| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_ml1.c | 551 double t7844, t7850, t7853, t7873, t7877, t7881, t7883, t7887; in func_pol() local
3180 t7883 = t789 * t1678; in func_pol()
3182 … * t1617 + 0.18763026946711844976e0 * t7881 + 0.93815134733559224880e-1 * t7883 - 0.50660172756121… in func_pol()
3794 … * t7877 + 0.12508684631141229984e0 * t7881 + 0.62543423155706149920e-1 * t7883 - 0.75052107786847… in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_m11_l.c | 2276 double t7869, t7871, t7875, t7883, t7887, t7901, t7915, t7918; in func_ferr() local
3639 t7883 = t114 * t1560 * tau[0]; in func_ferr()
3643 …t7883 + 0.6500e4 / 0.3e1 * t100 * t7887 + 0.26000e5 / 0.3e1 * t355 * t7887 + 0.13000e5 / 0.3e1 * t… in func_ferr()
3653 … * t7818 - 0.6560e4 / 0.9e1 * t1028 * t7866 - 0.52480e5 / 0.27e2 * t355 * t7883 + 0.2600e4 / 0.3e1… in func_ferr()
3675 …t7883 + 0.87750e5 * t463 * t7830 - 0.320000e6 / 0.3e1 * t458 * t7921 - 0.110000e6 / 0.3e1 * t181 *… in func_ferr()
3679 …* t7818 - 0.35000e5 / 0.9e1 * t169 * t7822 - 0.32800e5 / 0.27e2 * t1184 * t7883 - 0.14000e5 * t175… in func_ferr()
3684 …1 * t3269 * t7804 + 0.31850e5 * t1304 * t7850 - 0.6560e4 / 0.9e1 * t207 * t7883 - 0.5000e4 / 0.9e1… in func_ferr()
3686 … * t7818 - 0.6560e4 / 0.9e1 * t1351 * t7866 - 0.52480e5 / 0.27e2 * t509 * t7883 + 0.2600e4 / 0.3e1… in func_ferr()
3688 …* t7871 - 0.35000e5 / 0.9e1 * t210 * t7822 - 0.32800e5 / 0.27e2 * t1358 * t7883 + 0.6500e4 / 0.3e1… in func_ferr()
3693 …t7883 - 0.82000e5 / 0.27e2 * t576 * t7901 + 0.6500e4 / 0.3e1 * t3567 * t7875 + 0.32500e5 / 0.3e1 *… in func_ferr()
[all …]
|
| H A D | mgga_x_pbe_gx.c | 2704 double t7865, t7870, t7872, t7874, t7876, t7883, t7888, t7891; in func_pol() local
6053 t7883 = t422 * t1047; in func_pol()
6073 …t8086 = -t1000 * t1001 * t1418 / 0.2e1 - 0.3e1 / 0.2e1 * t1000 * t2801 * t449 - t1000 * t7883 * t4… in func_pol()
6095 …+ t1000 * t7854 * t1704 / 0.9e1 - t2946 * t2797 * t1711 / 0.3e1 - t1000 * t7883 * t587 / 0.3e1 - t… in func_pol()
6115 …* t7888 - 0.2e1 / 0.9e1 * t8225 + t1000 * t7854 * t1882 / 0.9e1 - t1000 * t7883 * t647 / 0.6e1 - 0… in func_pol()
|
| H A D | mgga_x_m06l.c | 2962 double t7797, t7805, t7814, t7823, t7883, t7891, t7900, t7907; in func_pol() local
5885 t7883 = t1485 * t1352; in func_pol()
5888 …940 * t7883 + 0.59124162764395035716e-2 * t443 * t607 * t3229 - 0.3361068e-1 * t2947 * t7883 + 0.1… in func_pol()
|
| H A D | mgga_x_mvs.c | 2127 double t7839, t7846, t7866, t7873, t7877, t7880, t7883, t7888; in func_pol() local
5394 t7883 = t55 * t676; in func_pol()
5396 …t7883 + 0.475e3 / 0.729e3 * t237 * t7792 + 0.625e3 / 0.2916e4 * t7888 * t987 - 0.5000e4 / 0.2187e4… in func_pol()
