9347 7.1890 7.1890 7.4012 7.4012 k = 0.1633-0.2328-0.4618 ( 8847 PWs) bands (ev): -27.1928 -27.1928 -27.1883 -27.1883 -27.0982 -27.0982 -27.0878 -27.0878 -10.9170 -10.9170 -10.9007 -10.9007 -10.8251 -10.8251 -10.7801 -10.7801 -10.6674 -10.6674 -10.6466 -10.6466 -10.6153 -10.6153 -10.5947 -10.5947 -10.5367 -10.5367 -10.5141 -10.5141 -10.4779 -10.4779 -10.4648 -10.4648 -6.0799 -6.0799 -5.4452 -5.4452 -3.2803 -3.2803 -3.2771 -3.2771 -2.9658 -2.9658 -2.9076 -2.9076 -2.8920 -2.8920 0.2239 0.2239 2.1170 2.1170 2.4280 2.4280 2.6887 2.6887 2.9716 2.9716 3.2787 3.2787 5.1727 5.1727 5.4991 5.4991 6.1131 6.1131 6.9361 6.9361 7.1314 7.1314 7.4679 7.4679 k = 0.1724-0.2457-0.4874 ( 8849 PWs) bands (ev): -27.1926 -27.1926 -27.1883 -27.1883 -27.0980 -27.0980 -27.0881 -27.0881 -10.9168 -10.9168 -10.9014 -10.9014 -10.8259 -10.8259 -10.7833 -10.7833 -10.6684 -10.6684 -10.6460 -10.6460 -10.6160 -10.6160 -10.5931 -10.5931 -10.5382 -10.5382 -10.5123 -10.5123 -10.4778 -10.4778 -10.4645 -10.4645 -6.0750 -6.0750 -5.4426 -5.4426 -3.2803 -3.2803 -3.2767 -3.2767 -2.9658 -2.9658 -2.9076 -2.9076 -2.8903 -2.8903 0.2331 0.2331 2.0957 2.0957 2.4258 2.4258 2.6819 2.6819 2.9574 2.9574 3.2711 3.2711 5.2202 5.2202 5.4964 5.4964 6.0749 6.0749 6.9378 6.9378 7.0727 7.0727 7.5356 7.5356 k = 0.1815-0.2586-0.5131 ( 8837 PWs) bands (ev): -27.1924 -27.1924 -27.1884 -27.1884 -27.0978 -27.0978 -27.0884 -27.0884 -10.9167 -10.9167 -10.9021 -10.9021 -10.8266 -10.8266 -10.7865 -10.7865 -10.6695 -10.6695 -10.6451 -10.6451 -10.6166 -10.6166 -10.5915 -10.5915 -10.5397 -10.5397 -10.5104 -10.5104 -10.4776 -10.4776 -10.4643 -10.4643 -6.0702 -6.0702 -5.4401 -5.4401 -3.2803 -3.2803 -3.2762 -3.2762 -2.9659 -2.9659 -2.9076 -2.9076 -2.8886 -2.8886 0.2422 0.2422 2.0773 2.0773 2.4232 2.4232 2.6735 2.6735 2.9448 2.9448 3.2622 3.2622 5.2482 5.2482 5.5151 5.5151 6.0369 6.0369 6.9401 6.9401 7.0141 7.0141 7.6027 7.6027 k = 0.1905-0.2716-0.5387 ( 8843 PWs) bands (ev): -27.1922 -27.1922 -27.1884 -27.1884 -27.0976 -27.0976 -27.0888 -27.0888 -10.9167 -10.9167 -10.9027 -10.9027 -10.8272 -10.8272 -10.7897 -10.7897 -10.6707 -10.6707 -10.6442 -10.6442 -10.6173 -10.6173 -10.5899 -10.5899 -10.5412 -10.5412 -10.5086 -10.5086 -10.4774 -10.4774 -10.4641 -10.4641 -6.0655 -6.0655 -5.4378 -5.4378 -3.2804 -3.2804 -3.2758 -3.2758 -2.9659 -2.9659 -2.9076 -2.9076 -2.8869 -2.8869 0.2512 0.2512 2.0618 2.0618 2.4202 2.4202 2.6637 2.6637 2.9340 2.9340 3.2520 3.2520 5.2576 5.2576 5.5538 5.5538 5.9997 5.9997 6.9405 6.9405 6.9590 6.9590 7.6681 7.6681 k = 0.1996-0.2845-0.5644 ( 8830 PWs) bands (ev): -27.1920 -27.1920 -27.1885 -27.1885 -27.0974 -27.0974 -27.0891 -27.0891 -10.9166 -10.9166 -10.9032 -10.9032 -10.8276 -10.8276 -10.7928 -10.7928 -10.6719 -10.6719 -10.6432 -10.6432 -10.6180 -10.6180 -10.5882 -10.5882 -10.5428 -10.5428 -10.5068 -10.5068 -10.4772 -10.4772 -10.4639 -10.4639 -6.0609 -6.0609 -5.4356 -5.4356 -3.2804 -3.2804 -3.2754 -3.2754 -2.9660 -2.9660 -2.9076 -2.9076 -2.8853 -2.8853 0.2601 0.2601 2.0494 2.0494 2.4168 2.4168 2.6523 2.6523 2.9249 2.9249 3.2405 3.2405 5.2556 5.2556 5.6051 5.6051 5.9636 5.9636 6.8962 6.8962 6.9508 6.9508 7.7309 7.7309 k = 0.2087-0.2974-0.5900 ( 8832 PWs) bands (ev): -27.1918 -27.1918 -27.1885 -27.1885 -27.0972 -27.0972 -27.0894 -27.0894 -10.9166 -10.9166 -10.9037 -10.9037 -10.8280 -10.8280 -10.7959 -10.7959 -10.6732 -10.6732 -10.6422 -10.6422 -10.6187 -10.6187 -10.5866 -10.5866 -10.5444 -10.5444 -10.5051 -10.5051 -10.4770 -10.4770 -10.4638 -10.4638 -6.0565 -6.0565 -5.4335 -5.4335 -3.2804 -3.2804 -3.2750 -3.2750 -2.9660 -2.9660 -2.9076 -2.9076 -2.8837 -2.8837 0.2687 0.2687 2.0402 2.0402 2.4128 2.4128 2.6394 2.6394 2.9177 2.9177 3.2277 3.2277 5.2488 5.2488 5.6621 5.6621 5.9291 5.9291 6.8407 6.8407 6.9564 6.9564 7.7868 7.7868 k = 0.2178-0.3103-0.6157 ( 8830 PWs) bands (ev): -27.1916 -27.1916 -27.1886 -27.1886 -27.0969 -27.0969 -27.0898 -27.0898 -10.9166 -10.9166 -10.9042 -10.9042 -10.8283 -10.8283 -10.7988 -10.7988 -10.6744 -10.6744 -10.6411 -10.6411 -10.6193 -10.6193 -10.5850 -10.5850 -10.5460 -10.5460 -10.5034 -10.5034 -10.4768 -10.4768 -10.4637 -10.4637 -6.0524 -6.0524 -5.4317 -5.4317 -3.2805 -3.2805 -3.2746 -3.2746 -2.9661 -2.9661 -2.9077 -2.9077 -2.8822 -2.8822 0.2771 0.2771 2.0342 2.0342 2.4081 2.4081 2.6251 2.6251 2.9124 2.9124 3.2134 3.2134 5.2412 5.2412 5.7206 5.7206 5.8964 5.8964 6.7861 6.7861 6.9636 6.9636 7.7857 7.7857 k = 0.2268-0.3233-0.6413 ( 8838 PWs) bands (ev): -27.1915 -27.1915 -27.1886 -27.1886 -27.0967 -27.0967 -27.0901 -27.0901 -10.9166 -10.9166 -10.9046 -10.9046 -10.8285 -10.8285 -10.8016 -10.8016 -10.6757 -10.6757 -10.6400 -10.6400 -10.6199 -10.6199 -10.5834 -10.5834 -10.5476 -10.5476 -10.5017 -10.5017 -10.4767 -10.4767 -10.4637 -10.4637 -6.0484 -6.0484 -5.4301 -5.4301 -3.2805 -3.2805 -3.2743 -3.2743 -2.9661 -2.9661 -2.9077 -2.9077 -2.8808 -2.8808 0.2851 0.2851 2.0314 2.0314 2.4027 2.4027 2.6096 2.6096 2.9089 2.9089 3.1979 3.1979 5.2347 5.2347 5.7774 5.7774 5.8667 5.8667 6.7330 6.7330 6.9723 6.9723 7.7686 7.7686 k = 0.2359-0.3362-0.6670 ( 8830 PWs) bands (ev): -27.1913 -27.1913 -27.1887 -27.1887 -27.0965 -27.0965 -27.0904 -27.0904 -10.9166 -10.9166 -10.9049 -10.9049 -10.8287 -10.8287 -10.8041 -10.8041 -10.6770 -10.6770 -10.6389 -10.6389 -10.6205 -10.6205 -10.5819 -10.5819 -10.5492 -10.5492 -10.5000 -10.5000 -10.4766 -10.4766 -10.4637 -10.4637 -6.0448 -6.0448 -5.4287 -5.4287 -3.2805 -3.2805 -3.2739 -3.2739 -2.9662 -2.9662 -2.9077 -2.9077 -2.8794 -2.8794 0.2928 0.2928 2.0319 2.0319 2.3964 2.3964 2.5931 2.5931 2.9072 2.9072 3.1810 3.1810 5.2303 5.2303 5.8187 5.8187 5.8527 5.8527 6.6816 6.6816 6.9824 6.9824 7.7510 7.7510 k = 0.2450-0.3491-0.6926 ( 8814 PWs) bands (ev): -27.1911 -27.1911 -27.1888 -27.1888 -27.0962 -27.0962 -27.0907 -27.0907 -10.9165 -10.9165 -10.9052 -10.9052 -10.8288 -10.8288 -10.8065 -10.8065 -10.6782 -10.6782 -10.6378 -10.6378 -10.6210 -10.6210 -10.5805 -10.5805 -10.5507 -10.5507 -10.4983 -10.4983 -10.4766 -10.4766 -10.4637 -10.4637 -6.0414 -6.0414 -5.4275 -5.4275 -3.2805 -3.2805 -3.2736 -3.2736 -2.9662 -2.9662 -2.9077 -2.9077 -2.8781 -2.8781 0.3000 0.3000 2.0355 2.0355 2.3890 2.3890 2.5761 2.5761 2.9073 2.9073 3.1631 3.1631 5.2287 5.2287 5.8028 5.8028 5.8954 5.8954 6.6319 6.6319 6.9940 6.9940 7.7341 7.7341 k = 0.2541-0.3621-0.7183 ( 8820 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0959 -27.0959 -27.0911 -27.0911 -10.9165 -10.9165 -10.9055 -10.9055 -10.8290 -10.8290 -10.8087 -10.8087 -10.6794 -10.6794 -10.6368 -10.6368 -10.6215 -10.6215 -10.5791 -10.5791 -10.5522 -10.5522 -10.4966 -10.4966 -10.4767 -10.4767 -10.4638 -10.4638 -6.0382 -6.0382 -5.4266 -5.4266 -3.2805 -3.2805 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8769 -2.8769 0.3068 0.3068 2.0422 2.0422 2.3802 2.3802 2.5588 2.5588 2.9090 2.9090 3.1442 3.1442 5.2300 5.2300 5.7784 5.7784 5.9454 5.9454 6.5841 6.5841 7.0070 7.0070 7.7183 7.7183 k = 0.2631-0.3750-0.7439 ( 8818 PWs) bands (ev): -27.1907 -27.1907 -27.1889 -27.1889 -27.0957 -27.0957 -27.0914 -27.0914 -10.9165 -10.9165 -10.9057 -10.9057 -10.8291 -10.8291 -10.8106 -10.8106 -10.6805 -10.6805 -10.6358 -10.6358 -10.6219 -10.6219 -10.5778 -10.5778 -10.5536 -10.5536 -10.4950 -10.4950 -10.4769 -10.4769 -10.4640 -10.4640 -6.0354 -6.0354 -5.4259 -5.4259 -3.2806 -3.2806 -3.2731 -3.2731 -2.9662 -2.9662 -2.9077 -2.9077 -2.8758 -2.8758 0.3130 0.3130 2.0520 2.0520 2.3696 2.3696 2.5420 2.5420 2.9120 2.9120 3.1246 3.1246 5.2346 5.2346 5.7549 5.7549 5.9927 5.9927 6.5386 6.5386 7.0217 7.0217 7.7041 7.7041 k = 0.2722-0.3879-0.7696 ( 8810 PWs) bands (ev): -27.1906 -27.1906 -27.1890 -27.1890 -27.0954 -27.0954 -27.0917 -27.0917 -10.9164 -10.9164 -10.9058 -10.9058 -10.8292 -10.8292 -10.8123 -10.8123 -10.6815 -10.6815 -10.6349 -10.6349 -10.6223 -10.6223 -10.5765 -10.5765 -10.5550 -10.5550 -10.4934 -10.4934 -10.4772 -10.4772 -10.4641 -10.4641 -6.0328 -6.0328 -5.4254 -5.4254 -3.2806 -3.2806 -3.2728 -3.2728 -2.9663 -2.9663 -2.9077 -2.9077 -2.8748 -2.8748 0.3188 0.3188 2.0646 2.0646 2.3571 2.3571 2.5261 2.5261 2.9163 2.9163 3.1047 3.1047 5.2425 5.2425 5.7329 5.7329 6.0361 6.0361 6.4959 6.4959 7.0379 7.0379 7.6915 7.6915 k = 0.2813-0.4009-0.7952 ( 8818 PWs) bands (ev): -27.1904 -27.1904 -27.1891 -27.1891 -27.0952 -27.0952 -27.0920 -27.0920 -10.9164 -10.9164 -10.9060 -10.9060 -10.8294 -10.8294 -10.8137 -10.8137 -10.6824 -10.6824 -10.6341 -10.6341 -10.6226 -10.6226 -10.5753 -10.5753 -10.5563 -10.5563 -10.4919 -10.4919 -10.4776 -10.4776 -10.4643 -10.4643 -6.0305 -6.0305 -5.4252 -5.4252 -3.2806 -3.2806 -3.2726 -3.2726 -2.9663 -2.9663 -2.9077 -2.9077 -2.8739 -2.8739 0.3240 0.3240 2.0797 2.0797 2.3423 2.3423 2.5117 2.5117 2.9212 2.9212 3.0850 3.0850 5.2538 5.2538 5.7124 5.7124 6.0740 6.0740 6.4570 6.4570 7.0556 7.0556 7.6805 7.6805 k = 0.2904-0.4138-0.8209 ( 8812 PWs) bands (ev): -27.1903 -27.1903 -27.1892 -27.1892 -27.0949 -27.0949 -27.0923 -27.0923 -10.9163 -10.9163 -10.9061 -10.9061 -10.8296 -10.8296 -10.8148 -10.8148 -10.6833 -10.6833 -10.6334 -10.6334 -10.6229 -10.6229 -10.5741 -10.5741 -10.5574 -10.5574 -10.4904 -10.4904 -10.4781 -10.4781 -10.4644 -10.4644 -6.0285 -6.0285 -5.4252 -5.4252 -3.2806 -3.2806 -3.2725 -3.2725 -2.9663 -2.9663 -2.9077 -2.9077 -2.8731 -2.8731 0.3288 0.3288 2.0971 2.0971 2.3255 2.3255 2.4991 2.4991 2.9259 2.9259 3.0666 3.0666 5.2684 5.2684 5.6934 5.6934 6.1048 6.1048 6.4238 6.4238 7.0749 7.0749 7.6709 7.6709 k = 0.2994-0.4267-0.8466 ( 8808 PWs) bands (ev): -27.1901 -27.1901 -27.1893 -27.1893 -27.0946 -27.0946 -27.0926 -27.0926 -10.9161 -10.9161 -10.9062 -10.9062 -10.8298 -10.8298 -10.8157 -10.8157 -10.6840 -10.6840 -10.6328 -10.6328 -10.6232 -10.6232 -10.5730 -10.5730 -10.5585 -10.5585 -10.4891 -10.4891 -10.4787 -10.4787 -10.4646 -10.4646 -6.0268 -6.0268 -5.4255 -5.4255 -3.2806 -3.2806 -3.2723 -3.2723 -2.9663 -2.9663 -2.9077 -2.9077 -2.8724 -2.8724 0.3329 0.3329 2.1160 2.1160 2.3071 2.3071 2.4885 2.4885 2.9290 2.9290 3.0510 3.0510 5.2863 5.2863 5.6757 5.6757 6.1253 6.1253 6.3991 6.3991 7.0956 7.0956 7.6623 7.6623 k = 0.3085-0.4397-0.8722 ( 8800 PWs) bands (ev): -27.1900 -27.1900 -27.1894 -27.1894 -27.0944 -27.0944 -27.0929 -27.0929 -10.9160 -10.9160 -10.9063 -10.9063 -10.8300 -10.8300 -10.8163 -10.8163 -10.6845 -10.6845 -10.6324 -10.6324 -10.6233 -10.6233 -10.5719 -10.5719 -10.5595 -10.5595 -10.4879 -10.4879 -10.4792 -10.4792 -10.4647 -10.4647 -6.0253 -6.0253 -5.4259 -5.4259 -3.2806 -3.2806 -3.2721 -3.2721 -2.9663 -2.9663 -2.9077 -2.9077 -2.8718 -2.8718 0.3366 0.3366 2.1352 2.1352 2.2887 2.2887 2.4797 2.4797 2.9282 2.9282 3.0406 3.0406 5.3075 5.3075 5.6593 5.6593 6.1322 6.1322 6.3865 6.3865 7.1174 7.1174 7.6537 7.6537 k = 0.3176-0.4526-0.8979 ( 8802 PWs) bands (ev): -27.1899 -27.1899 -27.1895 -27.1895 -27.0941 -27.0941 -27.0932 -27.0932 -10.9158 -10.9158 -10.9064 -10.9064 -10.8301 -10.8301 -10.8167 -10.8167 -10.6850 -10.6850 -10.6321 -10.6321 -10.6234 -10.6234 -10.5709 -10.5709 -10.5605 -10.5605 -10.4871 -10.4871 -10.4797 -10.4797 -10.4647 -10.4647 -6.0241 -6.0241 -5.4265 -5.4265 -3.2806 -3.2806 -3.2720 -3.2720 -2.9663 -2.9663 -2.9077 -2.9077 -2.8713 -2.8713 0.3397 0.3397 2.1519 2.1519 2.2731 2.2731 2.4726 2.4726 2.9214 2.9214 3.0376 3.0376 5.3318 5.3318 5.6440 5.6440 6.1240 6.1240 6.3873 6.3873 7.1400 7.1400 7.6442 7.6442 k = 0.3267-0.4655-0.9235 ( 8798 PWs) bands (ev): -27.1898 -27.1898 -27.1896 -27.1896 -27.0938 -27.0938 -27.0935 -27.0935 -10.9156 -10.9156 -10.9065 -10.9065 -10.8302 -10.8302 -10.8170 -10.8170 -10.6853 -10.6853 -10.6320 -10.6320 -10.6234 -10.6234 -10.5700 -10.5700 -10.5612 -10.5612 -10.4867 -10.4867 -10.4800 -10.4800 -10.4647 -10.4647 -6.0232 -6.0232 -5.4274 -5.4274 -3.2806 -3.2806 -3.2719 -3.2719 -2.9663 -2.9663 -2.9077 -2.9077 -2.8709 -2.8709 0.3423 0.3423 2.1604 2.1604 2.2662 2.2662 2.4670 2.4670 2.9084 2.9084 3.0422 3.0422 5.3592 5.3592 5.6298 5.6298 6.1033 6.1033 6.3993 6.3993 7.1631 7.1631 7.6322 7.6322 k = 0.3357-0.4784-0.9492 ( 8804 PWs) bands (ev): -27.1897 -27.1897 -27.1897 -27.1897 -27.0937 -27.0937 -27.0936 -27.0936 -10.9154 -10.9154 -10.9065 -10.9065 -10.8303 -10.8303 -10.8172 -10.8172 -10.6854 -10.6854 -10.6322 -10.6322 -10.6232 -10.6232 -10.5692 -10.5692 -10.5618 -10.5618 -10.4869 -10.4869 -10.4799 -10.4799 -10.4646 -10.4646 -6.0224 -6.0224 -5.4283 -5.4283 -3.2806 -3.2806 -3.2718 -3.2718 -2.9663 -2.9663 -2.9077 -2.9077 -2.8706 -2.8706 0.3445 0.3445 2.1551 2.1551 2.2739 2.2739 2.4628 2.4628 2.8911 2.8911 3.0528 3.0528 5.3895 5.3895 5.6166 5.6166 6.0744 6.0744 6.4180 6.4180 7.1859 7.1859 7.6160 7.6160 k = 0.3448-0.4914-0.9748 ( 8806 PWs) bands (ev): -27.1898 -27.1898 -27.1896 -27.1896 -27.0940 -27.0940 -27.0933 -27.0933 -10.9152 -10.9152 -10.9066 -10.9066 -10.8302 -10.8302 -10.8173 -10.8173 -10.6854 -10.6854 -10.6326 -10.6326 -10.6229 -10.6229 -10.5686 -10.5686 -10.5620 -10.5620 -10.4876 -10.4876 -10.4796 -10.4796 -10.4645 -10.4645 -6.0219 -6.0219 -5.4294 -5.4294 -3.2806 -3.2806 -3.2718 -3.2718 -2.9663 -2.9663 -2.9077 -2.9077 -2.8703 -2.8703 0.3463 0.3463 2.1385 2.1385 2.2935 2.2935 2.4599 2.4599 2.8713 2.8713 3.0675 3.0675 5.4225 5.4225 5.6043 5.6043 6.0409 6.0409 6.4401 6.4401 7.2079 7.2079 7.5940 7.5940 k = 0.6552-0.3335-0.8776 ( 8806 PWs) bands (ev): -27.1898 -27.1898 -27.1896 -27.1896 -27.0940 -27.0940 -27.0933 -27.0933 -10.9152 -10.9152 -10.9066 -10.9066 -10.8302 -10.8302 -10.8173 -10.8173 -10.6854 -10.6854 -10.6326 -10.6326 -10.6229 -10.6229 -10.5686 -10.5686 -10.5620 -10.5620 -10.4876 -10.4876 -10.4796 -10.4796 -10.4645 -10.4645 -6.0219 -6.0219 -5.4294 -5.4294 -3.2806 -3.2806 -3.2718 -3.2718 -2.9663 -2.9663 -2.9077 -2.9077 -2.8703 -2.8703 0.3463 0.3463 2.1385 2.1385 2.2935 2.2935 2.4599 2.4599 2.8713 2.8713 3.0675 3.0675 5.4225 5.4225 5.6043 5.6043 6.0409 6.0409 6.4401 6.4401 7.2079 7.2079 7.5940 7.5940 k = 0.6461-0.3046-0.8776 ( 8814 PWs) bands (ev): -27.1899 -27.1899 -27.1895 -27.1895 -27.0942 -27.0942 -27.0931 -27.0931 -10.9150 -10.9150 -10.9067 -10.9067 -10.8300 -10.8300 -10.8173 -10.8173 -10.6852 -10.6852 -10.6332 -10.6332 -10.6225 -10.6225 -10.5685 -10.5685 -10.5618 -10.5618 -10.4888 -10.4888 -10.4791 -10.4791 -10.4642 -10.4642 -6.0215 -6.0215 -5.4307 -5.4307 -3.2806 -3.2806 -3.2717 -3.2717 -2.9664 -2.9664 -2.9077 -2.9077 -2.8701 -2.8701 0.3476 0.3476 2.1160 2.1160 