| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th1.c | 646 double t6866, t6871, t6880, t6883, t6890, t6903, t6906, t6909; in func_pol() local
2383 t6906 = t2792 * t838; in func_pol()
2385 …3 - 0.32e2 / 0.3e1 * t76 * t6906 + 0.4e1 / 0.3e1 * t76 * t6909 + 0.352e3 / 0.9e1 * t97 * t6903 - 0… in func_pol()
2387 …t6906 + 0.4e1 / 0.3e1 * t102 * t6909 - 0.28e2 / 0.9e1 * t3040 * t3005 + 0.4e1 / 0.3e1 * t1246 * t6… in func_pol()
2398 … + 0.1408e4 / 0.9e1 * t6903 - 0.640e3 / 0.9e1 * t6880 - 0.128e3 / 0.3e1 * t6906 + 0.160e3 / 0.27e2… in func_pol()
|
| H A D | gga_c_lyp.c | 655 double t6899, t6904, t6906, t6911, t6914, t6916, t6919, t6923; in func_pol() local
2793 t6906 = t2564 * t2432 * t2762; in func_pol()
2798 …0.28e2 / 0.9e1 * t6897 + 0.28e2 / 0.9e1 * t6899 - t6904 - 0.2e1 / 0.9e1 * t6906 - t6911 - 0.4e1 / … in func_pol()
2885 …0.56e2 / 0.9e1 * t6897 + 0.56e2 / 0.9e1 * t6899 - t6904 - 0.4e1 / 0.9e1 * t6906 - t6911 - 0.8e1 / … in func_pol()
2934 …t6916 + 0.28e2 / 0.3e1 * t6897 + 0.28e2 / 0.3e1 * t6899 - 0.2e1 / 0.3e1 * t6906 - 0.4e1 / 0.3e1 * … in func_pol()
|
| H A D | gga_c_acggap.c | 4248 double t6891, t6894, t6896, t6899, t6901, t6906, t6908, t6911; in func_pol() local
9446 t6906 = t1764 * t490; in func_pol()
9447 t6908 = t320 * t3425 * t6906; in func_pol()
9460 t6960 = t3354 * t6906; in func_pol()
15053 …-1 * t20783 + 0.48018900292238105408e-1 * t20785 - t351 * t320 * t12595 * t6906 / 0.16e2 - t351 * … in func_pol()
15102 t26349 = t1000 * t6906; in func_pol()
15114 t26447 = t368 * t382 * t4464 * t6906 * t306; in func_pol()
15417 …e-1 * t17986 - 0.41159057393346947492e-1 * t23019 - t351 * t320 * t6299 * t6906 / 0.4e1 - 0.514488… in func_pol()
19423 t42323 = t128 * t6906; in func_pol()
19588 t43051 = t2003 * t133 * t8693 * t6906; in func_pol()
[all …]
|
| H A D | gga_xc_b97.c | 1963 double t6892, t6893, t6894, t6895, t6896, t6900, t6903, t6906; in func_pol() local
5606 t6906 = t159 * t113; in func_pol()
5615 …0 - 0.21617777777777777779e1 * t2454 * t6903 + 0.18204444444444444445e0 * t6906 * t6907 - 0.990814… in func_pol()
8217 … + 0.32401382716049382718e2 * t2454 * t20123 - 0.59467851851851851854e1 * t6906 * t20126 + 0.38836… in func_pol()
8510 …4444444444445e1 * t159 * t6844 * t232 * t104 - 0.14563555555555555556e0 * t6906 * t6917 + 0.266334… in func_pol()
|
| H A D | gga_c_hcth_a.c | 1689 double t6887, t6896, t6897, t6901, t6902, t6903, t6904, t6906; in func_pol() local
5160 t6906 = t339 * t243; in func_pol()
5162 …t6922 = 0.43252704000000000000e-3 * t2264 - 0.11730657600000000000e-5 * t6906 * sigma[0] - 0.29477… in func_pol()
7573 …6 * t10119) / 0.2e1 + t588 * t7080 + t228 * (-0.35191972800000000000e-5 * t6906 - 0.18919889280000… in func_pol()