|
| H A D | hyb_mgga_x_pjs18.c | 3749 double t7883, t7886, t7895, t7898, t7901, t7902, t7906, t7911; in func_pol() local
6981 t7883 = t4221 * t7427; in func_pol()
6988 …5 + 0.14744579111111111111e-1 * t887 * t1091 - 0.392e3 / 0.675e3 * t377 * t7883 - 0.10297801283950… in func_pol()
9861 … + 0.44233737333333333333e-1 * t141 * t4299 - 0.392e3 / 0.225e3 * t1247 * t7883 - 0.392e3 / 0.225e… in func_pol()
9886 …t22615 = 0.98e2 / 0.135e3 * t4209 * t2641 - 0.392e3 / 0.225e3 * t1244 * t7883 + 0.98e2 / 0.405e3 *… in func_pol()
10166 …t24765 = -0.28e2 / 0.81e2 * t4720 * t2496 - 0.392e3 / 0.675e3 * t1703 * t7883 - 0.2e1 / 0.5e1 * t5… in func_pol()
10934 ….784e3 / 0.675e3 * t2615 * t7883 + 0.14416921797530864197e0 * t141 * t1062 * t3607 - 0.49126344019… in func_pol()
|
| H A D | hyb_mgga_x_js18.c | 8779 double t7846, t7853, t7854, t7861, t7872, t7875, t7878, t7883; in func_pol() local
12944 t7883 = t241 * t7573; in func_pol()
12945 …2 * t7878 * t1882 - 0.14e2 / 0.15e2 * t2380 * t1911 - 0.392e3 / 0.375e3 * t7883 * t7410 + 0.98e2 /… in func_pol()
14630 …3 * t7878 * t4554 - 0.28e2 / 0.45e2 * t2380 * t4356 - 0.392e3 / 0.375e3 * t7883 * t13901 + 0.196e3… in func_pol()
15529 …1 * t46 * t18003 + 0.98e2 / 0.225e3 * t7878 * t5883 - 0.392e3 / 0.375e3 * t7883 * t18008 + 0.196e3… in func_pol()
16635 … * t46 * t22306 - 0.17737734345330796161e-4 * t6079 - 0.392e3 / 0.375e3 * t7883 * t22301 + 0.70297… in func_pol()
19698 …* t40745 - 0.17842310082304526749e-1 * t46 * t40748 - 0.392e3 / 0.125e3 * t7883 * t40751 - 0.19983… in func_pol()
19707 …* t7878 * t13877 + 0.98e2 / 0.75e2 * t7878 * t13880 - 0.392e3 / 0.125e3 * t7883 * t40776 + 0.98e2 … in func_pol()
21231 …t7883 * t53644 - 0.16737460732074723200e-2 * t7875 * t5891 + 0.17853291447546371413e-1 * t2380 * t… in func_pol()
21238 …83 * t53692 + 0.6664e4 / 0.1875e4 * t27450 * t53695 - 0.392e3 / 0.375e3 * t7883 * t53698 - 0.264e3… in func_pol()
[all …]
|
| H A D | mgga_k_pc07.c | 281 double t7843, t7850, t7852, t7868, t7881, t7882, t7883, t7885; in func_unpol() local
2579 t7883 = t7882 * t346; in func_unpol()
2591 …t7912 = -0.21556e1 * t7883 - 0.10778e1 * t7885 - 0.174247926e1 * t7888 - 0.10778e1 * t7890 - 0.107… in func_unpol()
2701 …5 * t388 - 0.50707191953556e2 * t5652 * t195 * t8276 - 0.64668e1 * t148 * t7883 - 0.1568231334e2 *… in func_unpol()
4205 double t7876, t7877, t7880, t7883, t7887, t7900, t7905, t7909; in func_ferr() local
6494 t7883 = t966 * t7860; in func_ferr()
6496 … * t322 * t7877 - 0.1045487556e2 * t322 * t7880 - 0.1045487556e2 * t322 * t7883 + 0.5634132439284e… in func_ferr()
