| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_wpbeh.c | 8686 t3881 = t111 * t1391; in func_ferr()
8687 t3882 = t3881 * t391; in func_ferr()
17994 t3882 = t1165 * t3881; in func_pol()
18035 t4002 = t397 * t3881; in func_pol()
18037 t4006 = t415 * t3881; in func_pol()
18050 t4049 = t1234 * t3881; in func_pol()
18060 t4082 = t1271 * t3881; in func_pol()
18063 t4091 = t1218 * t3881; in func_pol()
18103 t4206 = t400 * t3881; in func_pol()
20657 t11735 = t436 * t3881; in func_pol()
[all …]
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| H A D | gga_c_lm.c | 907 double t3874, t3875, t3877, t3878, t3879, t3880, t3881, t3882; in func_pol() local
2681 t3881 = 0.10824628081150931252e0 * t3880; in func_pol()
2698 …866 - t3869 + t3872 - t3874 - 0.60888532956473988292e-1 * t3875 + t3879 - t3881 + t3884 - t3886 + … in func_pol()
2760 …- 0.58586286547620645950e-2 * t3852 + 0.27061570202877328130e-1 * t3878 - t3881 + 0.40592355304315… in func_pol()
2799 …- t4006 - t4001 + t4004 + t4005 + t3856 + t3863 - t3869 + t3872 - t3874 - t3881 + t3890 + t3892 - … in func_pol()
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| H A D | gga_c_wl.c | 532 double t3881, t3882, t3883, t3898, t3899, t3900, t3901, t3902; in func_pol() local
2270 t3881 = 0.13502250000000000000e-1 * t3880; in func_pol()
2281 …t3908 = -0.90015000000000000000e-2 * t3873 + 0.36006000000000000000e-1 * t3875 + t3879 - t3881 - t… in func_pol()
2295 …t3920 = t3915 + t3916 - t3917 + t3676 - t3677 + t3918 - t3881 - t3883 + t3899 + t3901 - t3903 + t3… in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1095 double t3856, t3859, t3866, t3872, t3881, t3893, t3902, t3923; in func_pol() local
2451 t3881 = t1465 * t635; in func_pol()
2452 …941155423e-7 * t621 * t622 * t1401 - 0.18751987967693759340e-13 * t1464 * t3881 + 0.70319954878851… in func_pol()
2538 …93457433481642e-13 * t3866 * t3923 + 0.10547993231827739629e-13 * t1657 * t3881 + 0.52739966159138… in func_pol()
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| H A D | gga_c_lyp.c | 588 double t3862, t3864, t3869, t3875, t3881, t3883, t3884, t3885; in func_pol() local
2235 t3881 = t1642 * t150; in func_pol()
2271 …2 * t3875 + 0.3e1 / 0.32e2 * t1672 * t185 - t28 * (t3758 * t33 / 0.72e2 + t3881 / 0.24e2 + t3884 +… in func_pol()
2425 …* t4989 - t28 * (t4384 * t33 / 0.72e2 + t4993 / 0.36e2 + t4995 / 0.72e2 + t3881 / 0.36e2 + t3883 /… in func_pol()
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| H A D | gga_xc_th2.c | 530 double t3879, t3881, t3884, t3887, t3891, t3894, t3898, t3900; in func_pol() local
1835 …t3881 = 0.320e3 / 0.27e2 * t3835 - 0.320e3 / 0.27e2 * t3837 + 0.80e2 / 0.9e1 * t3841 + 0.40e2 / 0.… in func_pol()
1853 t3922 = t3881 + t3921; in func_pol()
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| H A D | gga_c_op_pbe.c | 849 double t3878, t3879, t3880, t3881, t3882, t3884, t3889, t3890; in func_pol() local
2867 t3881 = t2445 * t3880; in func_pol()
2874 …8786e-5 * t165 * t3862 * t97 * t898 + 0.10149752135540783509e-7 * t3878 * t3881 * t3884 + 0.471047… in func_pol()
3125 t5307 = t3881 * t5306; in func_pol()
3878 t9237 = t3881 * t9202; in func_pol()
4671 t13906 = t3881 * t101; in func_pol()
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| H A D | gga_x_beefvdw.c | 1756 double t3867, t3869, t3871, t3873, t3875, t3877, t3880, t3881; in func_pol() local
3338 t3881 = t474 * t3880; in func_pol()
3340 v3sigma3[9] = -0.3e1 / 0.8e1 * t397 * t3881; in func_pol()
3812 t8237 = t2645 * t3881; in func_pol()
