/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | hyb_mgga_x_pjs18.c | 3718 double t6841, t6842, t6843, t6851, t6854, t6863, t6868, t6873; in func_pol() local 6734 t6854 = t6760 * t187; in func_pol() 6737 …t6873 = -0.9e1 / 0.4e1 * t4433 * t6851 + t488 * t6854 / 0.2e1 + 0.3e1 / 0.2e1 * t6432 * t710 - 0.9… in func_pol() 9552 t19664 = t6854 * t456; in func_pol() 9599 …49 + 0.24e2 * t19851 - 0.18e2 * t19854 + 0.2e1 * t1397 * t19740 - t1846 * t6854 / 0.2e1 + 0.21e2 /… in func_pol() 9617 …736 + 0.432e3 * t1507 * t19738 - 0.9e1 / 0.4e1 * t14448 * t6851 + t1497 * t6854 / 0.2e1 + t516 * t… in func_pol() 9733 …t6854 + t516 * t21285 / 0.2e1 + 0.3e1 / 0.2e1 * t18239 * t2356 + 0.3e1 * t6527 * t2359 - t14352 * … in func_pol() 10685 t29254 = t6854 * t913; in func_pol() 10689 … t4506 * t29234 + t2867 * t6854 / 0.2e1 - 0.2e1 * t532 * t185 * t29198 + 0.3e1 / 0.2e1 * t9274 * t… in func_pol() 10744 t29834 = t2768 * t6854; in func_pol() [all …]
|
H A D | mgga_x_revtm.c | 207 double t6830, t6838, t6847, t6854, t6857, t6858, t6881, t6904; in func_unpol() local 1822 t6854 = t2747 * t364; in func_unpol() 1825 …0.12e2 * t2717 * t392 - 0.1296e4 * t4456 * t2731 + 0.108e3 * t545 * t6847 + 0.324e3 * t545 * t6854; in func_unpol() 1861 …295 * t6940 + 0.1296e4 * t3615 * t2731 - 0.9720e4 * t3724 * t6819 - 0.324e3 * t381 * t6854 - t6982; in func_unpol() 4850 double t6842, t6847, t6852, t6853, t6854, t6855, t6856, t6857; in func_pol() local 7870 t6854 = 0.146e3 / 0.135e3 * t6853; in func_pol() 7875 …1 - 0.292e3 / 0.135e3 * t6847 * t201 + 0.292e3 / 0.135e3 * t2123 * t540 - t6854 + t6856 - 0.146e3 … in func_pol() 9978 …t18885 = 0.584e3 / 0.405e3 * t446 * t6842 + 0.1168e4 / 0.405e3 * t1462 * t2120 - t6854 + t6856 + t… in func_pol() 10771 …t23176 = -0.146e3 / 0.135e3 * t6474 * t661 * t201 + 0.584e3 / 0.405e3 * t6474 * t691 - t6854 + t68… in func_pol()
|
H A D | mgga_x_m11.c | 3140 double t6849, t6851, t6852, t6853, t6854, t6855, t6856, t6857; in func_pol() local 5925 t6854 = 0.1e1 / t6853; in func_pol() 5927 t6856 = t6854 * t6855; in func_pol() 6204 t7828 = t6854 * t7827; in func_pol() 6533 t9094 = t6854 * t9093; in func_pol() 6824 t9949 = t6854 * t6887; in func_pol() 8532 …74 - 0.23472031702484377382e0 * t79 * t7153 - 0.24696498175413003768e-4 * t6854 * t6859 * t7829 - … in func_pol()
|
H A D | hyb_mgga_x_js18.c | 8739 double t6839, t6840, t6843, t6846, t6849, t6850, t6852, t6854; in func_pol() local 12632 t6854 = t262 * t6849; in func_pol() 12633 t6856 = 0.2e1 * t6843 + 0.2e1 * t6850 + 0.18e2 * t6852 + 0.9e1 * t6854; in func_pol() 12641 …t6886 = 0.12e2 * t1101 * t6852 + 0.6e1 * t1101 * t6854 + 0.12e2 * t1754 * t5720 - 0.54e2 * t3817 *… in func_pol() 17462 …4635 * t3817 - 0.162e3 * t24638 * t3817 + 0.36e2 * t5720 * t6852 + 0.18e2 * t5720 * t6854 - t24623; in func_pol() 17484 t24755 = t1764 * t6854; in func_pol() 22797 …389 + 0.6e1 * t1101 * t66395 + 0.12e2 * t12309 * t6852 + 0.6e1 * t12309 * t6854 + 0.12e2 * t5720 *… in func_pol() 24300 t78220 = t1191 * t6854 * t1122; in func_pol() 24964 …94 + 0.12e2 * t1101 * t82297 + 0.12e2 * t76258 * t1527 + 0.6e1 * t19644 * t6854 + 0.2592e4 * t2128… in func_pol() 25249 t83822 = t1191 * t6854 * t1540; in func_pol() [all …]