7100 …1 - 0.1045487556e2 * t1268 * t2279 - 0.1045487556e2 * t450 * t7880 - 0.1045487556e2 * t450 * t7883; in func_ferr()
7251 …* t1576 * t2279 - 0.1045487556e2 * t554 * t7880 - 0.1045487556e2 * t554 * t7883 - 0.60e2 * t2312 *… in func_ferr()
|
| H A D | mgga_x_m08.c | 2887 double t7874, t7875, t7878, t7883, t7891, t7927, t7935, t7941; in func_pol() local
5512 …t7883 = t3390 / 0.3e1 - t7878 - t3399 / 0.2e1 + t3404 - t3408 - t3412 / 0.2e1 + t3418 / 0.3e1 - t2… in func_pol()
5515 v4rho4[1] = t7682 + t7875 + t7883 + t7891; in func_pol()
|
| H A D | mgga_x_vt84.c | 6865 double t7874, t7875, t7876, t7880, t7881, t7883, t7884, t7887; in func_pol() local
10591 t7883 = t45 * t2213; in func_pol()
10592 t7884 = t618 * t7883; in func_pol()
13388 …3819576612e0 * t22709 * t1240 - 0.70480493755364682462e0 * t3307 * t618 * t7883 * t489 - 0.1879479… in func_pol()
13430 …t23083 = -0.3e1 * t6092 * t672 * t1704 - 0.93973991673819576616e0 * t1243 * t1567 * t7883 - 0.6e1 … in func_pol()
14510 …02145872984e1 * t5872 * t5855 - 0.28192197502145872984e1 * t3307 * t618 * t7883 * t665 + 0.1409609… in func_pol()
|
| H A D | mgga_c_vsxc.c | 3508 double t7878, t7879, t7880, t7881, t7882, t7883, t7884, t7885; in func_pol() local
8373 t7883 = 0.38863375000000000000e-2 * t7882; in func_pol()
8395 …t7905 = t7862 + t7865 + t7868 - t7871 + t7873 - t7875 + t7877 - t7879 - t7883 - t7885 + t7888 + t7… in func_pol()
12455 …t25539 = -t7871 + t7873 - t7875 + t7877 - t7879 - t7883 + t25530 - t7885 + t25531 + t25532 - t2553… in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_pbe.c | 1692 double t7879, t7883, t7897, t7900, t7901, t7902, t7903, t7905; in func_pol() local
4899 t7883 = 0.35089341735807877242e1 * t4653; in func_pol()
4927 …t8029 = -t7877 - t7878 - t4642 + t4645 - t7879 + t4652 - t7883 + t4658 - t5672 + t5673 - t4663 + t… in func_pol()
4970 … (t8577 + t7950 + t7905 - t7906 + t7901 + t7902 - t7903 + t7900 + t7897 - t7883 - t7879 + t7875 - … in func_pol()
|
| H A D | gga_c_op_b88.c | 925 double t7883, t7897, t7907, t7910, t7927, t7934, t7949, t7956; in func_pol() local
3462 t7883 = 0.80025640000000000000e0 * t5977 * t2379; in func_pol()
3463 …000e0 * t6574 * t2368 - 0.60019230000000000000e0 * t2191 * t933 * t1383 - t7883 - 0.80025640000000… in func_pol()
3585 …t5116 + 0.36011538000000000000e1 * t370 * t1348 * t7666 - t7861 - t7867 - t7883 - t7907 - 0.500000… in func_pol()
|
| H A D | gga_c_scan_e0.c | 1727 double t7868, t7873, t7881, t7882, t7883, t7888, t7889, t7890; in func_pol() local
5084 t7883 = 0.35089341735807877242e1 * t3890; in func_pol()
5167 …t8306 = t3869 + t3876 + t3879 - t7881 - t5296 - t7882 + t3885 - t3889 - t7883 - t3898 - t3903 + t3… in func_pol()