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| H A D | gga_c_op_pw91.c | 890 double t3881, t3884, t3887, t3890, t3891, t3894, t3895, t3918; in func_pol() local
2755 t3881 = t580 * t3868; in func_pol()
2762 …t3881 + 0.84217404458004825600e2 * t757 * t3884 - 0.56144936305336550400e2 * t757 * t3887 - 0.7018… in func_pol()
2767 …t3959 = 0.79500650212800000000e0 * t3156 * t3878 + 0.23850195063840000000e1 * t769 * t3881 + 0.238… in func_pol()
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| H A D | gga_c_scan_e0.c | 1600 double t3867, t3869, t3870, t3872, t3876, t3879, t3880, t3881; in func_pol() local
4062 t3881 = 0.96e2 * t3880; in func_pol()
4091 …t4112 = t3872 + t3876 + t3879 + t3881 + t3885 - t3889 - t3891 + t3894 + t3898 - t3903 + t3907 - t3… in func_pol()
4230 …t4487 = t3879 + t3881 + t3885 - t3889 - t3891 + t3894 + t3898 - t3903 + t3907 - t3909 - t3911 - t3… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 3356 double t3873, t3875, t3876, t3877, t3880, t3881, t3882, t3883; in func_pol() local
5431 t3881 = t1442 * t8; in func_pol()
5432 t3882 = t310 * t3881; in func_pol()
6938 …91e-1 * t1441 * t873 * t3875 - 0.59124162764395035718e-2 * t3880 * t873 * t3881 + 0.52554811346128… in func_pol()
7324 …e-1 * t1441 * t1436 * t3875 - 0.59124162764395035717e-2 * t3880 * t1436 * t3881 - 0.19708054254798… in func_pol()
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| H A D | gga_c_acgga.c | 150 double t3846, t3863, t3868, t3881, t3882, t3885, t3901, t3914; in func_unpol() local
1169 t3881 = sigma[0] * t1411; in func_unpol()
1170 t3882 = t162 * t3881; in func_unpol()
1180 …7500000000000e-2 * t664 * t964 * t665 - 0.33020496904084359672e-2 * t70 * t3881 * t1666 + 0.471721… in func_unpol()
2730 double t3881, t3884, t3886, t3889, t3892, t3896, t3897, t3899; in func_pol() local
5940 t3881 = t330 * t368 * t3879; in func_pol()
5941 …870 - t3874 - 0.25724410870841842183e-1 * t2404 * t3876 - 0.85748036236139473945e-2 * t995 * t3881; in func_pol()
9151 t13053 = t2398 * t3881; in func_pol()
11161 t23964 = t5814 * t3881; in func_pol()
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| H A D | gga_c_optc.c | 2414 double t3881, t3885, t3886, t3887, t3888, t3889, t3890, t3896; in func_pol() local
6169 t3881 = t1648 * t3880; in func_pol()
9210 t11245 = t1644 * t3881; in func_pol()
9265 t11416 = t5994 * t3881; in func_pol()
11279 t17317 = t4569 * t3881; in func_pol()
11298 t17377 = t15633 * t3881; in func_pol()
15190 t32806 = t5506 * t3881; in func_pol()
15397 t33887 = t20246 * t3881; in func_pol()
19174 t56772 = t15543 * t3881; in func_pol()
19256 t56966 = t52187 * t3881; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_revtm.c | 4748 double t3856, t3859, t3860, t3863, t3874, t3878, t3881, t3884; in func_pol() local
6750 t3881 = t2984 * t172; in func_pol()
6754 …64 * t3856 + 0.108e3 * t1364 * t3860 + 0.54e2 * t1364 * t3863 + 0.108e3 * t3881 * t1366 + 0.108e3 … in func_pol()
6911 …0962741563786008230e0 * t4361 * t673 - 0.24e2 * t3878 * t1637 + 0.108e3 * t3881 * t1651 + 0.108e3 … in func_pol()
8671 …78 * t3611 - 0.36e2 * t3878 * t3613 + 0.972e3 * t3881 * t3856 + 0.324e3 * t3881 * t3860 + 0.162e3 … in func_pol()
9062 …0.108e3 * t4979 * t3863 - 0.48e2 * t3878 * t4829 + 0.216e3 * t3881 * t4955 + 0.648e3 * t3881 * t49… in func_pol()
9320 …* t14725 - 0.12e2 * t1372 * t14728 + 0.324e3 * t1364 * t14732 + 0.108e3 * t3881 * t5509 + 0.108e3 … in func_pol()
9383 …64 * t14917 - 0.24e2 * t5568 * t3611 - 0.12e2 * t5568 * t3613 + 0.108e3 * t3881 * t5495 + 0.108e3 … in func_pol()
9576 … 0.48e2 * t3878 * t6051 - 0.24e2 * t3878 * t6054 + 0.648e3 * t3881 * t6041 + 0.216e3 * t3881 * t60… in func_pol()
