/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_mbrxh_bg.c | 3220 t8044 = t1364 * t201; in func_unpol() 3221 t8045 = t355 * t8044; in func_unpol() 3225 t8076 = t1405 * t8044; in func_unpol() 3353 t8659 = t364 * t8044; in func_unpol() 3355 t8673 = t1444 * t8044; in func_unpol() 3557 t9541 = t786 * t8044; in func_unpol() 3594 t9829 = t346 * t8044; in func_unpol() 20268 t8044 = t872 * t8043; in func_pol() 20269 t8045 = t8044 * t891; in func_pol() 20396 t8263 = t8044 * t877; in func_pol() [all …]
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H A D | mgga_x_mbeefvdw.c | 3536 t8044 = t6202 * t1127; in func_unpol() 21702 t8044 = t5933 * t1962; in func_pol() 21703 t8045 = t8044 * t7741; in func_pol() 22098 t9548 = t8044 * t9547; in func_pol() 22646 t11235 = t8044 * t11234; in func_pol() 23247 t12963 = t8044 * t12833; in func_pol() 23615 t14184 = t8044 * t14178; in func_pol() 25383 t20207 = t8044 * t20206; in func_pol() 26388 t24427 = t8044 * t24426; in func_pol() 26400 t24443 = t8044 * t24442; in func_pol() [all …]
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H A D | mgga_x_mvs.c | 2130 double t8005, t8012, t8026, t8035, t8038, t8044, t8064, t8076; in func_pol() local 5474 t8044 = t2848 * t417; in func_pol() 5477 …t8044 - 0.260000e6 / 0.19683e5 * t2599 - 0.2600e4 / 0.729e3 * t2603 - 0.1250e4 / 0.729e3 * t7203 *… in func_pol()
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H A D | mgga_x_m11_l.c | 4240 double t8031, t8033, t8035, t8036, t8040, t8044, t8051, t8058; in func_pol() local 7072 t8044 = t1028 * t2721; in func_pol() 7073 …0.8e1 / 0.27e2 * t2922 * t7752 * t8040 - 0.2e1 / 0.27e2 * t2922 * t3127 * t8044 - 0.2e1 / 0.9e1 * … in func_pol() 7095 …0.8e1 / 0.27e2 * t2964 * t7669 * t8040 + 0.2e1 / 0.27e2 * t2964 * t3167 * t8044 + 0.4e1 / 0.9e1 * … in func_pol() 9872 t20980 = t8044 * t892; in func_pol() 9882 t21028 = t2922 * t926 * t8044; in func_pol() 9906 t21124 = t2964 * t891 * t8044; in func_pol()
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H A D | mgga_k_pc07.c | 8212 double t8012, t8015, t8022, t8025, t8029, t8036, t8043, t8044; in func_pol() local 12155 t8044 = t2627 * t8043; in func_pol() 12161 … * t510 * t8036 - 0.784115667e1 * t879 * t1862 * t1866 - 0.1568231334e2 * t8044 * t170 + 0.4225599… in func_pol() 12176 …t8128 = 0.32334e1 * t8050 * t165 - 0.32334e1 * t1338 * t8110 - 0.174247926e1 * t8044 * t165 + 0.53… in func_pol() 16582 t30600 = t8044 * t155; in func_pol() 16654 …0833 - 0.522743778e1 * t4143 * t31072 - 0.32334e1 * t30764 - 0.129336e2 * t8044 * t1168 - 0.10778e… in func_pol() 16674 t31215 = t8044 * t340; in func_pol() 17681 …* t165 + 0.87123963e0 * t36607 + 0.469511036607e0 * t36714 - 0.129336e2 * t8044 * t1729 - 0.32334e… in func_pol()
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H A D | mgga_xc_b98.c | 5848 double t8043, t8044, t8045, t8046, t8047, t8048, t8049, t8050; in func_pol() local 11433 t8044 = t967 * t2432; in func_pol() 11434 t8045 = t963 * t8044; in func_pol() 17321 …* t967 * t8054 + 0.48247024766806046961e2 * t4464 * t8044 + 0.48247024766806046961e2 * t4467 * t80… in func_pol() 17393 …0000000000000001e-1 * t1641 * t26850 + 0.16082341588935348987e2 * t5089 * t8044 - 0.38862500000000… in func_pol() 17397 …00000000001e0 * t348 * t5281 * t2432 + 0.16082341588935348987e2 * t5129 * t8044 - 0.38862500000000… in func_pol() 17417 …164683177870697974e2 * t5106 * t8234 - 0.96494049533612093922e2 * t5009 * t8044 - t1788 * t8214 * … in func_pol()