|
| H A D | gga_c_sg4.c | 2910 double t6902, t6903, t6904, t6905, t6906, t6907, t6908, t6909; in func_pol() local
8073 t6906 = 0.15198177546350665716e-1 * t6905; in func_pol()
8222 …t7124 = t6903 + t6906 + t6909 - t6913 + t6916 + t6920 + t7107 - t7109 - t7112 - t7116 - t7120 + t7… in func_pol()
8392 …+ t6897 - t7307 - t7308 + t6909 + t7312 - t7316 + t7319 + t7322 + t6903 + t6906 - t6913 - t7324 - … in func_pol()
8524 …+ t6897 + t7530 - t7307 - t7308 + t6909 - t7316 + t7319 + t7322 + t6903 + t6906 - t6913 - t7324 - … in func_pol()
14445 …+ t28941 + t28984 + t29025 + t29068 + t29107 + t29140) + t7107 + t26722 + t6906 - t6913 + t7536 - … in func_pol()
14903 … t29899 + t29915 + t29938 + t29944 + t29960 + t29975 + t29991 + t30002) + t6906 - t6913 + t7721 - … in func_pol()
15047 …t30890 = t26722 + t6906 - t6913 + t7989 - t7990 + t7723 - t27463 + t7993 + t7726 - t7995 - t7325 +… in func_pol()
|
| H A D | gga_c_pw91.c | 2163 double t6906, t6910, t6912, t6925, t6938, t6940, t6941, t6945; in func_pol() local
6129 t6906 = 0.10389453539625517980e3 * t6905; in func_pol()
6135 … + 0.62027715443768233192e-1 * t1141 * t163 * t2030 * t299 - t6902 - t6904 - t6906 - t6910 + t6940; in func_pol()
6202 …67 - t6870 + t6874 - t6878 - t6882 + t6886 - t6888 + t6890 + t6894 - t6902 - t6904 - t6906 - t6910; in func_pol()
|
| H A D | gga_c_zpbeint.c | 2143 double t6888, t6890, t6892, t6894, t6896, t6899, t6905, t6906; in func_pol() local
6322 t6906 = 0.1e1 / t6905; in func_pol()
6323 t6909 = 0.35e2 * t94 * t6906 * t2295; in func_pol()
8217 t16547 = t1499 * t91 * t6906 * t1508; in func_pol()
|
| H A D | gga_c_regtpss.c | 2605 double t6885, t6892, t6894, t6899, t6903, t6906, t6907, t6909; in func_pol() local
6515 t6906 = t818 * t309 * t2307; in func_pol()
6516 t6907 = t6906 * t850; in func_pol()
7177 t9245 = t6906 * t1119; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_tpssloc.c | 12201 t6907 = t386 * t6906; in func_pol()
12203 t6911 = t91 * t6906; in func_pol()
20664 t29349 = t947 * t6906; in func_pol()
20676 t29381 = t6906 * t232; in func_pol()
20678 t29385 = t482 * t6906; in func_pol()
20744 t29639 = t1254 * t6906; in func_pol()
20755 t29675 = t1018 * t6906; in func_pol()
21944 t32035 = t4571 * t6906; in func_pol()
21947 t32041 = t1375 * t6906; in func_pol()
21959 t32063 = t1286 * t6906; in func_pol()
[all …]
|
| H A D | mgga_c_revtpss.c | 4948 double t6895, t6896, t6899, t6900, t6905, t6906, t6910, t6916; in func_pol() local
12663 t6906 = t7 * t6905; in func_pol()
12669 v2sigmatau[3] = t1016 * t6922 + t1481 * t1582 + t1575 * t1488 + t6906 * t395; in func_pol()