9964 … * t5495 + 0.108e3 * t3881 * t6933 + 0.108e3 * t3884 * t6933 + 0.108e3 * t1364 * t18739 + 0.108e3 … in func_pol()
[all …]
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| H A D | mgga_c_pkzb.c | 6546 t3881 = t1037 * t534; in func_pol()
6547 t3882 = t3880 * t3881; in func_pol()
9768 t11257 = t3881 * t7269; in func_pol()
10839 t13076 = t3881 * t342; in func_pol()
10845 t13082 = t3881 * t465; in func_pol()
10926 t13202 = t3881 * t361; in func_pol()
11071 t13397 = t3881 * t346; in func_pol()
11254 t13643 = t3881 * t779; in func_pol()
11297 t13717 = t3881 * t819; in func_pol()
11303 t13723 = t3881 * t801; in func_pol()
[all …]
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| H A D | mgga_x_regtpss.c | 228 double t3857, t3866, t3867, t3874, t3877, t3878, t3881, t3887; in func_unpol() local
2169 t3881 = t3877 * t740; in func_unpol()
4507 double t3874, t3881, t3883, t3885, t3888, t3889, t3891, t3893; in func_ferr() local
6326 t3881 = t279 * t2777; in func_ferr()
6332 …t3893 = -0.9e1 / 0.128e3 * t3881 + 0.74262024411779045056e-5 * t3883 - 0.27e2 / 0.32e2 * t1426 * t… in func_ferr()
7767 …t12562 = -0.5e1 / 0.16e2 * t3881 - 0.15e2 / 0.32e2 * t1315 * t8364 + 0.3e1 / 0.8e1 * t1315 * t8367… in func_ferr()
8568 double t3873, t3878, t3881, t3886, t3888, t3889, t3890, t3893; in func_pol() local
11179 t3881 = t478 * t1307; in func_pol()
11946 t5849 = t3881 * t150; in func_pol()
14740 …t3881 * t5050 + 0.73e2 / 0.129600e6 * t1308 * t5118 * t492 + 0.73e2 / 0.129600e6 * t1308 * t1774 *… in func_pol()
[all …]
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| H A D | mgga_x_rtpss.c | 3067 double t3879, t3880, t3881, t3883, t3884, t3889, t3893, t3894; in func_pol() local
5163 t3881 = t1377 * t3880; in func_pol()
5181 …* t3868 - t3872 * t1382 / 0.12e2 - 0.3e1 / 0.8e1 * t458 * t3875 + t3879 + t3881 * t3884 / 0.24e2 +… in func_pol()
5213 …v3rhosigmatau[6] = -t3760 - t458 * t3942 / 0.2e1 + t3879 + t3881 * t3947 / 0.24e2 - t3901 - t2591 … in func_pol()
6732 …9321 / 0.9e1 + t9323 / 0.36e2 + t9325 / 0.12e2 + t9328 * t3884 / 0.12e2 + t3881 * t1381 * t61 * t4… in func_pol()
6741 …174 / 0.6e1 + t9352 * t1381 * t61 * t46 * t687 / 0.72e2 - 0.2e1 / 0.9e1 * t3881 * t1381 * t61 * t2… in func_pol()
6803 …609 * t3531 * t349 * sigma[0] / 0.72e2 + t3194 * t3189 * t3946 / 0.24e2 - t3881 * t1381 * t61 * t2… in func_pol()
6849 …2e1 + t9486 + t9769 / 0.9e1 + t9352 * t1381 * t61 * t46 * t921 / 0.72e2 + t3881 * t1381 * t61 * t4… in func_pol()
7270 …0.12e2 - t9406 * t3909 / 0.6e1 + t11454 - t1379 * t4608 * t1174 / 0.6e1 - t3881 * t3037 * t79 * t8… in func_pol()
7315 …738 + t11481 * t3947 / 0.12e2 - t11516 - t2591 * t9466 * t1194 - t11742 - t3881 * t3037 * t79 * t8… in func_pol()
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| H A D | mgga_xc_b97mv.c | 2338 double t3853, t3856, t3860, t3881, t3886, t3888, t3889, t3891; in func_ferr() local
3800 double t3864, t3865, t3868, t3869, t3880, t3881, t3883, t3884; in func_pol() local
7046 t3881 = t180 * t3880; in func_pol()
7047 t3883 = 0.15545350000000000000e-1 * t166 * t3881; in func_pol()
10652 t12655 = t482 * t3881; in func_pol()
10654 t12657 = t497 * t3881; in func_pol()
10762 t12958 = t771 * t3881; in func_pol()
10764 t12960 = t779 * t3881; in func_pol()
15584 …76 * t3881 + t1739 * t3896 - 0.3e1 / 0.32e2 * t1108 * t3862 - 0.15545350000000000000e-1 * t1343 * … in func_pol()
15795 …5350000000000000e-1 * t2024 * t3881 - 0.15545350000000000000e-1 * t2027 * t3881 - 0.15545350000000… in func_pol()
[all …]