2.3193 2.3193 2.4587 2.4587 2.8502 2.8502 3.0851 3.0851 5.4580 5.4580 5.5930 5.5930 6.0048 6.0048 6.4637 6.4637 7.2281 7.2281 7.5650 7.5650 k = 0.6369-0.2756-0.8776 ( 8824 PWs) bands (ev): -27.1900 -27.1900 -27.1894 -27.1894 -27.0944 -27.0944 -27.0929 -27.0929 -10.9148 -10.9148 -10.9067 -10.9067 -10.8298 -10.8298 -10.8173 -10.8173 -10.6849 -10.6849 -10.6341 -10.6341 -10.6220 -10.6220 -10.5688 -10.5688 -10.5610 -10.5610 -10.4903 -10.4903 -10.4786 -10.4786 -10.4637 -10.4637 -6.0214 -6.0214 -5.4320 -5.4320 -3.2806 -3.2806 -3.2717 -3.2717 -2.9664 -2.9664 -2.9077 -2.9077 -2.8700 -2.8700 0.3486 0.3486 2.0913 2.0913 2.3467 2.3467 2.4598 2.4598 2.8288 2.8288 3.1047 3.1047 5.4949 5.4949 5.5832 5.5832 5.9677 5.9677 6.4873 6.4873 7.2453 7.2453 7.5287 7.5287 k = 0.6278-0.2467-0.8776 ( 8814 PWs) bands (ev): -27.1901 -27.1901 -27.1893 -27.1893 -27.0946 -27.0946 -27.0926 -27.0926 -10.9147 -10.9147 -10.9067 -10.9067 -10.8294 -10.8294 -10.8173 -10.8173 -10.6844 -10.6844 -10.6351 -10.6351 -10.6214 -10.6214 -10.5695 -10.5695 -10.5599 -10.5599 -10.4920 -10.4920 -10.4782 -10.4782 -10.4631 -10.4631 -6.0213 -6.0213 -5.4334 -5.4334 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9077 -2.9077 -2.8699 -2.8699 0.3493 0.3493 2.0659 2.0659 2.3725 2.3725 2.4650 2.4650 2.8077 2.8077 3.1256 3.1256 5.5300 5.5300 5.5780 5.5780 5.9307 5.9307 6.5103 6.5103 7.2581 7.2581 7.4859 7.4859 k = 0.6187-0.2178-0.8776 ( 8814 PWs) bands (ev): -27.1902 -27.1902 -27.1892 -27.1892 -27.0948 -27.0948 -27.0924 -27.0924 -10.9145 -10.9145 -10.9066 -10.9066 -10.8290 -10.8290 -10.8173 -10.8173 -10.6837 -10.6837 -10.6362 -10.6362 -10.6208 -10.6208 -10.5703 -10.5703 -10.5584 -10.5584 -10.4938 -10.4938 -10.4779 -10.4779 -10.4625 -10.4625 -6.0214 -6.0214 -5.4348 -5.4348 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8699 -2.8699 0.3496 0.3496 2.0406 2.0406 2.3927 2.3927 2.4771 2.4771 2.7872 2.7872 3.1475 3.1475 5.5465 5.5465 5.5934 5.5934 5.8945 5.8945 6.5321 6.5321 7.2652 7.2652 7.4378 7.4378 k = 0.6096-0.1889-0.8776 ( 8812 PWs) bands (ev): -27.1903 -27.1903 -27.1892 -27.1892 -27.0950 -27.0950 -27.0922 -27.0922 -10.9144 -10.9144 -10.9066 -10.9066 -10.8285 -10.8285 -10.8173 -10.8173 -10.6828 -10.6828 -10.6375 -10.6375 -10.6202 -10.6202 -10.5713 -10.5713 -10.5567 -10.5567 -10.4958 -10.4958 -10.4777 -10.4777 -10.4617 -10.4617 -6.0216 -6.0216 -5.4363 -5.4363 -3.2806 -3.2806 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8699 -2.8699 0.3498 0.3498 2.0161 2.0161 2.4049 2.4049 2.4976 2.4976 2.7676 2.7676 3.1699 3.1699 5.5427 5.5427 5.6302 5.6302 5.8603 5.8603 6.5525 6.5525 7.2655 7.2655 7.3858 7.3858 k = 0.6004-0.1600-0.8776 ( 8810 PWs) bands (ev): -27.1904 -27.1904 -27.1891 -27.1891 -27.0952 -27.0952 -27.0920 -27.0920 -10.9143 -10.9143 -10.9065 -10.9065 -10.8279 -10.8279 -10.8173 -10.8173 -10.6818 -10.6818 -10.6389 -10.6389 -10.6195 -10.6195 -10.5724 -10.5724 -10.5549 -10.5549 -10.4979 -10.4979 -10.4777 -10.4777 -10.4609 -10.4609 -6.0219 -6.0219 -5.4377 -5.4377 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8700 -2.8700 0.3497 0.3497 1.9925 1.9925 2.4108 2.4108 2.5244 2.5244 2.7494 2.7494 3.1925 3.1925 5.5351 5.5351 5.6696 5.6696 5.8305 5.8305 6.5712 6.5712 7.2582 7.2582 7.3318 7.3318 k = 0.5913-0.1311-0.8776 ( 8810 PWs) bands (ev): -27.1905 -27.1905 -27.1891 -27.1891 -27.0953 -27.0953 -27.0918 -27.0918 -10.9142 -10.9142 -10.9064 -10.9064 -10.8273 -10.8273 -10.8173 -10.8173 -10.6806 -10.6806 -10.6404 -10.6404 -10.6188 -10.6188 -10.5736 -10.5736 -10.5529 -10.5529 -10.5002 -10.5002 -10.4776 -10.4776 -10.4600 -10.4600 -6.0222 -6.0222 -5.4391 -5.4391 -3.2807 -3.2807 -3.2716 -3.2716 -2.9663 -2.9663 -2.9076 -2.9076 -2.8700 -2.8700 0.3495 0.3495 1.9703 1.9703 2.4132 2.4132 2.5536 2.5536 2.7327 2.7327 3.2148 3.2148 5.5270 5.5270 5.7012 5.7012 5.8122 5.8122 6.5880 6.5880 7.2418 7.2418 7.2786 7.2786 k = 0.5822-0.1022-0.8776 ( 8814 PWs) bands (ev): -27.1906 -27.1906 -27.1890 -27.1890 -27.0955 -27.0955 -27.0917 -27.0917 -10.9141 -10.9141 -10.9062 -10.9062 -10.8266 -10.8266 -10.8174 -10.8174 -10.6793 -10.6793 -10.6420 -10.6420 -10.6182 -10.6182 -10.5748 -10.5748 -10.5508 -10.5508 -10.5025 -10.5025 -10.4777 -10.4777 -10.4592 -10.4592 -6.0226 -6.0226 -5.4405 -5.4405 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8701 -2.8701 0.3491 0.3491 1.9497 1.9497 2.4140 2.4140 2.5828 2.5828 2.7181 2.7181 3.2366 3.2366 5.5191 5.5191 5.7088 5.7088 5.8208 5.8208 6.6027 6.6027 7.2079 7.2079 7.2371 7.2371 k = 0.5730-0.0733-0.8776 ( 8828 PWs) bands (ev): -27.1907 -27.1907 -27.1890 -27.1890 -27.0956 -27.0956 -27.0915 -27.0915 -10.9141 -10.9141 -10.9061 -10.9061 -10.8259 -10.8259 -10.8175 -10.8175 -10.6779 -10.6779 -10.6437 -10.6437 -10.6175 -10.6175 -10.5759 -10.5759 -10.5485 -10.5485 -10.5050 -10.5050 -10.4777 -10.4777 -10.4584 -10.4584 -6.0230 -6.0230 -5.4418 -5.4418 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8702 -2.8702 0.3487 0.3487 1.9308 1.9308 2.4140 2.4140 2.6096 2.6096 2.7066 2.7066 3.2575 3.2575 5.5116 5.5116 5.6934 5.6934 5.8549 5.8549 6.6151 6.6151 7.1571 7.1571 7.2094 7.2094 k = 0.5639-0.0444-0.8776 ( 8822 PWs) bands (ev): -27.1907 -27.1907 -27.1889 -27.1889 -27.0957 -27.0957 -27.0914 -27.0914 -10.9141 -10.9141 -10.9059 -10.9059 -10.8252 -10.8252 -10.8176 -10.8176 -10.6763 -10.6763 -10.6454 -10.6454 -10.6169 -10.6169 -10.5771 -10.5771 -10.5461 -10.5461 -10.5075 -10.5075 -10.4778 -10.4778 -10.4576 -10.4576 -6.0234 -6.0234 -5.4430 -5.4430 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8703 -2.8703 0.3482 0.3482 1.9137 1.9137 2.4135 2.4135 2.6310 2.6310 2.7005 2.7005 3.2770 3.2770 5.5046 5.5046 5.6710 5.6710 5.8983 5.8983 6.6248 6.6248 7.1049 7.1049 7.1832 7.1832 k = 0.5548-0.0155-0.8776 ( 8824 PWs) bands (ev): -27.1908 -27.1908 -27.1889 -27.1889 -27.0958 -27.0958 -27.0912 -27.0912 -10.9141 -10.9141 -10.9057 -10.9057 -10.8246 -10.8246 -10.8178 -10.8178 -10.6747 -10.6747 -10.6471 -10.6471 -10.6163 -10.6163 -10.5781 -10.5781 -10.5437 -10.5437 -10.5101 -10.5101 -10.4779 -10.4779 -10.4569 -10.4569 -6.0237 -6.0237 -5.4440 -5.4440 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8704 -2.8704 0.3478 0.3478 1.8987 1.8987 2.4129 2.4129 2.6422 2.6422 2.7037 2.7037 3.2948 3.2948 5.4983 5.4983 5.6481 5.6481 5.9437 5.9437 6.6318 6.6318 7.0551 7.0551 7.1574 7.1574 k = 0.5456 0.0134-0.8776 ( 8832 PWs) bands (ev): -27.1908 -27.1908 -27.1889 -27.1889 -27.0959 -27.0959 -27.0911 -27.0911 -10.9141 -10.9141 -10.9056 -10.9056 -10.8239 -10.8239 -10.8180 -10.8180 -10.6730 -10.6730 -10.6488 -10.6488 -10.6158 -10.6158 -10.5791 -10.5791 -10.5412 -10.5412 -10.5127 -10.5127 -10.4780 -10.4780 -10.4563 -10.4563 -6.0241 -6.0241 -5.4450 -5.4450 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8705 -2.8705 0.3473 0.3473 1.8858 1.8858 2.4123 2.4123 2.6433 2.6433 2.7158 2.7158 3.3106 3.3106 5.4928 5.4928 5.6271 5.6271 5.9883 5.9883 6.6358 6.6358 7.0096 7.0096 7.1333 7.1333 k = 0.5365 0.0423-0.8776 ( 8830 PWs) bands (ev): -27.1909 -27.1909 -27.1889 -27.1889 -27.0960 -27.0960 -27.0911 -27.0911 -10.9142 -10.9142 -10.9055 -10.9055 -10.8233 -10.8233 -10.8183 -10.8183 -10.6713 -10.6713 -10.6505 -10.6505 -10.6154 -10.6154 -10.5800 -10.5800 -10.5386 -10.5386 -10.5154 -10.5154 -10.4781 -10.4781 -10.4558 -10.4558 -6.0244 -6.0244 -5.4458 -5.4458 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8706 -2.8706 0.3469 0.3469 1.8752 1.8752 2.4117 2.4117 2.6399 2.6399 2.7307 2.7307 3.3240 3.3240 5.4881 5.4881 5.6090 5.6090 6.0298 6.0298 6.6367 6.6367 6.9701 6.9701 7.1119 7.1119 k = 0.5274 0.0712-0.8776 ( 8838 PWs) bands (ev): -27.1909 -27.1909 -27.1889 -27.1889 -27.0960 -27.0960 -27.0910 -27.0910 -10.9142 -10.9142 -10.9053 -10.9053 -10.8227 -10.8227 -10.8186 -10.8186 -10.6697 -10.6697 -10.6522 -10.6522 -10.6150 -10.6150 -10.5807 -10.5807 -10.5360 -10.5360 -10.5180 -10.5180 -10.4781 -10.4781 -10.4554 -10.4554 -6.0246 -6.0246 -5.4464 -5.4464 -3.2808 -3.2808 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8706 -2.8706 0.3466 0.3466 1.8668 1.8668 2.4112 2.4112 2.6357 2.6357 2.7443 2.7443 3.3348 3.3348 5.4844 5.4844 5.5943 5.5943 6.0661 6.0661 6.6350 6.6350 6.9380 6.9380 7.0944 7.0944 k = 0.5183 0.1001-0.8776 ( 8820 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9053 -10.9053 -10.8222 -10.8222 -10.8188 -10.8188 -10.6683 -10.6683 -10.6535 -10.6535 -10.6147 -10.6147 -10.5812 -10.5812 -10.5335 -10.5335 -10.5206 -10.5206 -10.4782 -10.4782 -10.4551 -10.4551 -6.0248 -6.0248 -5.4468 -5.4468 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8707 -2.8707 0.3463 0.3463 1.8608 1.8608 2.4108 2.4108 2.6322 2.6322 2.7547 2.7547 3.3427 3.3427 5.4817 5.4817 5.5836 5.5836 6.0948 6.0948 6.6316 6.6316 6.9145 6.9145 7.0813 7.0813 k = 0.5091 0.1290-0.8776 ( 8824 PWs) bands (ev): -27.1909 -27.1909 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8219 -10.8219 -10.8191 -10.8191 -10.6673 -10.6673 -10.6545 -10.6545 -10.6145 -10.6145 -10.5815 -10.5815 -10.5313 -10.5313 -10.5228 -10.5228 -10.4782 -10.4782 -10.4549 -10.4549 -6.0249 -6.0249 -5.4471 -5.4471 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8707 -2.8707 0.3462 0.3462 1.8572 1.8572 2.4106 2.4106 2.6300 2.6300 2.7612 2.7612 3.3475 3.3475 5.4800 5.4800 5.5770 5.5770 6.1135 6.1135 6.6283 6.6283 6.9004 6.9004 7.0733 7.0733 k = 0.5000 0.1579-0.8776 ( 8842 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8217 -10.8217 -10.8192 -10.8192 -10.6670 -10.6670 -10.6549 -10.6549 -10.6145 -10.6145 -10.5817 -10.5817 -10.5302 -10.5302 -10.5239 -10.5239 -10.4782 -10.4782 -10.4549 -10.4549 -6.0250 -6.0250 -5.4472 -5.4472 -3.2808 -3.2808 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8707 -2.8707 0.3461 0.3461 1.8560 1.8560 2.4105 2.4105 2.6292 2.6292 2.7634 2.7634 3.3491 3.3491 5.4795 5.4795 5.5748 5.5748 6.1200 6.1200 6.6269 6.6269 6.8956 6.8956 7.0706 7.0706 k = 0.5000 0.1579-0.8776 ( 8842 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8217 -10.8217 -10.8192 -10.8192 -10.6670 -10.6670 -10.6549 -10.6549 -10.6145 -10.6145 -10.5817 -10.5817 -10.5302 -10.5302 -10.5239 -10.5239 -10.4782 -10.4782 -10.4549 -10.4549 -6.0250 -6.0250 -5.4472 -5.4472 -3.2808 -3.2808 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8707 -2.8707 0.3461 0.3461 1.8560 1.8560 2.4105 2.4105 2.6292 2.6292 2.7634 2.7634 3.3491 3.3491 5.4795 5.4795 5.5748 5.5748 6.1200 6.1200 6.6269 6.6269 6.8956 6.8956 7.0706 7.0706 k = 0.5222 0.1649-0.8637 ( 8831 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8217 -10.8217 -10.8191 -10.8191 -10.6670 -10.6670 -10.6549 -10.6549 -10.6144 -10.6144 -10.5817 -10.5817 -10.5301 -10.5301 -10.5239 -10.5239 -10.4782 -10.4782 -10.4549 -10.4549 -6.0250 -6.0250 -5.4472 -5.4472 -3.2808 -3.2808 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8708 -2.8708 0.3458 0.3458 1.8574 1.8574 2.4055 2.4055 2.6339 2.6339 2.7636 2.7636 3.3488 3.3488 5.4669 5.4669 5.5869 5.5869 6.1213 6.1213 6.6290 6.6290 6.8751 6.8751 7.0905 7.0905 k = 0.5443 0.1719-0.8498 ( 8823 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8217 -10.8217 -10.8190 -10.8190 -10.6670 -10.6670 -10.6549 -10.6549 -10.6143 -10.6143 -10.5820 -10.5820 -10.5300 -10.5300 -10.5239 -10.5239 -10.4782 -10.4782 -10.4549 -10.4549 -6.0251 -6.0251 -5.4471 -5.4471 -3.2807 -3.2807 -3.2717 -3.2717 -2.9663 -2.9663 -2.9076 -2.9076 -2.8708 -2.8708 0.3450 0.3450 1.8615 1.8615 2.3918 2.3918 2.6463 2.6463 2.7643 2.7643 3.3480 3.3480 5.4394 5.4394 5.6131 5.6131 6.1255 6.1255 6.6345 6.6345 6.8297 6.8297 7.1345 7.1345 k = 0.5665 0.1789-0.8359 ( 8831 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9142 -10.9142 -10.9052 -10.9052 -10.8217 -10.8217 -10.8187 -10.8187 -10.6672 -10.6672 -10.6548 -10.6548 -10.6141 -10.6141 -10.5823 -10.5823 -10.5298 -10.5298 -10.5238 -10.5238 -10.4783 -10.4783 -10.4550 -10.4550 -6.0254 -6.0254 -5.4470 -5.4470 -3.2807 -3.2807 -3.2718 -3.2718 -2.9663 -2.9663 -2.9076 -2.9076 -2.8709 -2.8709 0.3437 0.3437 1.8682 1.8682 2.3725 2.3725 2.6637 2.6637 2.7656 2.7656 3.3466 3.3466 5.4070 5.4070 5.6437 5.6437 6.1323 6.1323 6.6409 6.6409 6.7784 6.7784 7.1862 7.1862 k = 0.5887 0.1859-0.8220 ( 8830 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9143 -10.9143 -10.9053 -10.9053 -10.8218 -10.8218 -10.8184 -10.8184 -10.6673 -10.6673 -10.6548 -10.6548 -10.6138 -10.6138 -10.5828 -10.5828 -10.5296 -10.5296 -10.5237 -10.5237 -10.4783 -10.4783 -10.4551 -10.4551 -6.0257 -6.0257 -5.4468 -5.4468 -3.2807 -3.2807 -3.2718 -3.2718 -2.9663 -2.9663 -2.9076 -2.9076 -2.8710 -2.8710 0.3419 0.3419 1.8771 1.8771 2.3503 2.3503 2.6831 2.6831 2.7677 2.7677 3.3448 3.3448 5.3733 5.3733 5.6753 5.6753 6.1416 6.1416 6.6382 6.6382 6.7366 6.7366 7.2395 7.2395 k = 0.6109 0.1929-0.8081 ( 8831 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9143 -10.9143 -10.9053 -10.9053 -10.8218 -10.8218 -10.8180 -10.8180 -10.6675 -10.6675 -10.6547 -10.6547 -10.6135 -10.6135 -10.5834 -10.5834 -10.5293 -10.5293 -10.5236 -10.5236 -10.4784 -10.4784 -10.4552 -10.4552 -6.0262 -6.0262 -5.4466 -5.4466 -3.2807 -3.2807 -3.2719 -3.2719 -2.9663 -2.9663 -2.9076 -2.9076 -2.8712 -2.8712 0.3397 0.3397 1.8878 1.8878 2.3275 2.3275 2.7022 2.7022 2.7708 2.7708 3.3425 3.3425 5.3399 5.3399 5.7069 5.7069 6.1535 6.1535 6.6069 6.6069 6.7259 6.7259 7.2919 7.2919 k = 0.6330 0.1999-0.7942 ( 8834 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9144 -10.9144 -10.9054 -10.9054 -10.8218 -10.8218 -10.8175 -10.8175 -10.6678 -10.6678 -10.6546 -10.6546 -10.6131 -10.6131 -10.5842 -10.5842 -10.5290 -10.5290 -10.5234 -10.5234 -10.4785 -10.4785 -10.4554 -10.4554 -6.0267 -6.0267 -5.4463 -5.4463 -3.2807 -3.2807 -3.2719 -3.2719 -2.9663 -2.9663 -2.9076 -2.9076 -2.8715 -2.8715 0.3370 0.3370 1.8997 1.8997 2.3060 2.3060 2.7190 2.7190 2.7754 2.7754 3.3398 3.3398 5.3077 5.3077 5.7381 5.7381 6.1675 6.1675 6.5539 6.5539 6.7397 6.7397 7.3421 7.3421 k = 0.6552 0.2069-0.7803 ( 8821 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9144 -10.9144 -10.9055 -10.9055 -10.8219 -10.8219 -10.8170 -10.8170 -10.6680 -10.6680 -10.6544 -10.6544 -10.6126 -10.6126 -10.5850 -10.5850 -10.5287 -10.5287 -10.5231 -10.5231 -10.4785 -10.4785 -10.4556 -10.4556 -6.0274 -6.0274 -5.4459 -5.4459 -3.2807 -3.2807 -3.2720 -3.2720 -2.9663 -2.9663 -2.9076 -2.9076 -2.8717 -2.8717 0.3340 0.3340 1.9119 1.9119 2.2871 