|
H A D | mgga_x_tm.c | 2204 double t6792, t6807, t6823, t6838, t6841, t6848, t6851, t6854; in func_ferr() local 3672 t6854 = t2046 * t199; in func_ferr() 3675 …* t2532 + 0.54e2 * t466 * t6841 - 0.24e2 * t474 * t6851 - 0.24e2 * t474 * t6854 - 0.24e2 * t474 * … in func_ferr() 3687 …+ t1757 + t1761 + t2598 + t2604 + t675 + t679 + 0.36e2 * t6851 + 0.36e2 * t6854 + 0.36e2 * t6857 +… in func_ferr() 3691 …t7113 = 0.24e2 * t118 * t6851 + 0.24e2 * t118 * t6854 + 0.24e2 * t118 * t6857 + 0.12e2 * t118 * t6… in func_ferr()
|
H A D | mgga_c_bc95.c | 2496 double t6854, t6857, t6859, t6862, t6864, t6866, t6868, t6870; in func_pol() local 7249 t6854 = t1654 * t122; in func_pol() 7264 …0 * t6850 + 0.89344330548291861484e1 * t6852 + 0.55555555555555555556e0 * t6854 - 0.92120592592592… in func_pol() 10521 …0 * t6850 + 0.26803299164487558445e2 * t6852 + 0.16666666666666666667e1 * t6854 - 0.27636177777777… in func_pol()
|
H A D | mgga_x_regtpss.c | 8705 double t6852, t6854, t6855, t6856, t6857, t6860, t6863, t6865; in func_pol() local 12373 t6854 = t200 * t38; in func_pol() 12374 t6855 = t1352 * t6854; in func_pol() 12418 t6966 = t520 * t6854; in func_pol() 15454 t19488 = t6854 * t12205; in func_pol() 15463 …79012344e-1 * t6764 * t19517 - 0.34973395704732510287e0 * t3687 * t1371 * t6854 * t43 - 0.15188605… in func_pol() 15519 t19987 = t6854 * t1381; in func_pol()
|
H A D | mgga_x_br89.c | 345 double t6844, t6845, t6850, t6854, t6855, t6856, t6857, t6862; in func_unpol() local 4175 t6854 = t866 * t1084; in func_unpol() 4176 t6855 = t6854 / 0.2e1; in func_unpol() 13493 t56885 = 0.3e1 / 0.2e1 * t6854; in func_unpol() 14161 double t6851, t6853, t6854, t6855, t6856, t6857, t6858, t6859; in func_ferr() local 17989 t6854 = 0.2e1 / 0.3e1 * t6009; in func_ferr() 38298 t6854 = t411 * t586; in func_pol() 38299 t6855 = t562 * t6854; in func_pol() 52677 t36330 = t2965 * t6854; in func_pol() 52681 t36340 = t2935 * t6854; in func_pol() [all …]
|
H A D | mgga_x_mggac.c | 383 double t6854, t6859, t6860, t6869, t6870, t6881, t6884, t6893; in func_unpol() local 4225 t6854 = t325 * t6853; in func_unpol() 4734 …t8316 = -t6854 * t7069 / 0.12e2 + 0.3e1 * t2530 * t8268 + t6574 * t1275 / 0.8e1 + t6574 * t1280 / … in func_unpol() 8384 …t27582 = -t6854 * t11324 / 0.12e2 + 0.3e1 * t597 * t6845 + t277 * t355 * t75 * t76 * t25646 / 0.12… in func_unpol() 8393 …623 / 0.12e2 - 0.4e1 / 0.9e1 * t22453 * t6860 - 0.10e2 * t25293 * t2502 + t6854 * t9518 / 0.4e1 - … in func_unpol() 