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| H A D | mgga_c_kcis.c | 9463 t3882 = t234 * t3881; in func_pol()
10146 t5441 = t3881 * t1427; in func_pol()
12442 t10266 = t3865 * t3881; in func_pol()
14407 t14917 = t3881 * t5462; in func_pol()
16562 t21067 = t3881 * t5748; in func_pol()
18339 t25438 = t3881 * t867; in func_pol()
19290 t27255 = t253 * t3881; in func_pol()
20034 t28170 = t3881 * t10560; in func_pol()
21548 t34095 = t5412 * t3881; in func_pol()
25854 t64962 = t845 * t3881; in func_pol()
[all …]
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| H A D | mgga_x_tpss.c | 3587 double t3853, t3856, t3867, t3868, t3869, t3880, t3881, t3884; in func_pol() local
5645 t3881 = t3880 * t36; in func_pol()
5646 …099 * t1921 - 0.15e2 / 0.512e3 * t770 * t2103 * t775 - t763 * t1612 / 0.16e2 + t30 * t3881 / 0.8e1; in func_pol()
7355 …* t2092 * t6013 * t1921 + 0.81e2 / 0.512e3 * t770 * t6017 * t775 + t763 * t3881 / 0.4e1 + 0.2e1 * … in func_pol()
7939 …2 - 0.15e2 / 0.131072e6 * t6039 * t7713 * t4706 + 0.3e1 / 0.8e1 * t1153 * t3881 + 0.27e2 / 0.4096e… in func_pol()
8110 …t2092 * t2099 * t3407 + 0.33e2 / 0.256e3 * t770 * t2103 * t1418 + t1410 * t3881 / 0.8e1 + 0.2e1 * … in func_pol()
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| H A D | mgga_x_pbe_gx.c | 2623 double t3869, t3871, t3875, t3877, t3879, t3881, t3884, t3887; in func_pol() local
5161 t3881 = t193 * t3879 * t68; in func_pol()
5165 …v3sigma2tau[0] = -0.3e1 / 0.8e1 * t358 * t3881 + 0.76166175000000000000e-3 * t1000 * t3884 - 0.773… in func_pol()
6788 t10670 = t2959 * t3881 / 0.2e1; in func_pol()
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| H A D | mgga_xc_b98.c | 9405 t3881 = 0.1e1 / t1074 / t413; in func_pol()
9406 t3882 = t3881 * t3762; in func_pol()
10241 t5450 = t3881 * t648; in func_pol()
10538 t6185 = t3881 * t2022; in func_pol()
11019 t7289 = t3881 * t7288; in func_pol()
15532 t14947 = t3881 * t14946; in func_pol()
15555 t14993 = t3881 * t1076 * t1087; in func_pol()
15973 t17241 = t3878 * t3881; in func_pol()
15985 t17268 = t3881 * t9 * t1076; in func_pol()
16203 t18271 = t4267 * t3881; in func_pol()
[all …]
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| H A D | mgga_x_msb.c | 1609 double t3878, t3881, t3894, t3897, t3899, t3900, t3907, t3933; in func_ferr() local
2641 t3881 = t1014 * t91 * tau[0]; in func_ferr()
2644 …+ 0.26e2 * t1241 - 0.3e1 / 0.4e1 * t3878 - 0.300e3 * t2201 * t3881 + 0.525e3 * t2209 * t3881 + 0.8… in func_ferr()
2647 …t3933 = -0.25e2 * t3900 + 0.30e2 * t2093 * t3881 - 0.15e2 * t686 * t531 * t233 - 0.875e3 / 0.2e1 *… in func_ferr()
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| H A D | mgga_x_mbrxc_bg.c | 14758 t3881 = t3 * t72; in func_ferr()
14759 t3882 = t1319 * t3881; in func_ferr()
14761 t3886 = t1311 * t3881; in func_ferr()
14800 t4025 = t1206 * t3881; in func_ferr()
14832 t4139 = t422 * t3881; in func_ferr()
14837 t4154 = t408 * t3881; in func_ferr()
17963 t15508 = t1636 * t3881; in func_ferr()
19714 t25341 = t2293 * t3881; in func_ferr()
19884 t26277 = t6039 * t3881; in func_ferr()
30728 t3881 = t3880 * t270; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pmgb06.c | 1535 double t3874, t3877, t3878, t3879, t3880, t3881, t3883, t3886; in func_pol() local
4529 t3881 = t3061 * t111; in func_pol()
4530 t3883 = 0.31505407223141117834e-1 * t78 * t3881; in func_pol()
7368 t10412 = t380 * t3881; in func_pol()
7371 t10422 = 0.12602162889256447134e0 * t372 * t3881; in func_pol()
8432 t12808 = t762 * t3881; in func_pol()
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