5198 …4 + t7 * (t8680 + t8309 - t7922 - t7918 + t7916 + t7909 + t7908 + t7895 - t7883 - t7881 - t7882 + … in func_pol()
|
| H A D | gga_c_pbe_vwn.c | 2183 double t7876, t7877, t7878, t7879, t7881, t7882, t7883, t7884; in func_pol() local
5530 t7883 = t3021 * t279; in func_pol()
5531 t7884 = t7883 / 0.12e2; in func_pol()
5738 t9379 = t7883 / 0.8e1; in func_pol()
|
| H A D | gga_x_ncap.c | 2365 double t7782, t7783, t7813, t7823, t7828, t7850, t7883, t7915; in func_pol() local
4676 …t7883 = 0.304e3 * t858 * t2400 - 0.48e2 * t1046 * t2391 - 0.18e2 * t1046 * t1048 * t686 - 0.9e1 * … in func_pol()
4699 … / 0.8e1 * t277 * t318 * (t7648 + t7686 + t7726 + t7772 + t7813 + t7850 + t7883 + t7915 + t7943 + … in func_pol()
|
| H A D | hyb_gga_xc_wb97.c | 2199 double t7874, t7876, t7878, t7880, t7881, t7883, t7884, t7886; in func_pol() local
6581 t7883 = t1656 * t1133; in func_pol()
6582 t7884 = t1654 * t7883; in func_pol()
9870 …94049533612093922e2 * t18578 * t4944 - 0.30000000000000000000e1 * t4936 * t7883 + 0.15000000000000… in func_pol()
9891 …e2 * t1952 * t17804 * t2931 + t18720 - 0.30000000000000000000e1 * t4949 * t7883 + 0.15000000000000… in func_pol()
10731 …000000000000000000e1 * t23396 * t691 - 0.20000000000000000000e1 * t7887 * t7883 + 0.10000000000000… in func_pol()
10836 …000000000000000001e0 * t4955 * t3540 - 0.20000000000000000000e1 * t8313 * t7883 + t19580 / 0.12e2 … in func_pol()
|
| H A D | gga_c_sg4.c | 2995 double t7881, t7883, t7884, t7901, t7904, t7906, t7909, t7910; in func_pol() local
8777 …t7883 = t7362 + 0.17271807701906377583e0 * t7646 - t7364 + t7365 + 0.17271807701906377583e0 * t764… in func_pol()
8778 t7884 = t399 * t7883; in func_pol()
14954 …t30321 = 0.2e1 * t396 * t998 * t7883 * t406 + 0.57572692339687925277e-1 * t29583 - 0.5757269233968… in func_pol()
15493 …t30344 * t484 + 0.34543615403812755166e0 * t31122 + 0.4e1 * t396 * t998 * t7883 * t483 + 0.2e1 * t… in func_pol()
17000 t35733 = t1593 * t1567 * t1594 * t7883; in func_pol()
17062 t35871 = 0.2e1 * t396 * t998 * t7883 * t538; in func_pol()
17170 … t7909 + 0.51815423105719132749e0 * t35485 + 0.6e1 * t396 * t998 * t557 * t7883 + 0.6e1 * t6220 * … in func_pol()
|
| H A D | gga_c_zpbeint.c | 2180 double t7875, t7881, t7883, t7884, t7885, t7886, t7887, t7889; in func_pol() local
6616 t7883 = t2117 * t1056; in func_pol()
6617 t7884 = 0.119e3 / 0.1152e4 * t7883; in func_pol()
6983 ….7e1 / 0.576e3 * t7875 + 0.595e3 / 0.1296e4 * t7881 - 0.119e3 / 0.864e3 * t7883 + 0.595e3 / 0.864e… in func_pol()
|
| H A D | gga_c_acggap.c | 232 double t7719, t7742, t7745, t7772, t7783, t7845, t7850, t7883; in func_unpol() local