20982 …v3rhosigmatau[3] = t1014 * t6922 + t1016 * t29240 + t6906 * t1022 + t1481 * t6157 + t6140 * t1488 … in func_pol()
21267 …v3rhosigmatau[9] = t1016 * t30056 + t1330 * t6922 + t6906 * t1337 + t1481 * t6267 + t6251 * t1488 … in func_pol()
22381 …v3sigma2tau[3] = t1016 * t32353 + t1430 * t6922 + t6906 * t1437 + t1481 * t6834 + t6818 * t1488 + … in func_pol()
22459 …v3sigma2tau[7] = t1016 * t32617 + 0.2e1 * t1481 * t6922 + 0.2e1 * t6906 * t1488 + t1575 * t6635 + … in func_pol()
22485 …v3sigma2tau[9] = t1016 * t32715 + t1481 * t6959 + t6951 * t1488 + t1536 * t6922 + t6906 * t1540 + … in func_pol()
22755 …v3sigmatau2[4] = t1016 * t33227 + t1481 * t7031 + t7015 * t1488 + t1554 * t6922 + t6906 * t1561 + … in func_pol()
22774 … t33301 + t1481 * t7069 + t7055 * t1488 + 0.2e1 * t1575 * t6922 + 0.2e1 * t6906 * t1582 + t33267 *… in func_pol()
[all …]
|
| H A D | mgga_x_ms.c | 2944 double t6853, t6861, t6862, t6864, t6906, t6908, t6912, t6914; in func_pol() local
5889 t6906 = t421 * t399; in func_pol()
5890 t6908 = 0.950e3 / 0.531441e6 * t392 * t6906; in func_pol()
5912 ….100e3 / 0.27e2 * t3785 * t936 * t413 * t421 - 0.475e3 / 0.486e3 * t161 * t6906 - 0.50e2 / 0.27e2 … in func_pol()
5919 …+ 0.5375e4 / 0.28697814e8 * t1321 * t6912 - 0.950e3 / 0.531441e6 * t469 * t6906 + t7077 - t6914 + … in func_pol()
|
| H A D | mgga_x_sa_tpss.c | 297 double t6831, t6840, t6847, t6866, t6878, t6885, t6890, t6906; in func_unpol() local
2679 t6906 = t6778 * t50; in func_unpol()
2680 …550 - t2098 * t139 / 0.3e1 - 0.73e2 / 0.64800e5 * t616 * t2231 - 0.82650536060639746532e-1 * t6906; in func_unpol()
2689 …t7009 = -0.73e2 / 0.194400e6 * t220 * (-0.7776e4 * t6906 - 0.1337600e7 / 0.27e2 * t6866) - 0.73e2 … in func_unpol()
7696 double t6906, t6907, t6910, t6911, t6914, t6917, t6920, t6923; in func_pol() local
10971 t6906 = t20 * t974 * t650; in func_pol()
10972 t6907 = t6906 * t1595; in func_pol()
11353 …2 - 0.65e2 / 0.432e3 * t2375 - 0.5e1 / 0.27e2 * t2382 + 0.5e1 / 0.486e3 * t6906 * t2060 + 0.5e1 / … in func_pol()
13294 …4694 * t13574 - 0.625e3 / 0.17496e5 * t14698 * t13574 + 0.5e1 / 0.162e3 * t6906 * t3287 + 0.5e1 / … in func_pol()
13818 …* t4567 * t18181 - 0.25e2 / 0.324e3 * t4539 * t18196 - 0.5e1 / 0.1944e4 * t6906 * t4508 + 0.5e1 / … in func_pol()
[all …]
|
| H A D | mgga_x_mbeefvdw.c | 17148 double t6904, t6905, t6906, t6911, t6918, t6919, t6921, t6927; in func_pol() local
21289 t6906 = t6905 * t290; in func_pol()
21294 …t6906 + 0.41231507222222222222e-1 * t5190 * t6906 - 0.12369452166666666667e0 * t6911 * t5197 - 0.8… in func_pol()
25869 …t6906 - 0.51073168555555555557e-5 * t5179 * t22034 + 0.12369452166666666667e0 * t5190 * t22034 - 0… in func_pol()