8414 …0.2e1 / 0.3e1 * t3232 * t25707 - t3232 * t27787 + t885 * t26122 / 0.6e1 - t6854 * t9492 / 0.6e1 - … in func_unpol() 9611 …08 - t866 * t751 * t36039 / 0.12e2 + t6574 * t4282 / 0.4e1 - t6854 * t31327 / 0.12e2 - t6854 * t31… in func_unpol() 23995 double t6853, t6854, t6855, t6856, t6857, t6858, t6859, t6860; in func_pol() local 32688 t6854 = t6853 / 0.3e1; in func_pol() 32693 t6859 = -t6836 + t6838 + t6840 + t6842 + t6843 - t6845 - t6850 - t6852 + t6854 + t6856 + t6858; in func_pol() [all …]
|
H A D | mgga_x_rscan.c | 7379 double t6847, t6848, t6849, t6850, t6852, t6853, t6854, t6855; in func_ferr() local 10529 t6854 = t1226 * t6853; in func_ferr() 10530 t6855 = 0.14e2 * t6854; in func_ferr() 10573 t6956 = 0.9338e1 * t6854; in func_ferr() 10658 t7128 = 0.28e2 * t6854; in func_ferr() 10682 t7196 = 0.18676e2 * t6854; in func_ferr() 10759 t7364 = 0.42e2 * t6854; in func_ferr() 10779 t7413 = 0.28014e2 * t6854; in func_ferr() 14125 …3 * t6944 + 0.766284839490720e3 * t6949 - 0.16008e2 * t6847 + 0.37352e2 * t6854 - 0.21344e2 * t686… in func_ferr() 14142 …t24507 = -0.24e2 * t6847 + 0.56e2 * t6854 - 0.32e2 * t6861 + 0.324e3 * t23542 - 0.576e3 * t23547 +… in func_ferr()
|
H A D | mgga_c_m05.c | 3332 double t6847, t6848, t6849, t6850, t6851, t6852, t6853, t6854; in func_pol() local 7845 t6854 = 0.15000000000000000000e1 * t6853; in func_pol() 7876 …t6953 = t6837 - t6842 - t6845 + t6848 + t6851 + t6854 + t6856 + t6858 + t6945 + t6948 - t6950 + t6… in func_pol() 11472 …6242 + 0.18654420000000000000e0 * t6245 + 0.18654420000000000000e0 * t6248 + t6848 + t6851 + t6854; in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_x_wpbeh.c | 3050 t6854 = t4081 * t2377; in func_unpol() 9494 t6854 = t6853 * t388; in func_ferr() 19058 t6855 = t1256 * t6854; in func_pol() 23457 t20302 = t4113 * t6854; in func_pol() 23497 t20465 = t4069 * t6854; in func_pol() 24244 t22962 = t5203 * t6854; in func_pol() 24338 t23446 = t6866 * t6854; in func_pol() 26684 t31836 = t8182 * t6854; in func_pol() 33967 t70715 = t6854 * t1259; in func_pol() 34810 t76347 = t1818 * t6854; in func_pol() [all …]
|
H A D | gga_x_n12.c | 1222 double t6822, t6854, t6856, t6866, t6867, t6883, t6890, t6892; in func_pol() local 3205 t6854 = t2298 * t2918; in func_pol() 3207 …47999999999999999999e1 * t2329 * t2588 * t8 + 0.88888888888888888887e-1 * t6854 - 0.26666666666666… in func_pol() 3232 …0 * t6794 + 0.10666666666666666666e1 * t6796 + 0.35555555555555555555e0 * t6854 - 0.10666666666666… in func_pol()
|
H A D | gga_c_bmk.c | 1598 double t6853, t6854, t6855, t6856, t6857, t6860, t6861, t6887; in func_pol() local 4969 t6854 = t412 * t2476; in func_pol() 4970 t6855 = t391 * t6854; in func_pol() 6852 …00000000000000000e1 * t1372 * t6854 - 0.15545000000000000000e-1 * t1096 * t2477 + 0.10000000000000… in func_pol() 6896 …t1681 * t6854 - 0.15545000000000000000e-1 * t1606 * t2477 - 0.15545000000000000000e-1 * t1615 * t2… in func_pol()