2.2871 2.7323 2.7323 2.7820 2.7820 3.3368 3.3368 5.2773 5.2773 5.7683 5.7683 6.1836 6.1836 6.4951 6.4951 6.7628 6.7628 7.3884 7.3884 k = 0.6552 0.2069-0.7803 ( 8821 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9144 -10.9144 -10.9055 -10.9055 -10.8219 -10.8219 -10.8170 -10.8170 -10.6680 -10.6680 -10.6544 -10.6544 -10.6126 -10.6126 -10.5850 -10.5850 -10.5287 -10.5287 -10.5231 -10.5231 -10.4785 -10.4785 -10.4556 -10.4556 -6.0274 -6.0274 -5.4459 -5.4459 -3.2807 -3.2807 -3.2720 -3.2720 -2.9663 -2.9663 -2.9076 -2.9076 -2.8717 -2.8717 0.3340 0.3340 1.9119 1.9119 2.2871 2.2871 2.7323 2.7323 2.7820 2.7820 3.3368 3.3368 5.2773 5.2773 5.7683 5.7683 6.1836 6.1836 6.4951 6.4951 6.7628 6.7628 7.3884 7.3884 k = 0.6500 0.2053-0.7511 ( 8824 PWs) bands (ev): -27.1911 -27.1911 -27.1888 -27.1888 -27.0963 -27.0963 -27.0906 -27.0906 -10.9145 -10.9145 -10.9051 -10.9051 -10.8227 -10.8227 -10.8153 -10.8153 -10.6684 -10.6684 -10.6539 -10.6539 -10.6127 -10.6127 -10.5850 -10.5850 -10.5292 -10.5292 -10.5228 -10.5228 -10.4786 -10.4786 -10.4557 -10.4557 -6.0275 -6.0275 -5.4482 -5.4482 -3.2807 -3.2807 -3.2720 -3.2720 -2.9662 -2.9662 -2.9076 -2.9076 -2.8717 -2.8717 0.3333 0.3333 1.9224 1.9224 2.2745 2.2745 2.7356 2.7356 2.7840 2.7840 3.3348 3.3348 5.2909 5.2909 5.7761 5.7761 6.1874 6.1874 6.4918 6.4918 6.7756 6.7756 7.3693 7.3693 k = 0.6449 0.2037-0.7218 ( 8822 PWs) bands (ev): -27.1912 -27.1912 -27.1887 -27.1887 -27.0965 -27.0965 -27.0904 -27.0904 -10.9147 -10.9147 -10.9046 -10.9046 -10.8234 -10.8234 -10.8133 -10.8133 -10.6687 -10.6687 -10.6533 -10.6533 -10.6127 -10.6127 -10.5852 -10.5852 -10.5299 -10.5299 -10.5224 -10.5224 -10.4787 -10.4787 -10.4559 -10.4559 -6.0280 -6.0280 -5.4508 -5.4508 -3.2807 -3.2807 -3.2720 -3.2720 -2.9662 -2.9662 -2.9076 -2.9076 -2.8718 -2.8718 0.3319 0.3319 1.9350 1.9350 2.2622 2.2622 2.7391 2.7391 2.7866 2.7866 3.3325 3.3325 5.3067 5.3067 5.7863 5.7863 6.1920 6.1920 6.4855 6.4855 6.7933 6.7933 7.3468 7.3468 k = 0.6397 0.2020-0.6926 ( 8830 PWs) bands (ev): -27.1913 -27.1913 -27.1887 -27.1887 -27.0966 -27.0966 -27.0902 -27.0902 -10.9149 -10.9149 -10.9040 -10.9040 -10.8239 -10.8239 -10.8111 -10.8111 -10.6690 -10.6690 -10.6527 -10.6527 -10.6128 -10.6128 -10.5854 -10.5854 -10.5306 -10.5306 -10.5220 -10.5220 -10.4787 -10.4787 -10.4561 -10.4561 -6.0289 -6.0289 -5.4537 -5.4537 -3.2806 -3.2806 -3.2721 -3.2721 -2.9662 -2.9662 -2.9076 -2.9076 -2.8720 -2.8720 0.3298 0.3298 1.9493 1.9493 2.2503 2.2503 2.7426 2.7426 2.7902 2.7902 3.3300 3.3300 5.3244 5.3244 5.7991 5.7991 6.1974 6.1974 6.4772 6.4772 6.8144 6.8144 7.3199 7.3199 k = 0.6345 0.2004-0.6633 ( 8830 PWs) bands (ev): -27.1914 -27.1914 -27.1887 -27.1887 -27.0968 -27.0968 -27.0900 -27.0900 -10.9153 -10.9153 -10.9033 -10.9033 -10.8242 -10.8242 -10.8088 -10.8088 -10.6693 -10.6693 -10.6521 -10.6521 -10.6128 -10.6128 -10.5857 -10.5857 -10.5313 -10.5313 -10.5218 -10.5218 -10.4787 -10.4787 -10.4565 -10.4565 -6.0300 -6.0300 -5.4570 -5.4570 -3.2806 -3.2806 -3.2722 -3.2722 -2.9662 -2.9662 -2.9076 -2.9076 -2.8724 -2.8724 0.3271 0.3271 1.9653 1.9653 2.2389 2.2389 2.7455 2.7455 2.7953 2.7953 3.3271 3.3271 5.3438 5.3438 5.8143 5.8143 6.2036 6.2036 6.4676 6.4676 6.8380 6.8380 7.2877 7.2877 k = 0.6293 0.1988-0.6341 ( 8837 PWs) bands (ev): -27.1916 -27.1916 -27.1886 -27.1886 -27.0970 -27.0970 -27.0897 -27.0897 -10.9157 -10.9157 -10.9026 -10.9026 -10.8243 -10.8243 -10.8064 -10.8064 -10.6695 -10.6695 -10.6515 -10.6515 -10.6128 -10.6128 -10.5860 -10.5860 -10.5321 -10.5321 -10.5217 -10.5217 -10.4787 -10.4787 -10.4569 -10.4569 -6.0316 -6.0316 -5.4606 -5.4606 -3.2806 -3.2806 -3.2723 -3.2723 -2.9661 -2.9661 -2.9076 -2.9076 -2.8728 -2.8728 0.3237 0.3237 1.9826 1.9826 2.2284 2.2284 2.7478 2.7478 2.8021 2.8021 3.3240 3.3240 5.3645 5.3645 5.8320 5.8320 6.2106 6.2106 6.4569 6.4569 6.8628 6.8628 7.2496 7.2496 k = 0.6242 0.1971-0.6048 ( 8842 PWs) bands (ev): -27.1917 -27.1917 -27.1886 -27.1886 -27.0972 -27.0972 -27.0894 -27.0894 -10.9161 -10.9161 -10.9018 -10.9018 -10.8242 -10.8242 -10.8038 -10.8038 -10.6697 -10.6697 -10.6509 -10.6509 -10.6128 -10.6128 -10.5865 -10.5865 -10.5328 -10.5328 -10.5216 -10.5216 -10.4785 -10.4785 -10.4573 -10.4573 -6.0334 -6.0334 -5.4645 -5.4645 -3.2806 -3.2806 -3.2724 -3.2724 -2.9661 -2.9661 -2.9076 -2.9076 -2.8734 -2.8734 0.3199 0.3199 2.0008 2.0008 2.2191 2.2191 2.7491 2.7491 2.8107 2.8107 3.3207 3.3207 5.3862 5.3862 5.8518 5.8518 6.2182 6.2182 6.4454 6.4454 6.8876 6.8876 7.2057 7.2057 k = 0.6190 0.1955-0.5756 ( 8843 PWs) bands (ev): -27.1919 -27.1919 -27.1886 -27.1886 -27.0974 -27.0974 -27.0891 -27.0891 -10.9165 -10.9165 -10.9010 -10.9010 -10.8239 -10.8239 -10.8011 -10.8011 -10.6698 -10.6698 -10.6503 -10.6503 -10.6129 -10.6129 -10.5870 -10.5870 -10.5334 -10.5334 -10.5218 -10.5218 -10.4784 -10.4784 -10.4579 -10.4579 -6.0355 -6.0355 -5.4686 -5.4686 -3.2805 -3.2805 -3.2726 -3.2726 -2.9661 -2.9661 -2.9076 -2.9076 -2.8741 -2.8741 0.3155 0.3155 2.0192 2.0192 2.2117 2.2117 2.7496 2.7496 2.8213 2.8213 3.3172 3.3172 5.4084 5.4084 5.8735 5.8735 6.2266 6.2266 6.4330 6.4330 6.9108 6.9108 7.1575 7.1575 k = 0.6138 0.1939-0.5463 ( 8828 PWs) bands (ev): -27.1920 -27.1920 -27.1885 -27.1885 -27.0976 -27.0976 -27.0888 -27.0888 -10.9169 -10.9169 -10.9002 -10.9002 -10.8234 -10.8234 -10.7984 -10.7984 -10.6698 -10.6698 -10.6496 -10.6496 -10.6129 -10.6129 -10.5875 -10.5875 -10.5339 -10.5339 -10.5220 -10.5220 -10.4781 -10.4781 -10.4584 -10.4584 -6.0378 -6.0378 -5.4729 -5.4729 -3.2805 -3.2805 -3.2728 -3.2728 -2.9660 -2.9660 -2.9075 -2.9075 -2.8749 -2.8749 0.3108 0.3108 2.0368 2.0368 2.2071 2.2071 2.7494 2.7494 2.8335 2.8335 3.3136 3.3136 5.4304 5.4304 5.8965 5.8965 6.2356 6.2356 6.4197 6.4197 6.9281 6.9281 7.1096 7.1096 k = 0.6086 0.1922-0.5171 ( 8838 PWs) bands (ev): -27.1922 -27.1922 -27.1885 -27.1885 -27.0978 -27.0978 -27.0885 -27.0885 -10.9172 -10.9172 -10.8995 -10.8995 -10.8227 -10.8227 -10.7955 -10.7955 -10.6699 -10.6699 -10.6490 -10.6490 -10.6129 -10.6129 -10.5882 -10.5882 -10.5344 -10.5344 -10.5223 -10.5223 -10.4779 -10.4779 -10.4591 -10.4591 -6.0404 -6.0404 -5.4774 -5.4774 -3.2804 -3.2804 -3.2730 -3.2730 -2.9660 -2.9660 -2.9075 -2.9075 -2.8757 -2.8757 0.3058 0.3058 2.0521 2.0521 2.2067 2.2067 2.7487 2.7487 2.8474 2.8474 3.3098 3.3098 5.4519 5.4519 5.9199 5.9199 6.2451 6.2451 6.4057 6.4057 6.9294 6.9294 7.0735 7.0735 k = 0.6035 0.1906-0.4878 ( 8837 PWs) bands (ev): -27.1924 -27.1924 -27.1885 -27.1885 -27.0980 -27.0980 -27.0882 -27.0882 -10.9176 -10.9176 -10.8987 -10.8987 -10.8217 -10.8217 -10.7926 -10.7926 -10.6699 -10.6699 -10.6484 -10.6484 -10.6130 -10.6130 -10.5890 -10.5890 -10.5347 -10.5347 -10.5228 -10.5228 -10.4776 -10.4776 -10.4598 -10.4598 -6.0432 -6.0432 -5.4821 -5.4821 -3.2804 -3.2804 -3.2732 -3.2732 -2.9659 -2.9659 -2.9075 -2.9075 -2.8766 -2.8766 0.3005 0.3005 2.0635 2.0635 2.2121 2.2121 2.7476 2.7476 2.8628 2.8628 3.3060 3.3060 5.4719 5.4719 5.9428 5.9428 6.2552 6.2552 6.3913 6.3913 6.9015 6.9015 7.0637 7.0637 k = 0.5983 0.1890-0.4585 ( 8836 PWs) bands (ev): -27.1925 -27.1925 -27.1884 -27.1884 -27.0982 -27.0982 -27.0879 -27.0879 -10.9179 -10.9179 -10.8981 -10.8981 -10.8207 -10.8207 -10.7897 -10.7897 -10.6698 -10.6698 -10.6478 -10.6478 -10.6130 -10.6130 -10.5898 -10.5898 -10.5349 -10.5349 -10.5234 -10.5234 -10.4773 -10.4773 -10.4605 -10.4605 -6.0461 -6.0461 -5.4868 -5.4868 -3.2803 -3.2803 -3.2734 -3.2734 -2.9659 -2.9659 -2.9075 -2.9075 -2.8776 -2.8776 0.2951 0.2951 2.0699 2.0699 2.2243 2.2243 2.7461 2.7461 2.8795 2.8795 3.3021 3.3021 5.4897 5.4897 5.9634 5.9634 6.2657 6.2657 6.3772 6.3772 6.8520 6.8520 7.0747 7.0747 k = 0.5931 0.1873-0.4293 ( 8832 PWs) bands (ev): -27.1927 -27.1927 -27.1884 -27.1884 -27.0983 -27.0983 -27.0876 -27.0876 -10.9181 -10.9181 -10.8975 -10.8975 -10.8194 -10.8194 -10.7868 -10.7868 -10.6698 -10.6698 -10.6471 -10.6471 -10.6131 -10.6131 -10.5907 -10.5907 -10.5349 -10.5349 -10.5241 -10.5241 -10.4770 -10.4770 -10.4613 -10.4613 -6.0492 -6.0492 -5.4917 -5.4917 -3.2803 -3.2803 -3.2737 -3.2737 -2.9658 -2.9658 -2.9075 -2.9075 -2.8786 -2.8786 0.2895 0.2895 2.0713 2.0713 2.2430 2.2430 2.7445 2.7445 2.8975 2.8975 3.2983 3.2983 5.5043 5.5043 5.9793 5.9793 6.2766 6.2766 6.3648 6.3648 6.7963 6.7963 7.0936 7.0936 k = 0.5879 0.1857-0.4000 ( 8834 PWs) bands (ev): -27.1929 -27.1929 -27.1884 -27.1884 -27.0985 -27.0985 -27.0873 -27.0873 -10.9184 -10.9184 -10.8969 -10.8969 -10.8181 -10.8181 -10.7838 -10.7838 -10.6697 -10.6697 -10.6465 -10.6465 -10.6132 -10.6132 -10.5918 -10.5918 -10.5348 -10.5348 -10.5249 -10.5249 -10.4768 -10.4768 -10.4621 -10.4621 -6.0524 -6.0524 -5.4966 -5.4966 -3.2803 -3.2803 -3.2739 -3.2739 -2.9658 -2.9658 -2.9075 -2.9075 -2.8797 -2.8797 0.2840 0.2840 2.0690 2.0690 2.2670 2.2670 2.7428 2.7428 2.9166 2.9166 3.2946 3.2946 5.5148 5.5148 5.9878 5.9878 6.2876 6.2876 6.3557 6.3557 6.7430 6.7430 7.1144 7.1144 k = 0.5828 0.1841-0.3708 ( 8834 PWs) bands (ev): -27.1930 -27.1930 -27.1884 -27.1884 -27.0987 -27.0987 -27.0870 -27.0870 -10.9186 -10.9186 -10.8964 -10.8964 -10.8166 -10.8166 -10.7809 -10.7809 -10.6695 -10.6695 -10.6459 -10.6459 -10.6132 -10.6132 -10.5929 -10.5929 -10.5345 -10.5345 -10.5257 -10.5257 -10.4767 -10.4767 -10.4628 -10.4628 -6.0556 -6.0556 -5.5015 -5.5015 -3.2802 -3.2802 -3.2742 -3.2742 -2.9657 -2.9657 -2.9074 -2.9074 -2.8807 -2.8807 0.2784 0.2784 2.0643 2.0643 2.2947 2.2947 2.7410 2.7410 2.9366 2.9366 3.2911 3.2911 5.5200 5.5200 5.9859 5.9859 6.2985 6.2985 6.3513 6.3513 6.6975 6.6975 7.1350 7.1350 k = 0.5776 0.1824-0.3415 ( 8828 PWs) bands (ev): -27.1932 -27.1932 -27.1884 -27.1884 -27.0988 -27.0988 -27.0868 -27.0868 -10.9187 -10.9187 -10.8960 -10.8960 -10.8151 -10.8151 -10.7780 -10.7780 -10.6694 -10.6694 -10.6453 -10.6453 -10.6134 -10.6134 -10.5940 -10.5940 -10.5341 -10.5341 -10.5265 -10.5265 -10.4767 -10.4767 -10.4634 -10.4634 -6.0589 -6.0589 -5.5063 -5.5063 -3.2802 -3.2802 -3.2744 -3.2744 -2.9657 -2.9657 -2.9074 -2.9074 -2.8818 -2.8818 0.2730 0.2730 2.0582 2.0582 2.3249 2.3249 2.7392 2.7392 2.9575 2.9575 3.2877 3.2877 5.5191 5.5191 5.9718 5.9718 6.3090 6.3090 6.3519 6.3519 6.6643 6.6643 7.1545 7.1545 k = 0.5724 0.1808-0.3123 ( 8833 PWs) bands (ev): -27.1934 -27.1934 -27.1884 -27.1884 -27.0990 -27.0990 -27.0865 -27.0865 -10.9189 -10.9189 -10.8956 -10.8956 -10.8134 -10.8134 -10.7753 -10.7753 -10.6692 -10.6692 -10.6447 -10.6447 -10.6135 -10.6135 -10.5952 -10.5952 -10.5336 -10.5336 -10.5272 -10.5272 -10.4769 -10.4769 -10.4640 -10.4640 -6.0622 -6.0622 -5.5111 -5.5111 -3.2801 -3.2801 -3.2747 -3.2747 -2.9656 -2.9656 -2.9074 -2.9074 -2.8829 -2.8829 0.2676 0.2676 2.0513 2.0513 2.3567 2.3567 2.7376 2.7376 2.9790 2.9790 3.2847 3.2847 5.5114 5.5114 5.9457 5.9457 6.3187 6.3187 6.3557 6.3557 6.6472 6.6472 7.1723 7.1723 k = 0.5673 0.1792-0.2830 ( 8837 PWs) bands (ev): -27.1935 -27.1935 -27.1884 -27.1884 -27.0991 -27.0991 -27.0863 -27.0863 -10.9190 -10.9190 -10.8953 -10.8953 -10.8118 -10.8118 -10.7725 -10.7725 -10.6690 -10.6690 -10.6442 -10.6442 -10.6137 -10.6137 -10.5964 -10.5964 -10.5332 -10.5332 -10.5276 -10.5276 -10.4773 -10.4773 -10.4644 -10.4644 -6.0655 -6.0655 -5.5157 -5.5157 -3.2801 -3.2801 -3.2750 -3.2750 -2.9656 -2.9656 -2.9074 -2.9074 -2.8839 -2.8839 0.2625 0.2625 2.0441 2.0441 2.3895 2.3895 2.7362 2.7362 3.0008 3.0008 3.2821 3.2821 5.4966 5.4966 5.9093 5.9093 6.3273 6.3273 6.3610 6.3610 6.6480 6.6480 7.1885 7.1885 k = 0.5621 0.1775-0.2538 ( 8835 PWs) bands (ev): -27.1937 -27.1937 -27.1884 -27.1884 -27.0992 -27.0992 -27.0860 -27.0860 -10.9191 -10.9191 -10.8950 -10.8950 -10.8101 -10.8101 -10.7700 -10.7700 -10.6688 -10.6688 -10.6437 -10.6437 -10.6139 -10.6139 -10.5976 -10.5976 -10.5331 -10.5331 -10.5277 -10.5277 -10.4781 -10.4781 -10.4646 -10.4646 -6.0687 -6.0687 -5.5202 -5.5202 -3.2801 -3.2801 -3.2752 -3.2752 -2.9655 -2.9655 -2.9074 -2.9074 -2.8849 -2.8849 0.2575 0.2575 2.0369 2.0369 2.4226 2.4226 2.7351 2.7351 3.0227 3.0227 3.2800 3.2800 5.4749 5.4749 5.8653 5.8653 6.3344 6.3344 6.3675 6.3675 6.6657 6.6657 7.2029 7.2029 k = 0.5569 0.1759-0.2245 ( 8846 PWs) bands (ev): -27.1938 -27.1938 -27.1884 -27.1884 -27.0993 -27.0993 -27.0858 -27.0858 -10.9192 -10.9192 -10.8947 -10.8947 -10.8085 -10.8085 -10.7675 -10.7675 -10.6686 -10.6686 -10.6432 -10.6432 -10.6141 -10.6141 -10.5989 -10.5989 -10.5334 -10.5334 -10.5272 -10.5272 -10.4790 -10.4790 -10.4647 -10.4647 -6.0717 -6.0717 -5.5244 -5.5244 -3.2800 -3.2800 -3.2755 -3.2755 -2.9655 -2.9655 -2.9074 -2.9074 -2.8859 -2.8859 0.2529 0.2529 2.0299 2.0299 2.4555 2.4555 2.7344 2.7344 3.0443 3.0443 3.2785 3.2785 5.4471 5.4471 5.8163 5.8163 6.3404 6.3404 6.3753 6.3753 6.6973 6.6973 7.2157 7.2157 k = 0.5517 0.1743-0.1953 ( 8845 PWs) bands (ev): -27.1939 -27.1939 -27.1884 -27.1884 -27.0994 -27.0994 -27.0856 -27.0856 -10.9192 -10.9192 -10.8945 -10.8945 -10.8069 -10.8069 -10.7652 -10.7652 -10.6683 -10.6683 -10.6427 -10.6427 -10.6144 -10.6144 -10.6000 -10.6000 -10.5339 -10.5339 -10.5261 -10.5261 -10.4803 -10.4803 -10.4646 -10.4646 -6.0747 -6.0747 -5.5285 -5.5285 -3.2800 -3.2800 -3.2758 -3.2758 -2.9654 -2.9654 -2.9073 -2.9073 -2.8869 -2.8869 0.2485 0.2485 2.0232 2.0232 2.4875 2.4875 2.7342 2.7342 3.0652 3.0652 3.2778 3.2778 5.4145 5.4145 5.7647 5.7647 6.3463 6.3463 6.3844 6.3844 6.7391 6.7391 7.2270 7.2270 k = 0.5466 0.1726-0.1660 ( 8841 PWs) bands (ev): -27.1940 -27.1940 -27.1884 -27.1884 -27.0995 -27.0995 -27.0854 -27.0854 -10.9192 -10.9192 -10.8944 -10.8944 -10.8053 -10.8053 -10.7631 -10.7631 -10.6681 -10.6681 -10.6423 -10.6423 -10.6146 -10.6146 -10.6011 -10.6011 -10.5347 -10.5347 -10.5247 -10.5247 -10.4817 -10.4817 -10.4644 -10.4644 -6.0774 -6.0774 -5.5323 -5.5323 -3.2800 -3.2800 -3.2760 -3.2760 -2.9654 -2.9654 -2.9073 -2.9073 -2.8877 -2.8877 0.2445 0.2445 2.0168 2.0168 2.5180 2.5180 2.7348 2.7348 3.0850 3.0850 3.2781 3.2781 5.3786 5.3786 5.7127 5.7127 6.3530 6.3530 6.3941 6.3941 6.7881 6.7881 7.2370 7.2370 k = 0.5414 0.1710-0.1368 ( 8833 PWs) bands (ev): -27.1941 -27.1941 -27.1884 -27.1884 -27.0996 -27.0996 -27.0852 -27.0852 -10.9192 -10.9192 -10.8942 -10.8942 -10.8038 -10.8038 -10.7611 -10.7611 -10.6678 -10.6678 -10.6420 -10.6420 -10.6149 -10.6149 -10.6021 -10.6021 -10.5355 -10.5355 -10.5231 -10.5231 -10.4833 -10.4833 -10.4642 -10.4642 -6.0800 -6.0800 -5.5357 -5.5357 -3.2799 -3.2799 -3.2762 -3.2762 -2.9653 -2.9653 -2.9073 -2.9073 -2.8885 -2.8885 0.2408 0.2408 2.0110 2.0110 2.5463 2.5463 2.7363 2.7363 3.1032 3.1032 3.2793 3.2793 5.3411 5.3411 5.6620 5.6620 6.3606 6.3606 6.4040 6.4040 6.8422 6.8422 7.2457 7.2457 k = 0.5362 0.1694-0.1075 ( 8840 PWs) bands (ev): -27.1942 -27.1942 -27.1884 -27.1884 -27.0997 -27.0997 -27.0851 -27.0851 -10.9192 -10.9192 -10.8941 -10.8941 -10.8025 -10.8025 -10.7594 -10.7594 -10.6675 -10.6675 -10.6417 -10.6417 -10.6151 -10.6151 -10.6030 -10.6030 -10.5363 -10.5363 -10.5214 -10.5214 -10.4850 -10.4850 -10.4640 -10.4640 -6.0823 -6.0823 -5.5388 -5.5388 -3.2799 -3.2799 -3.2764 -3.2764 -2.9653 -2.9653 -2.9073 -2.9073 -2.8893 -2.8893 0.2375 0.2375 2.0057 2.0057 2.5718 2.5718 2.7390 2.7390 3.1193 3.1193 3.2818 3.2818 5.3036 5.3036 5.6141 5.6141 6.3689 6.3689 6.4137 6.4137 6.8997 6.8997 7.2532 7.2532 k = 0.5310 0.1677-0.0783 ( 8840 PWs) bands (ev): -27.1943 -27.1943 -27.1884 -27.1884 -27.0997 -27.0997 -27.0849 -27.0849 -10.9192 -10.9192 -10.8940 -10.8940 -10.8013 -10.8013 -10.7579 -10.7579 -10.6673 -10.6673 -10.6414 -10.6414 -10.6154 -10.6154 -10.6038 -10.6038 -10.5370 -10.5370 -10.5196 -10.5196 -10.4868 -10.4868 -10.4638 -10.4638 -6.0844 -6.0844 -5.5416 -5.5416 -3.2799 -3.2799 -3.2766 -3.2766 -2.9653 -2.9653 -2.9073 -2.9073 -2.8899 -2.8899 0.2346 0.2346 2.0011 2.0011 2.5936 2.5936 2.7429 2.7429 3.1330 3.1330 3.2853 3.2853 5.2677 5.2677 5.5700 5.5700 6.3773 6.3773 6.4230 6.4230 6.9590 6.9590 7.2596 7.2596 k = 0.5259 0.1661-0.0490 ( 8842 PWs) bands (ev): -27.1944 -27.1944 -27.1885 -27.1885 -27.0998 -27.0998 -27.0848 -27.0848 -10.9192 -10.9192 -10.8939 -10.8939 -10.8002 -10.8002 -10.7566 -10.7566 -10.6670 -10.6670 -10.6413 -10.6413 -10.6156 -10.6156 -10.6045 -10.6045 -10.5376 -10.5376 -10.5177 -10.5177 -10.4886 -10.4886 -10.4635 -10.4635 -6.0862 -6.0862 -5.5440 -5.5440 -3.2799 -3.2799 -3.2767 -3.2767 -2.9653 -2.9653 -2.9073 -2.9073 -2.8905 -2.8905 0.2321 0.2321 1.9971 1.9971 2.6115 2.6115 2.7481 2.7481 3.1442 3.1442 3.2896 3.2896 5.2348 5.2348 5.5310 5.5310 6.3853 6.3853 6.4314 6.4314 7.0187 7.0187 7.2650 7.2650 k = 0.5207 0.1645-0.0198 ( 8842 PWs) bands (ev): -27.1944 -27.1944 -27.1885 -27.1885 -27.0998 -27.0998 -27.0847 -27.0847 -10.9192 -10.9192 -10.8939 -10.8939 -10.7993 -10.7993 -10.7556 -10.7556 -10.6668 -10.6668 -10.6412 -10.6412 -10.6158 -10.6158 -10.6051 -10.6051 -10.5382 -10.5382 -10.5158 -10.5158 -10.4904 -10.4904 -10.4633 -10.4633 -6.0877 -6.0877 -5.5460 -5.5460 -3.2799 -3.2799 -3.2768 -3.2768 -2.9652 -2.9652 -2.9073 -2.9073 -2.8909 -2.8909 0.2301 0.2301 1.9938 1.9938 2.6251 2.6251 2.7541 2.7541 3.1528 3.1528 3.2944 3.2944 5.2062 5.2062 5.4977 5.4977 6.3924 6.3924 6.4389 6.4389 7.0771 7.0771 7.2693 7.2693 k = 0.5155 0.1628 0.0095 ( 8841 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0847 -27.0847 -10.9192 -10.9192 -10.8938 -10.8938 -10.7986 -10.7986 -10.7547 -10.7547 -10.6666 -10.6666 -10.6411 -10.6411 -10.6159 -10.6159 -10.6055 -10.6055 -10.5387 -10.5387 -10.5141 -10.5141 -10.4920 -10.4920 -10.4631 -10.4631 -6.0889 -6.0889 -5.5475 -5.5475 -3.2798 -3.2798 -3.2769 -3.2769 -2.9652 -2.9652 -2.9073 -2.9073 -2.8913 -2.8913 0.2284 0.2284 1.9911 1.9911 2.6349 2.6349 2.7602 2.7602 3.1590 3.1590 3.2990 3.2990 5.1827 5.1827 5.4711 5.4711 6.3982 6.3982 6.4450 6.4450 7.1319 7.1319 7.2726 7.2726 k = 0.5103 0.1612 0.0387 ( 8834 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7980 -10.7980 -10.7541 -10.7541 -10.6664 -10.6664 -10.6410 -10.6410 -10.6160 -10.6160 -10.6058 -10.6058 -10.5390 -10.5390 -10.5126 -10.5126 -10.4934 -10.4934 -10.4630 -10.4630 -6.0897 -6.0897 -5.5487 -5.5487 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8916 -2.8916 0.2273 0.2273 1.9893 1.9893 2.6413 2.6413 2.7655 2.7655 3.1632 3.1632 3.3028 3.3028 5.1654 5.1654 5.4517 5.4517 6.4025 6.4025 6.4496 6.4496 7.1791 7.1791 7.2750 7.2750 k = 0.5052 0.1596 0.0680 ( 8817 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7977 -10.7977 -10.7537 -10.7537 -10.6663 -10.6663 -10.6410 -10.6410 -10.6161 -10.6161 -10.6060 -10.6060 -10.5392 -10.5392 -10.5116 -10.5116 -10.4944 -10.4944 -10.4629 -10.4629 -6.0902 -6.0902 -5.5493 -5.5493 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8917 -2.8917 0.2266 0.2266 1.9881 1.9881 2.6449 2.6449 2.7691 2.7691 3.1656 3.1656 3.3053 3.3053 5.1547 5.1547 5.4398 5.4398 6.4051 6.4051 6.4525 6.4525 7.2127 7.2127 7.2764 7.2764 k = 0.5000 0.1579 0.0972 ( 8814 PWs) bands (ev): -27.1945 -27.1945 -27.1885 -27.1885 -27.0999 -27.0999 -27.0846 -27.0846 -10.9191 -10.9191 -10.8938 -10.8938 -10.7976 -10.7976 -10.7536 -10.7536 -10.6663 -10.6663 -10.6410 -10.6410 -10.6161 -10.6161 -10.6061 -10.6061 -10.5393 -10.5393 -10.5113 -10.5113 -10.4948 -10.4948 -10.4629 -10.4629 -6.0904 -6.0904 -5.5496 -5.5496 -3.2798 -3.2798 -3.2770 -3.2770 -2.9652 -2.9652 -2.9073 -2.9073 -2.8918 -2.8918 0.2264 0.2264 1.9878 1.9878 2.6460 2.6460 2.7704 2.7704 3.1664 3.1664 3.3062 3.3062 5.1511 5.1511 5.4358 5.4358 6.4060 6.4060 6.4535 6.4535 7.2252 7.2252 7.2769 7.2769 k = 0.5000-0.7126-0.4388 ( 8826 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8187 -10.8187 -10.8169 -10.8169 -10.6694 -10.6694 -10.6537 -10.6537 -10.6059 -10.6059 -10.5965 -10.5965 -10.5246 -10.5246 -10.5209 -10.5209 -10.4785 -10.4785 -10.4577 -10.4577 -6.0383 -6.0383 -5.4275 -5.4275 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8767 -2.8767 0.2965 0.2965 1.8790 1.8790 2.4584 2.4584 2.7508 2.7508 2.7770 2.7770 3.3117 3.3117 5.0682 5.0682 5.6634 5.6634 6.3851 6.3851 6.5446 6.5446 6.7312 6.7312 7.2239 7.2239 k = 0.5259-0.6994-0.4307 ( 8832 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0909 -27.0909 -10.9160 -10.9160 -10.9067 -10.9067 -10.8188 -10.8188 -10.8168 -10.8168 -10.6694 -10.6694 -10.6537 -10.6537 -10.6060 -10.6060 -10.5963 -10.5963 -10.5246 -10.5246 -10.5209 -10.5209 -10.4785 -10.4785 -10.4576 -10.4576 -6.0382 -6.0382 -5.4277 -5.4277 -3.2806 -3.2806 -3.2733 -3.2733 -2.9662 -2.9662 -2.9077 -2.9077 -2.8767 -2.8767 0.2968 0.2968 1.8801 1.8801 2.4534 2.4534 2.7522 2.7522 2.7783 2.7783 3.3119 3.3119 5.0686 5.0686 5.6683 5.6683 6.3826 6.3826 6.5279 6.5279 6.7465 6.7465 7.2265 7.2265 k = 0.5517-0.6862-0.4226 ( 8829 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9159 -10.9159 -10.9067 -10.9067 -10.8189 -10.8189 -10.8168 -10.8168 -10.6693 -10.6693 -10.6537 -10.6537 -10.6063 -10.6063 -10.5958 -10.5958 -10.5247 -10.5247 -10.5210 -10.5210 -10.4785 -10.4785 -10.4576 -10.4576 -6.0378 -6.0378 -5.4282 -5.4282 -3.2806 -3.2806 -3.2732 -3.2732 -2.9662 -2.9662 -2.9077 -2.9077 -2.8765 -2.8765 0.2980 0.2980 1.8831 1.8831 2.4391 2.4391 2.7550 2.7550 2.7824 2.7824 3.3127 3.3127 5.0699 5.0699 5.6825 5.6825 6.3751 6.3751 6.4896 6.4896 6.7800 6.7800 7.2352 7.2352 k = 0.5776-0.6731-0.4145 ( 8825 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9158 -10.9158 -10.9067 -10.9067 -10.8191 -10.8191 -10.8168 -10.8168 -10.6692 -10.6692 -10.6538 -10.6538 -10.6068 -10.6068 -10.5951 -10.5951 -10.5248 -10.5248 -10.5212 -10.5212 -10.4785 -10.4785 -10.4574 -10.4574 -6.0372 -6.0372 -5.4292 -5.4292 -3.2806 -3.2806 -3.2732 -3.2732 -2.9662 -2.9662 -2.9077 -2.9077 -2.8762 -2.8762 