27924 …17407407407407e-1 * t5134 * t31047 - 0.34048779037037037037e-5 * t23217 * t6906 - 0.1099818826e-6 … in func_pol()
28036 …07222222222222e-1 * t5190 * t31047 - 0.71249834814814814815e-1 * t23214 * t6906 + 0.21017764837677… in func_pol()
28846 t35311 = t26936 * t6906; in func_pol()
28903 t35423 = t27068 * t6906; in func_pol()
28952 t35600 = t26680 * t6906; in func_pol()
29081 t36232 = t26785 * t6906; in func_pol()
[all …]
|
| H A D | mgga_x_rscan.c | 373 double t6897, t6898, t6899, t6900, t6905, t6906, t6915, t6921; in func_unpol() local
3634 t6906 = t50 * t6905; in func_unpol()
3636 …0e3 - 0.9e1 / 0.100e3 * t1895 * t2110 - 0.3e1 / 0.100e3 * t6906 * t91 + 0.3e1 / 0.50e2 * t6906 * t… in func_unpol()
6009 …9e1 / 0.100e3 * t1899 * t1279 + 0.3e1 / 0.20e2 * t6906 * t1276 + 0.9e1 / 0.50e2 * t1899 * t19607 -… in func_unpol()
14600 double t6906, t6907, t6910, t6913, t6916, t6923, t6926, t6935; in func_pol() local
19465 t6906 = t6905 * t1101; in func_pol()
19472 …3 + 0.80565022027453500000e2 * t2179 * t6902 - 0.24169506608236050000e4 * t6906 * t6907 - 0.268550… in func_pol()
20376 …t9175 = -0.80565022027453500000e3 * t6906 * t9133 + 0.78774688204621200000e3 * t9141 * t9142 + 0.4… in func_pol()
20880 …5 * t10421 + 0.1920479760e3 * t9132 * t10641 - 0.80565022027453500000e3 * t6906 * t10641 + 0.78774… in func_pol()
27347 t35435 = 0.80565022027453500000e3 * t6906 * t35419; in func_pol()
[all …]
|
| H A D | mgga_x_m11_l.c | 189 double t6868, t6906, t6911, t6914, t6917, t6920, t6923, t6926; in func_unpol() local
1620 …t6906 = 0.108800e6 / 0.27e2 * t1409 * t6355 + 0.108800e6 / 0.27e2 * t1413 * t6355 + 0.870400e6 / 0… in func_unpol()
1644 …+ t6541 + t6598) + t75 * (t6643 + t6680 + t6718 + t6761 + t6820 + t6868 + t6906 + t6958) - 0.63064… in func_unpol()
4205 double t6906, t6908, t6910, t6913, t6916, t6918, t6919, t6923; in func_pol() local
6784 t6906 = t546 * t6904 * t550; in func_pol()
6807 …t6866 / 0.27e2 - t546 * t554 * t6896 / 0.18e2 + t6903 + 0.10e2 / 0.81e2 * t6906 - 0.5e1 / 0.27e2 *… in func_pol()
7274 … * t8671 + 0.10e2 / 0.243e3 * t6935 + t6941 / 0.27e2 + 0.20e2 / 0.243e3 * t6906 - 0.10e2 / 0.81e2 … in func_pol()
7466 …t9255 = t546 * t549 * t9209 / 0.27e2 + 0.10e2 / 0.243e3 * t6906 - 0.5e1 / 0.81e2 * t6910 - t8697 +… in func_pol()
|
| H A D | mgga_x_mggac.c | 12073 double t6889, t6890, t6891, t6894, t6898, t6901, t6902, t6906; in func_ferr() local
15907 t6906 = t534 * t550 * t6879; in func_ferr()
15910 …6 * t6894 / 0.4e1 - t1176 * t6898 / 0.2e1 + t516 * t6902 / 0.4e1 + t769 * t6906 / 0.2e1 - t604 * t… in func_ferr()
24001 double t6903, t6904, t6905, t6906, t6907, t6908, t6909, t6910; in func_pol() local