|
H A D | gga_c_op_pw91.c | 966 double t6845, t6847, t6854, t6860, t6862, t6864, t6866, t6871; in func_pol() local 3395 t6854 = t1362 * t1943; in func_pol() 3405 …27049731300000000000e1 * t474 * t1212 * t783 + 0.15000000000000000000e1 * t6854 - 0.27049731300000… in func_pol() 3551 …6 + 0.36066308400000000000e1 * t1323 * t2280 + 0.10000000000000000000e1 * t6854 - 0.10000000000000… in func_pol() 3696 …11 * t853 + 0.50000000000000000000e0 * t8602 + 0.50000000000000000000e0 * t6854 - 0.18033154200000… in func_pol()
|
H A D | gga_c_revtca.c | 1428 double t6847, t6854, t6859, t6861, t6863, t6865, t6868, t6872; in func_pol() local 4748 t6854 = t1945 * t1050 * t625 * t167 * t408; in func_pol() 4755 …t6880 = -0.21675893235834469598e-1 * t6854 - 0.10837946617917234799e-1 * t6859 - 0.216758932358344… in func_pol() 4813 …t7138 = t5778 + t5782 + t5786 + t5791 - 0.43351786471668939192e-1 * t6854 - 0.21675893235834469596… in func_pol()
|
H A D | gga_x_ityh.c | 2672 double t6854, t6877, t6881, t6885, t6890, t6892, t6896, t6900; in func_pol() local 5089 t6854 = t1032 * t6853; in func_pol() 5093 … * t2672 + 0.27e2 * t2648 * t2660 - 0.4e1 * t336 * t6849 + 0.9e1 * t934 * t6854 + 0.405e3 * t3677 … in func_pol() 5118 … 0.36e2 * t2710 * t2660 + 0.16e2 / 0.3e1 * t289 * t6849 - 0.12e2 * t841 * t6854 + 0.16e2 / 0.9e1 *… in func_pol()
|
H A D | gga_c_pbe_vwn.c | 2154 double t6824, t6828, t6832, t6838, t6842, t6851, t6854, t6856; in func_pol() local 5295 t6854 = t53 * t6851 * t78 / 0.24e2; in func_pol() 5302 …+ t5582 + t5589 - t5591 - t5593 - t5595 - t6787 - t6792 - t6798 - t6800 - t6854 - t6856 + t6858 - … in func_pol() 5386 …- t6792 - t5576 + t5582 + t5589 - t5591 - t5593 - t5595 - t6798 - t6800 - t6854 - t6856 + t6858 - … in func_pol()
|
H A D | gga_xc_b97.c | 1960 double t6834, t6835, t6838, t6839, t6842, t6844, t6845, t6854; in func_pol() local 5582 t6854 = t36 * t741; in func_pol() 5595 …- 0.29491200000000000001e-6 * t2178 * t6845 + 0.46603377777777777781e-9 * t6854 * t6857 - 0.46080e… in func_pol() 8200 … 0.59649896296296296299e-5 * t2178 * t19856 - 0.20194797037037037038e-7 * t6854 * t19893 + 0.24855… in func_pol() 8512 … 0.70487608888888888892e-8 * t2178 * t6857 - 0.93206755555555555566e-11 * t6854 * t6869 + 0.318350… in func_pol()
|
H A D | gga_c_sogga11.c | 3172 double t6843, t6845, t6846, t6847, t6850, t6854, t6857, t6860; in func_pol() local 7115 t6854 = t1882 * t608 * t684; in func_pol() 7124 … t6857 - 0.20e2 * t296 * t6863 + 0.24e2 * t612 * t6730 - 0.216e3 * t612 * t6854 + 0.216e3 * t612 *… in func_pol() 7147 …* t6988 - 0.2e1 * t286 * t6847 + 0.60e2 * t605 * t6926 - 0.432e3 * t698 * t6854 - 0.24e2 * t6997 *… in func_pol() 7155 …* t6850 - 0.9e1 * t290 * t6923 - 0.30e2 * t296 * t6857 - 0.720e3 * t605 * t6854 + 0.48e2 * t698 * … in func_pol()