1910 t7883 = t51 * t105 * t5907; in func_unpol()
1914 …t7883 * t5617 * t56 * t2065 - 0.66443794656801351252e-4 * t7883 * t3240 * t56 * t2065 - 0.49137644… in func_unpol()
4321 double t7879, t7881, t7882, t7883, t7885, t7886, t7888, t7889; in func_pol() local
10031 t7883 = t7882 * t2084; in func_pol()
10057 …736281882051994620e0 * t2096 * t7874 - t7881 - 0.17347256376410398924e1 * t7883 - t7888 + 0.173472… in func_pol()
10534 …2 - 0.65854491829355115987e0 * t8935 - t7881 - 0.86736281882051994620e0 * t7883 + 0.86736281882051… in func_pol()
|
| H A D | gga_c_zvpbeloc.c | 2376 double t7845, t7847, t7875, t7882, t7883, t7885, t7898, t7899; in func_pol() local
6584 t7883 = t2092 * t879; in func_pol()
6591 …t7919 = 0.7e1 / 0.384e3 * t7883 - t7885 * t352 / 0.768e3 - t2058 * t879 / 0.512e3 - t338 * t340 * … in func_pol()
6976 … t9491 + 0.3e1 / 0.16e2 * t613 * t123 * t3129 * t297 + 0.7e1 / 0.1536e4 * t7883 - 0.119e3 / 0.2304… in func_pol()
|
| H A D | gga_c_pbeloc.c | 2249 double t7883, t7884, t7886, t7888, t7891, t7895, t7896, t7897; in func_pol() local
6471 t7883 = 0.960e3 * t2178; in func_pol()
6475 …t7876 - 0.12e2 * t2459 + 0.24e2 * t2462 + t7879 + t7880 + t7881 - t7882 + t7883 - t7884 - 0.701786… in func_pol()
7434 … t3776 + 0.4e1 * t4026 + t7879 + t7880 + 0.36e2 * t4028 - t7881 - t7882 - t7883 - t7884 - t7886 - … in func_pol()
|
| H A D | gga_c_gapc.c | 362 double t7882, t7883, t7889, t7897, t7902, t7922, t7941, t7959; in func_unpol() local
3167 t7883 = t3 * t918; in func_unpol()
3171 …t7922 = 0.14832487269357106522e-2 * t7876 * t141 * t3219 * t7883 - 0.12165753993895264536e-2 * t18… in func_unpol()
3363 …t3838 * t333 * t3840 - 0.43944844631026245588e-4 * t3838 * t141 * t1402 * t7883 - 0.72087999722812… in func_unpol()
8731 double t7878, t7881, t7882, t7883, t7884, t7887, t7888, t7891; in func_pol() local
13757 t7883 = t1054 * t7882; in func_pol()
13758 t7884 = t2519 * t7883; in func_pol()
20132 t29754 = t7887 * t3021 * t1053 * t7883; in func_pol()
|
| H A D | gga_xc_b97.c | 2017 double t7853, t7856, t7857, t7860, t7863, t7864, t7883, t7884; in func_pol() local
6058 …t7883 = 0.11520000000000000000e-5 * t950 * t2504 - 0.23040000000000000000e-5 * t2510 * t7857 + 0.1… in func_pol()
6062 t7912 = t7883 + t7911; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 4344 double t7838, t7847, t7851, t7883, t7889, t7899, t7918, t7919; in func_pol() local
7248 …t7883 = t4242 * t7144 - 0.6e1 * t4242 * t7137 - t7851 * t111 * t137 / 0.2e1 + t7851 * t130 * t132 … in func_pol()
7249 …6 * t159 / 0.12e2 - t152 * t749 * t303 * t1137 / 0.24e2 - 0.2e1 * t3 * t25 * (t7847 + t7883) * t32; in func_pol()
|