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H A D | mgga_c_m05.c | 3407 double t8039, t8040, t8041, t8042, t8043, t8044, t8045, t8046; in func_pol() local 8464 t8044 = 0.19431687500000000000e-2 * t8043; in func_pol() 8485 …- t8026 - t8028 - t8030 + t8032 + t8034 + t8036 + t8038 + t8040 + t8042 + t8044 + t8046 + t8048 + … in func_pol() 12294 …t25265 = t8042 - t8030 + t8032 + t23865 + t23866 + t8044 + t8046 + t23870 + t23871 + t23872 + t238… in func_pol()
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H A D | mgga_c_scan.c | 3930 double t8042, t8043, t8044, t8045, t8047, t8048, t8049, t8050; in func_pol() local 9526 t8044 = t184 * t8043; in func_pol() 9527 …70 + t7974 + t7978 + t7651 - t7656 + t7660 + t7982 + t8021 + t8022 + t8024 + t8026 + t8027 + t8044; in func_pol() 16006 …8429 + t28433 + t28440 + t28441 + t28444 + t28598) + t7667 + t8021 + t7956 + t7731 + t7732 + t8044; in func_pol() 16430 … t8050 + t8054 + t8051 + t8052 + t8047 + t8048 + t7804 - t26915 + 0.2e1 * t8044 + 0.2e1 * t8027 + … in func_pol()
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H A D | mgga_x_mbrxc_bg.c | 33855 t8044 = t393 * t2939; in func_pol() 33856 t8045 = t8044 * t489; in func_pol() 33876 t8068 = t8044 * t1310; in func_pol() 34011 t8238 = t700 * t8044; in func_pol() 34062 t8333 = t8044 * t703; in func_pol() 34064 t8337 = t8044 * t712; in func_pol() 36889 t11920 = t8044 * t490; in func_pol() 46792 t37893 = t8044 * t1342; in func_pol() 46937 t38462 = t8044 * t150; in func_pol() 47332 t40385 = t169 * t8044; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | hyb_gga_xc_wb97.c | 2207 double t8034, t8038, t8040, t8041, t8044, t8045, t8048, t8051; in func_pol() local 6644 t8044 = t1469 * t145; in func_pol() 6645 t8045 = t8044 * t6445; in func_pol() 7048 t9164 = t8044 * t8477; in func_pol() 8924 …4067 + 0.4e1 / 0.81e2 * t1553 * t2878 * t13937 + 0.8e1 / 0.81e2 * t1553 * t8044 * t13691 + 0.2e1 /… in func_pol() 10083 t19853 = t8044 * t4469; in func_pol() 10138 …t8044 * t17584 + 0.4e1 / 0.9e1 * t7316 * t2878 * t17531 + 0.4e1 / 0.9e1 * t1553 * t2878 * t17588 -… in func_pol() 11162 …565 + 0.2e1 / 0.27e2 * t1553 * t20166 * t2882 + 0.4e1 / 0.243e3 * t1553 * t8044 * t23307 + t1553 *… in func_pol() 11172 … t1553 * t2878 * t23339 - 0.16e2 / 0.81e2 * t1553 * t8044 * t23344 + 0.4e1 / 0.243e3 * t1553 * t80… in func_pol() 11685 …t8044 * t28546 + t1553 * t2878 * t28565 / 0.81e2 + t1553 * t1554 * t31872 / 0.27e2 + 0.28e2 / 0.72… in func_pol() [all …]
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H A D | gga_c_op_b88.c | 928 double t8022, t8025, t8029, t8033, t8037, t8040, t8044, t8048; in func_pol() local 3495 t8044 = t318 * t2470 * t126; in func_pol() 3497 …23251943726460000000e2 * t630 * t8040 + 0.13951166235876000000e3 * t630 * t8044 - 0.69755831179380… in func_pol() 3498 …t8044 - 0.19952466388545600000e2 * t638 * t8048 - 0.23777812116000000000e2 * t630 * t8022 - 0.1585… in func_pol()
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H A D | gga_x_n12.c | 1237 double t7953, t7966, t7976, t8011, t8021, t8023, t8025, t8044; in func_pol() local 3355 …t8044 = -t7772 - 0.3e1 / 0.8e1 * t494 * t495 * t8011 - t494 * t1279 * t3353 * t370 - t3326 * t1279… in func_pol() 3359 v4rho3sigma[6] = t8044 + t8064; in func_pol()