32738 t6906 = t847 * t6905; in func_pol()
32739 t6907 = t6906 * t1571; in func_pol()
32741 t6909 = t6906 * t1580; in func_pol()
46388 …t31215 - 0.2e1 / 0.3e1 * t33888 * t6363 + 0.3e1 / 0.4e1 * t6906 * t6390 + 0.3e1 / 0.8e1 * t6906 * … in func_pol()
51035 … t1558 * t50884 / 0.6e1 - 0.26e2 / 0.9e1 * t54003 * t11302 - t6906 * t11137 / 0.6e1 - t6906 * t111… in func_pol()
57231 … - 0.88e2 / 0.27e2 * t84819 * t23372 - t11087 * t11143 / 0.4e1 + t84825 + t6906 * t17407 / 0.2e1 -… in func_pol()
[all …]
|
| H A D | hyb_mgga_x_pjs18.c | 1903 double t6885, t6888, t6893, t6903, t6904, t6906, t6908, t6910; in func_ferr() local
3327 t6906 = t299 * t2663; in func_ferr()
3339 …4 + (0.120e3 * t6849 + 0.160e3 * t6906 + 0.40e2 * t6908 - t6911 - t6913 - t6915 - t6917 - t6904) *… in func_ferr()
3355 …1 - 0.3e1 / 0.2e1 * t2505 * t1014 + 0.6e1 * t625 * t6849 + 0.8e1 * t625 * t6906 + 0.21e2 * t969 * … in func_ferr()
3356 …460800e6 * t76 * t6849 + 0.1344e4 * t6849 - 0.5760e4 * t6903 + 0.1792e4 * t6906 + 0.448e3 * t6908 … in func_ferr()
3360 …t7241 = 0.576e3 * t519 * t6906 - 0.9e1 * t4507 * t2738 + 0.2e1 * t6171 * t329 + 0.960e3 * t333 * t… in func_ferr()
|
| H A D | mgga_c_kcis.c | 10814 t6906 = t1853 * t658; in func_pol()
10815 t6907 = t6906 * t710; in func_pol()
11143 t7383 = t6906 * t1800; in func_pol()
17989 t24693 = t6906 * t2942; in func_pol()
19350 t27338 = t6906 * t6714; in func_pol()
19412 t27426 = t6906 * t6918; in func_pol()
20065 t28214 = t6906 * t7313; in func_pol()
28123 t86548 = t6906 * t10995; in func_pol()
29913 t99023 = t6906 * t24336; in func_pol()
30984 t103986 = t6906 * t26990; in func_pol()
[all …]
|
| H A D | mgga_x_mbrxh_bg.c | 5995 double t6864, t6869, t6904, t6906, t6922, t6925, t6926, t6933; in func_ferr() local
8766 t6906 = t4464 * t413; in func_ferr()
8856 …1 / 0.3e1 * t4564 * t462 + 0.4e1 / 0.9e1 * t1788 * t213 - 0.4e1 / 0.9e1 * t6906 * t320 + 0.8e1 / 0… in func_ferr()
9450 …0.27e2 * t6906 * t567 + 0.8e1 / 0.27e2 * t7484 * t564 - 0.8e1 / 0.27e2 * t6906 * t572 + 0.4e1 / 0.… in func_ferr()
12108 double t6906, t6916, t6922, t6924, t6925, t6926, t6927, t6928; in func_pol() local
19207 t6906 = t802 * t6894; in func_pol()
19209 … + 0.2e1 / 0.3e1 * t6819 * t1068 + t293 * t6903 / 0.2e1 - 0.2e1 * t1059 * t6906 + 0.2e1 * t1459 * … in func_pol()
20085 …t7887 = -t5696 * t1637 - t1284 * t6906 + t7864 + 0.6e1 * t5699 * t7865 + t1284 * t6816 - 0.3e1 * t… in func_pol()
29131 …0.3e1 * t5696 * t6828 - t1284 * t32515 - t26375 * t1637 - 0.2e1 * t5696 * t6906 - t39595 + t337 * … in func_pol()
30625 …t6882 - 0.12e2 * t6802 * t6895 + 0.18e2 * t6802 * t6906 + 0.2e1 * t6819 * t6895 - 0.3e1 * t6819 * … in func_pol()
[all …]
|