|
H A D | gga_c_sg4.c | 2904 double t6849, t6850, t6851, t6852, t6853, t6854, t6855, t6858; in func_pol() local 8020 t6854 = 0.15198177546350665716e-1 * t6130; in func_pol() 8021 …03 + t6704 + t6707 + t6709 + t6710 - t6711 - t6712 - t6713 + t6846 + t6849 + t6852 + t6853 + t6854; in func_pol() 12448 …1331432e-1 * t5405 + 0.30396355092701331432e-1 * t5410 + t22034 - t5652 + t6854 - 0.24317084074161… in func_pol() 12833 …t17145 - t17200 - 0.37995443865876664290e-2 * t22054) - t20941 + t20942 + t6854 + t20943 - t5422 +… in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_c_pk09.c | 2610 double t6845, t6851, t6854, t6855, t6856, t6857, t6865, t6867; in func_pol() local 5669 t6854 = 0.27433775686566395222e-1 * t1898 * t1719 * t1899; in func_pol() 5680 …79848381299059167e2 * t6387 + 0.27433775686566395222e-1 * t6845 - t6851 - t6854 - 0.49373337174483… in func_pol() 6624 …4570322917723890e0 * t11573 + 0.13716887843283197611e-1 * t6845 - t6851 - t6854 - 0.49373337174483… in func_pol() 6991 …t495 * t12210 + 0.19489173774580151667e2 * t14474 * t433 * t436 - t6851 - t6854 - 0.98746674348967… in func_pol()
|
H A D | lda_c_pmgb06.c | 1720 double t6842, t6845, t6848, t6850, t6852, t6854, t6864, t6867; in func_pol() local 6015 t6854 = t2621 * t358; in func_pol() 6027 … * t2265 + 0.4e1 * t4488 * t2251 + 0.2e1 * t4070 * t2625 - t359 * t6897 - t6854 * t365 - 0.6e1 * t… in func_pol() 6105 … 0.6e1 * t4488 * t2625 - t359 * t7188 - 0.6e1 * t4077 * t7171 + t7163 * t68 - 0.3e1 * t6854 * t754; in func_pol() 8897 …+ 0.2e1 * t7995 * t2625 - 0.2e1 * t13521 * t754 - 0.2e1 * t1223 * t6897 - t6854 * t1241 - 0.2e1 * … in func_pol() 11144 … t20401 * t365 - 0.3e1 * t14320 * t754 + 0.6e1 * t14338 * t2251 - 0.3e1 * t6854 * t2265 + 0.6e1 * … in func_pol() 11184 …t20855) * t68 - 0.4e1 * t20401 * t754 + 0.12e2 * t14338 * t2625 - 0.6e1 * t6854 * t2633 - 0.24e2 *… in func_pol()
|
H A D | lda_c_ml1.c | 530 double t6844, t6847, t6850, t6852, t6854, t6877, t6882, t6897; in func_pol() local 3010 …t6854 = 0.28144540420067767464e0 * t1414 * t740 - 0.98497158835667868799e0 * t5498 * t2545 * t1469… in func_pol() 3195 …69e0 * t5395 + t7095 - t5862 - t5864 + 0.11819659060280144256e1 * t5715 + t6854 - 0.39398863534267… in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_tb09.c | 4316 double t6839, t6843, t6844, t6845, t6846, t6849, t6850, t6854; in func_pol() local 7004 t6854 = t2223 * t2264 * t1051; in func_pol() 7013 …0.4e1 * t6844 * t6846 + 0.56e2 / 0.3e1 * t6844 * t6850 - 0.12e2 * t6844 * t6854 + 0.12e2 * t2279 *… in func_pol() 7240 …1 / 0.3e1 * t284 * t6909 - 0.4e1 * t97 * t7724 * t6913 - 0.12e2 * t7691 * t6854 + 0.12e2 * t2279 *… in func_pol() 7322 …t8337 = -0.12e2 * t8231 * t6854 + 0.12e2 * t2279 * t8230 * t6857 + 0.8e1 * t8247 * t6868 - 0.16e2 … in func_pol()
|