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H A D | gga_c_sg4.c | 3006 double t8032, t8033, t8035, t8036, t8038, t8039, t8043, t8044; in func_pol() local 8880 t8044 = t998 * t8043; in func_pol() 8914 …t8100 = 0.20808826820007844870e-2 * t8039 - 0.3e1 * t7060 * t539 + 0.6e1 * t396 * t8044 - t396 * t… in func_pol() 15612 …6 - t32722 + t32727 - 0.20808826820007844870e-2 * t32734 + 0.6e1 * t866 * t8044 - 0.25907711552859… in func_pol() 15722 …- t32975 - 0.3e1 * t5381 * t1962 - 0.3e1 * t5338 * t1962 + 0.6e1 * t993 * t8044 - 0.25907711552859… in func_pol() 16669 …t998 * t8067 * t483 + t32695 - t32700 - t32704 + t32711 + 0.6e1 * t1236 * t8044 - t32722 + t32727 … in func_pol() 16709 …8e2 * t1664 * t7573 - 0.25907711552859566375e0 * t35127 + 0.6e1 * t1104 * t8044 + 0.6e1 * t7060 * … in func_pol() 17251 …7 - 0.51815423105719132748e0 * t36660 + 0.20726169242287653100e1 * t36663 + 0.24e2 * t1664 * t8044; in func_pol() 17336 t36847 = 0.6e1 * t1746 * t8044; in func_pol()
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H A D | gga_c_pw91.c | 2207 double t8038, t8041, t8042, t8044, t8045, t8048, t8051, t8054; in func_pol() local 6487 t8044 = t184 * t2764 * t1343; in func_pol() 6488 t8045 = 0.2200e4 / 0.27e2 * t8044; in func_pol() 7438 …t11772 = -0.8800e4 / 0.81e2 * t8041 - 0.8800e4 / 0.81e2 * t8044 + 0.400e3 / 0.27e2 * t8048 + 0.800… in func_pol()
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H A D | gga_c_regtpss.c | 2647 double t8032, t8033, t8034, t8035, t8041, t8042, t8043, t8044; in func_pol() local 6856 t8044 = 0.12e2 * t8043; in func_pol() 7200 …t9350 = t8024 - t8026 - t8031 - t8033 + t8035 + t8042 - t8044 + t9295 + t9341 - t9342 - t9345 - t9… in func_pol() 7357 …t9787 = t8042 - t8044 + t90 * t96 * (t8074 + t8103 + t8132 + t8173 + t8206 + t9705 + t9743 + t9773… in func_pol()
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H A D | gga_x_gg99.c | 3820 double t8022, t8027, t8044, t8053, t8055, t8056, t8058, t8072; in func_pol() local 7852 t8044 = t1314 * t303; in func_pol() 7854 …7e2 * t536 * t2579 * t2322 + 0.8e1 / 0.27e2 * t2302 * t8044 * t2312 + 0.8e1 / 0.9e1 * t536 * t8044… in func_pol()
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H A D | gga_c_acgga.c | 2955 double t8030, t8033, t8036, t8041, t8044, t8047, t8048, t8049; in func_pol() local 7783 t8044 = t1823 * t6102; in func_pol() 7795 …119737665102352616e0 * t8041 * t2079 - 0.17135921299530705785e1 * t7916 * t8044 - 0.11423947533020… in func_pol() 13191 …1025997310e0 * t1759 * t8065 * t858 - 0.34271842599061411570e1 * t31239 * t8044 + 0.68543685198122… in func_pol() 13605 …68140941025997310e0 * t6092 * t8470 - 0.17135921299530705785e1 * t32262 * t8044 - 0.86736281882051… in func_pol()
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H A D | gga_c_optc.c | 2631 double t8044, t8045, t8046, t8048, t8051, t8052, t8053, t8054; in func_pol() local 7934 t8044 = t167 * t8042 * t99; in func_pol() 7935 t8045 = t8044 * t194; in func_pol() 13702 t25796 = t8044 * t653; in func_pol() 13760 t26033 = t8044 * t635; in func_pol() 15410 t33964 = t8044 * t1096; in func_pol()
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H A D | gga_c_zvpbeloc.c | 2379 double t8018, t8032, t8035, t8040, t8042, t8044, t8045, t8049; in func_pol() local 6609 t8044 = t581 * t581; in func_pol() 6610 t8045 = 0.1e1 / t8044; in func_pol()