| H A D | mgga_xc_b97mv.c | 3970 double t6906, t6907, t6916, t6920, t6922, t6928, t6933, t6934; in func_pol() local
8426 t6906 = t287 * t2775; in func_pol()
8427 t6907 = t6906 * t334; in func_pol()
8982 t8273 = t6906 * t701; in func_pol()
13054 … * t2723 - 0.2535e1 * t7032 * t1820 + 0.20360736000000000000e-4 * t2153 * t6906 * t1127 + 0.208234… in func_pol()
13064 …0000000e-7 * t1844 * t2788 * t22322 + 0.59231232000000000000e-4 * t5125 * t6906 * t1155 - 0.133270… in func_pol()
13747 …00000000e-5 * t1844 * t5681 * t8216 + 0.35538739200000000000e-3 * t5125 * t6906 * t2383 + 0.888468… in func_pol()
13753 …00000000e-1 * t1849 * t2154 * t8199 + 0.12216441600000000000e-3 * t2153 * t6906 * t2358 - 0.190033… in func_pol()
|
| H A D | mgga_x_tpss.c | 3685 double t6840, t6851, t6864, t6903, t6906, t6909, t6916, t6923; in func_pol() local
6840 t6906 = t381 * t739 * t2726; in func_pol()
6843 …6e1 + t2346 * t2355 * t959 * t9 / 0.3e1 - t6903 / 0.8e1 - 0.3e1 / 0.4e1 * t6906 - t6909 / 0.6e1 - … in func_pol()
6870 …t238 * t7125 - t8 * t887 * t238 * t7130 / 0.2e1 - t6903 / 0.2e1 - 0.3e1 * t6906 - 0.2e1 / 0.3e1 * … in func_pol()
|
| H A D | mgga_x_mbeef.c | 248 double t6884, t6886, t6888, t6893, t6902, t6903, t6904, t6906; in func_unpol() local
3413 t6906 = t6568 * t296; in func_unpol()
3414 t6907 = t6906 * t6903; in func_unpol()
4571 t11762 = t6906 * t11374; in func_unpol()
4712 t12380 = t6906 * t12379; in func_unpol()
5275 … + 0.95582558248234517096e0 * t7143 * t14408 - 0.18511197886501041508e1 * t6906 * t14408 + 0.16525… in func_unpol()
6591 …482e-1 * t257 * t20502 + 0.37022395773002083016e1 * t6906 * t18862 - 0.55533593659503124524e1 * t6… in func_unpol()
7378 …t24088 = -0.22082175481379870955e1 * t6902 * t23402 - 0.92555989432505207538e0 * t6906 * t23402 + … in func_unpol()
11615 …t48896 = 0.57847493395315754712e-1 * t6906 * t46911 + 0.1759518246e-1 * t827 * t13211 + 0.23826109… in func_unpol()
13336 … 0.17251699594828024183e-1 * t6902 * t58623 - 0.72309366744144693390e-2 * t6906 * t58623 + 0.64553… in func_unpol()
[all …]
|
| H A D | mgga_x_m11.c | 3143 double t6902, t6903, t6906, t6907, t6910, t6917, t6918, t6921; in func_pol() local
5947 t6906 = t868 * t6885; in func_pol()
5948 t6907 = t6906 * t6887; in func_pol()
8322 t18369 = t6906 * t9093; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_x_erf.c | 625 double t6878, t6886, t6897, t6900, t6906, t6919, t6922, t6925; in func_pol() local
2696 …t6906 = 0.2e1 / 0.27e2 * t1942 * t2349 * t2411 + 0.8e1 / 0.27e2 * t5080 * t2349 * t2415 + 0.80e2 /… in func_pol()
2734 …/ 0.27e2 * t23 * t1423 * t137 * t308 + t23 * t25 * t26 * (t6827 + t6858 + t6906 + t6957 + t7004 + … in func_pol()
|