0.2998 0.2998 1.8881 1.8881 2.4179 2.4179 2.7574 2.7574 2.7893 2.7893 3.3140 3.3140 5.0729 5.0729 5.7048 5.7048 6.3630 6.3630 6.4448 6.4448 6.8155 6.8155 7.2515 7.2515 k = 0.6035-0.6599-0.4064 ( 8824 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0909 -27.0909 -10.9157 -10.9157 -10.9066 -10.9066 -10.8194 -10.8194 -10.8168 -10.8168 -10.6691 -10.6691 -10.6540 -10.6540 -10.6074 -10.6074 -10.5941 -10.5941 -10.5250 -10.5250 -10.5214 -10.5214 -10.4786 -10.4786 -10.4573 -10.4573 -6.0364 -6.0364 -5.4305 -5.4305 -3.2806 -3.2806 -3.2731 -3.2731 -2.9662 -2.9662 -2.9077 -2.9077 -2.8758 -2.8758 0.3023 0.3023 1.8945 1.8945 2.3925 2.3925 2.7584 2.7584 2.7977 2.7977 3.3157 3.3157 5.0784 5.0784 5.7329 5.7329 6.3466 6.3466 6.4013 6.4013 6.8441 6.8441 7.2777 7.2777 k = 0.6293-0.6468-0.3983 ( 8817 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0908 -27.0908 -10.9155 -10.9155 -10.9065 -10.9065 -10.8197 -10.8197 -10.8168 -10.8168 -10.6690 -10.6690 -10.6541 -10.6541 -10.6081 -10.6081 -10.5931 -10.5931 -10.5252 -10.5252 -10.5216 -10.5216 -10.4786 -10.4786 -10.4571 -10.4571 -6.0355 -6.0355 -5.4321 -5.4321 -3.2806 -3.2806 -3.2729 -3.2729 -2.9662 -2.9662 -2.9077 -2.9077 -2.8754 -2.8754 0.3054 0.3054 1.9020 1.9020 2.3652 2.3652 2.7585 2.7585 2.8054 2.8054 3.3177 3.3177 5.0874 5.0874 5.7640 5.7640 6.3265 6.3265 6.3638 6.3638 6.8618 6.8618 7.3145 7.3145 k = 0.6552-0.6336-0.3902 ( 8813 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0961 -27.0961 -27.0908 -27.0908 -10.9153 -10.9153 -10.9064 -10.9064 -10.8200 -10.8200 -10.8168 -10.8168 -10.6688 -10.6688 -10.6542 -10.6542 -10.6088 -10.6088 -10.5919 -10.5919 -10.5255 -10.5255 -10.5219 -10.5219 -10.4786 -10.4786 -10.4569 -10.4569 -6.0344 -6.0344 -5.4339 -5.4339 -3.2806 -3.2806 -3.2728 -3.2728 -2.9662 -2.9662 -2.9077 -2.9077 -2.8749 -2.8749 0.3090 0.3090 1.9097 1.9097 2.3385 2.3385 2.7578 2.7578 2.8109 2.8109 3.3201 3.3201 5.1006 5.1006 5.7940 5.7940 6.3050 6.3050 6.3349 6.3349 6.8677 6.8677 7.3601 7.3601 k = 0.6811-0.6204-0.3821 ( 8815 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9151 -10.9151 -10.9063 -10.9063 -10.8203 -10.8203 -10.8168 -10.8168 -10.6687 -10.6687 -10.6543 -10.6543 -10.6095 -10.6095 -10.5907 -10.5907 -10.5259 -10.5259 -10.5222 -10.5222 -10.4786 -10.4786 -10.4567 -10.4567 -6.0331 -6.0331 -5.4359 -5.4359 -3.2807 -3.2807 -3.2727 -3.2727 -2.9662 -2.9662 -2.9077 -2.9077 -2.8743 -2.8743 0.3130 0.3130 1.9169 1.9169 2.3143 2.3143 2.7565 2.7565 2.8132 2.8132 3.3227 3.3227 5.1185 5.1185 5.8181 5.8181 6.2852 6.2852 6.3166 6.3166 6.8634 6.8634 7.4100 7.4100 k = 0.7069-0.6073-0.3740 ( 8818 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9149 -10.9149 -10.9062 -10.9062 -10.8206 -10.8206 -10.8169 -10.8169 -10.6685 -10.6685 -10.6544 -10.6544 -10.6101 -10.6101 -10.5895 -10.5895 -10.5263 -10.5263 -10.5224 -10.5224 -10.4786 -10.4786 -10.4564 -10.4564 -6.0319 -6.0319 -5.4380 -5.4380 -3.2807 -3.2807 -3.2725 -3.2725 -2.9662 -2.9662 -2.9077 -2.9077 -2.8737 -2.8737 0.3173 0.3173 1.9224 1.9224 2.2946 2.2946 2.7546 2.7546 2.8119 2.8119 3.3255 3.3255 5.1414 5.1414 5.8315 5.8315 6.2657 6.2657 6.3154 6.3154 6.8511 6.8511 7.4558 7.4558 k = 0.7328-0.5941-0.3659 ( 8825 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9147 -10.9147 -10.9061 -10.9061 -10.8209 -10.8209 -10.8170 -10.8170 -10.6684 -10.6684 -10.6545 -10.6545 -10.6108 -10.6108 -10.5883 -10.5883 -10.5268 -10.5268 -10.5226 -10.5226 -10.4786 -10.4786 -10.4562 -10.4562 -6.0306 -6.0306 -5.4401 -5.4401 -3.2807 -3.2807 -3.2724 -3.2724 -2.9663 -2.9663 -2.9077 -2.9077 -2.8732 -2.8732 0.3216 0.3216 1.9251 1.9251 2.2812 2.2812 2.7519 2.7519 2.8072 2.8072 3.3284 3.3284 5.1691 5.1691 5.8315 5.8315 6.2445 6.2445 6.3359 6.3359 6.8331 6.8331 7.4837 7.4837 k = 0.7587-0.5810-0.3577 ( 8828 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9146 -10.9146 -10.9059 -10.9059 -10.8212 -10.8212 -10.8170 -10.8170 -10.6683 -10.6683 -10.6545 -10.6545 -10.6115 -10.6115 -10.5871 -10.5871 -10.5274 -10.5274 -10.5228 -10.5228 -10.4786 -10.4786 -10.4560 -10.4560 -6.0294 -6.0294 -5.4422 -5.4422 -3.2807 -3.2807 -3.2722 -3.2722 -2.9663 -2.9663 -2.9076 -2.9076 -2.8726 -2.8726 0.3260 0.3260 1.9242 1.9242 2.2754 2.2754 2.7479 2.7479 2.7997 2.7997 3.3313 3.3313 5.2014 5.2014 5.8190 5.8190 6.2231 6.2231 6.3757 6.3757 6.8114 6.8114 7.4793 7.4793 k = 0.7845-0.5678-0.3496 ( 8822 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9145 -10.9145 -10.9057 -10.9057 -10.8215 -10.8215 -10.8170 -10.8170 -10.6681 -10.6681 -10.6545 -10.6545 -10.6121 -10.6121 -10.5860 -10.5860 -10.5280 -10.5280 -10.5230 -10.5230 -10.4786 -10.4786 -10.4557 -10.4557 -6.0283 -6.0283 -5.4441 -5.4441 -3.2807 -3.2807 -3.2721 -3.2721 -2.9663 -2.9663 -2.9076 -2.9076 -2.8721 -2.8721 0.3302 0.3302 1.9196 1.9196 2.2776 2.2776 2.7418 2.7418 2.7907 2.7907 3.3341 3.3341 5.2377 5.2377 5.7969 5.7969 6.2025 6.2025 6.4302 6.4302 6.7875 6.7875 7.4433 7.4433 k = 0.8104-0.5546-0.3415 ( 8821 PWs) bands (ev): -27.1910 -27.1910 -27.1888 -27.1888 -27.0962 -27.0962 -27.0908 -27.0908 -10.9144 -10.9144 -10.9055 -10.9055 -10.8219 -10.8219 -10.8170 -10.8170 -10.6680 -10.6680 -10.6544 -10.6544 -10.6126 -10.6126 -10.5850 -10.5850 -10.5287 -10.5287 -10.5231 -10.5231 -10.4785 -10.4785 -10.4556 -10.4556 -6.0274 -6.0274 -5.4459 -5.4459 -3.2807 -3.2807 -3.2720 -3.2720 -2.9663 -2.9663 -2.9076 -2.9076 -2.8717 -2.8717 0.3340 0.3340 1.9119 1.9119 2.2871 2.2871 2.7323 2.7323 2.7820 2.7820 3.3368 3.3368 5.2773 5.2773 5.7683 5.7683 6.1836 6.1836 6.4951 6.4951 6.7628 6.7628 7.3884 7.3884 Writing output data file K4ZnAs2.save init_run : 0.84s CPU 1.07s WALL ( 1 calls) electrons : 457.32s CPU 460.45s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.08s CPU 0.15s WALL ( 1 calls) Called by electrons: c_bands : 457.32s CPU 460.44s 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 0.21s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.11s WALL ( 219 calls) cegterg : 411.40s CPU 413.80s WALL ( 356 calls) Called by sum_band: Called by *egterg: h_psi : 338.29s CPU 340.03s WALL ( 5886 calls) s_psi : 9.68s CPU 9.79s WALL ( 5886 calls) g_psi : 0.48s CPU 0.47s WALL ( 5311 calls) cdiaghg : 68.64s CPU 69.30s WALL ( 5530 calls) cegterg:over : 12.88s CPU 13.03s WALL ( 5311 calls) cegterg:upda : 12.06s CPU 12.16s WALL ( 5311 calls) cegterg:last : 5.70s CPU 5.70s WALL ( 794 calls) cdiaghg:chol : 4.12s CPU 4.08s WALL ( 5530 calls) cdiaghg:inve : 2.95s CPU 2.94s WALL ( 5530 calls) cdiaghg:para : 5.02s CPU 4.98s WALL ( 11060 calls) Called by h_psi: h_psi:vloc : 316.88s CPU 318.38s WALL ( 5886 calls) h_psi:vnl : 20.86s CPU 21.13s WALL ( 5886 calls) add_vuspsi : 10.81s CPU 10.92s WALL ( 5886 calls) General routines calbec : 10.02s CPU 10.20s WALL ( 5886 calls) fft : 0.01s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 295.02s CPU 296.39s WALL ( 747156 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.28s CPU 0.35s WALL ( 438 calls) Parallel routines fft_scatter : 61.98s CPU 62.44s WALL ( 747179 calls) PWSCF : 8m 1.36s CPU 8m24.21s WALL This run was terminated on: 19:31:43 27Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=