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H A D | gga_c_pbeloc.c | 2259 double t8037, t8038, t8039, t8040, t8044, t8048, t8049, t8050; in func_pol() local 6558 …t8044 = 0.9e1 * t499 * t2432 * t965 - 0.3e1 * t912 * t8033 * t356 + t6782 - t6785 + t6789 - t6792 … in func_pol() 6826 …2 - t912 * t913 * t2428 - t8071 + t9000 + t9002 - t9003 + t7992 + t8013 + t8044 - t8985 + t8133 - … in func_pol()
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H A D | gga_c_ft97.c | 6241 double t8037, t8039, t8041, t8042, t8044, t8047, t8055, t8057; in func_pol() local 14373 …t8044 = 0.63843608379629629630e-2 * t7977 - 0.34049924469135802470e-1 * t7979 - 0.5107488670370370… in func_pol() 14385 …* t374 * t7966 + 0.40559281352147498558e-3 * t7765 * t7972 - t64 * t409 * t8044 + 0.6e1 * t8047 - … in func_pol() 26627 …834e-9 * t79 * t37320 + 0.46509801892875584000e-1 * t1624 * t374 * t384 * t8044 - 0.16540877980489… in func_pol() 26782 …6477736175058559857e-3 * t1624 * t7889 * t37842 + 0.8e1 * t3076 * t7852 * t8044 - 0.24e2 * t22874 … in func_pol() 26786 …t37925 = -0.8e1 * t1669 * t1670 * t8044 - 0.92955472350117119713e-3 * t1603 * t7889 * t37835 + 0.2… in func_pol() 28463 …1617 * t11235 * t7811 + 0.11627450473218896000e-1 * t1624 * t374 * t930 * t8044 + 0.14225713554822… in func_pol() 28521 … t3070 * t8059 + 0.6e1 * t3076 * t11403 * t1751 + 0.2e1 * t3076 * t3077 * t8044 - 0.11627450473218… in func_pol() 35805 … t92104 * t428 - 0.6e1 * t1669 * t22877 * t1751 - 0.2e1 * t1669 * t5522 * t8044 - 0.23089403769541… in func_pol() 35897 …e-3 * t1665 * t5557 + 0.22227677429409423704e-2 * t1300 * t1701 * t5546 * t8044 + 0.69764702839313… in func_pol() [all …]
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H A D | gga_c_acggap.c | 4330 double t8029, t8030, t8034, t8037, t8038, t8040, t8041, t8044; in func_pol() local 10110 t8044 = t2097 * t2179 * t447; in func_pol() 10111 t8045 = t2088 * t8044; in func_pol() 16629 t33110 = t7889 * t8044; in func_pol() 18472 t37968 = 0.34694512752820797848e1 * t8331 * t8044; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_xc_bn05.c | 1074 double t7993, t7994, t7995, t7996, t8012, t8028, t8043, t8044; in func_pol() local 3796 t8044 = t8043 * t133; in func_pol() 3811 …e-1 * t8044 * t159 - 0.51947577317044391277e2 * t8047 + 0.35089341735807877242e1 * t8049 - 0.54934… in func_pol()
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H A D | lda_c_pmgb06.c | 1781 double t8040, t8044, t8046, t8048, t8052, t8053, t8056, t8060; in func_pol() local 6494 t8044 = t63 * t7788; in func_pol() 6497 …040 + 0.10345530000000000000e3 * t63 * t7900 + 0.71524651851851851850e1 * t8044 - 0.45980133333333… in func_pol() 8676 …t13514 = 0.53643488888888888889e1 * t8044 - 0.22990066666666666666e1 * t8046 + 0.57475166666666666… in func_pol() 8888 … - t14114 + 0.22990066666666666666e1 * t8038 + 0.35762325925925925926e1 * t8044 - 0.76633555555555… in func_pol() 11096 …00000000000e2 * t2257 * t2258 * t736 * t6813 + 0.17881162962962962963e1 * t8044 + t7802 - t7808 + … in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_tb09.c | 4346 double t8044, t8045, t8051, t8058, t8069, t8076, t8107, t8112; in func_pol() local 7294 t8044 = my_piecewise3(t69, t168, 0.65185185185185185186e0 * t1153); in func_pol() 7295 t8045 = t8044 * t181; in func_pol() 7306 t8147 = t128 * t8044; in func_pol()
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