| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_pbeloc.c | 587 t912 = t47 * t79; in func_unpol()
588 t913 = t912 * t440; in func_unpol()
662 t1107 = t912 * t1106; in func_unpol()
680 t1148 = t912 * t525; in func_unpol()
3356 t912 = t90 * t96; in func_pol()
3358 t915 = t912 * t913 * t356; in func_pol()
4201 t2459 = t912 * t1434 * t890; in func_pol()
4246 t2536 = t912 * t2534 * t356; in func_pol()
4466 t3082 = t912 * t913 * t890; in func_pol()
9092 t20248 = t912 * t5796; in func_pol()
[all …]
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| H A D | gga_x_hjs.c | 2975 t1247 = t912 * t605; in func_ferr()
3035 t1448 = t912 * t1447; in func_ferr()
3120 t1718 = t912 * t459; in func_ferr()
3342 t2499 = t912 * t1183; in func_ferr()
3474 t3047 = t255 * t912; in func_ferr()
3534 t3262 = t912 * t1450; in func_ferr()
3982 t5956 = t912 * t2495; in func_ferr()
4031 t6444 = t479 * t912; in func_ferr()
4069 t7077 = t912 * t7076; in func_ferr()
4071 t7084 = t912 * t3265; in func_ferr()
[all …]
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| H A D | gga_x_pw91.c | 1602 t912 = t388 * params->expo; in func_pol()
1604 t914 = t912 * t913; in func_pol()
1774 t1259 = t912 * t1258; in func_pol()
1811 t1357 = t912 * t389; in func_pol()
1881 t1501 = t912 * t551; in func_pol()
1906 t1572 = t912 * t152; in func_pol()
1960 t1647 = t912 * t226; in func_pol()
1981 t1707 = t49 * t912 * t1704 / 0.8e1; in func_pol()
2027 t1762 = t95 * t912 * t1759 / 0.8e1; in func_pol()
2494 t3934 = 0.3e1 / 0.4e1 * t49 * t912 * t3928; in func_pol()
[all …]
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| H A D | gga_xc_th1.c | 501 double t884, t887, t890, t905, t908, t911, t912, t923; in func_pol() local
1059 t912 = t127 * t911; in func_pol()
1061 … / 0.4e1 * t905 * t122 + 0.10e2 / 0.9e1 * t908 * t122 + 0.55e2 / 0.36e2 * t912 * t122 + t30 * t890… in func_pol()
1394 … / 0.4e1 * t905 * t178 + 0.10e2 / 0.9e1 * t908 * t178 + 0.55e2 / 0.36e2 * t912 * t178 + t30 * t188… in func_pol()
1492 … / 0.4e1 * t905 * t309 + 0.10e2 / 0.3e1 * t908 * t309 + 0.55e2 / 0.12e2 * t912 * t309 + 0.5e1 * t3… in func_pol()
1621 … / 0.4e1 * t905 * t413 + 0.10e2 / 0.9e1 * t908 * t413 + 0.55e2 / 0.36e2 * t912 * t413 + 0.4e1 * t2… in func_pol()
1628 …0.9e1 * t908 * t120 + 0.160e3 / 0.9e1 * t2725 - t2465 - 0.55e2 / 0.18e2 * t912 * t120 + 0.176e3 / … in func_pol()
2074 …+ 0.2e1 / 0.3e1 * t225 * t2228 + 0.2e1 * t364 * t1884 + 0.55e2 / 0.12e2 * t912 * t683 + 0.9e1 / 0.… in func_pol()
2293 … 0.4e1 * t905 * t1009 + 0.10e2 / 0.9e1 * t908 * t1009 + 0.55e2 / 0.36e2 * t912 * t1009 + 0.4e1 * t… in func_pol()
2323 t6396 = t912 * t175; in func_pol()
[all …]
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| H A D | gga_x_2d_b88.c | 624 double t912, t921, t924, t936, t939, t940, t943, t951; in func_pol() local
1253 t912 = t9 * t397; in func_pol()
1266 … t900 - t904 - 0.8e1 * t906 - 0.2e1 * t144 * t908 * t184 - 0.8e1 * t144 * t912 * t64 - 0.4e1 * t14… in func_pol()
1283 t990 = t912 * t108; in func_pol()
1647 …v4rho3sigma[0] = -0.12e2 * t144 * t912 * t197 - 0.4e1 * t144 * t368 * t612 - 0.8e1 / 0.3e1 * t144 … in func_pol()
1666 … t108 + t2398 * t986 * t184 - 0.2e1 * t985 * t986 * t197 - 0.8e1 * t993 * t912 * t3 - 0.4e1 * t993… in func_pol()
1684 …* t985 * t157 * t310 * t64 - 0.2e1 * t144 * t2333 * t305 - 0.4e1 * t144 * t912 * t310 - 0.4e1 * t1… in func_pol()
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| H A D | gga_x_herman.c | 344 double t892, t894, t898, t903, t911, t912, t913, t915; in func_pol() local
1023 t912 = 0.71111111111111111113e-2 * t911; in func_pol()
1026 …8 * t134 + 0.10666666666666666667e-1 * t564 * t689 * t165 + t736 + t740 - t912 - 0.391111111111111… in func_pol()
1111 …+ 0.35555555555555555557e-2 * t1141 + 0.10666666666666666667e-1 * t1143 - t912 - t930 + 0.29629629… in func_pol()
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| H A D | gga_x_mpbe.c | 741 double t910, t912, t913, t915, t916, t917, t919, t920; in func_pol() local
1313 t912 = -t900; in func_pol()
1314 t913 = t112 * t912; in func_pol()
1727 …e1 * t946 * t463 * t418 * t427 - 0.2e1 / 0.3e1 * t1871 - 0.2e1 / 0.3e1 * t462 * t463 * t184 * t912; in func_pol()
1746 …18 * t875 * t196 / 0.2e1 - t7 * t1891 * t124 / 0.2e1 - t7 * t183 * t247 * t912 / 0.2e1 + t1901 + 0… in func_pol()
1758 …196 * t900 / 0.6e1 + t1966 + 0.7e1 / 0.6e1 * t1969 - t462 * t463 * t201 * t912 / 0.6e1 + t462 * t1… in func_pol()
1877 …55 * t945 * t316 * t784 / 0.9e1 - t1339 * t1357 * t793 / 0.2e1 - t255 * t623 * t316 * t912 / 0.2e1; in func_pol()
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| H A D | gga_k_apbeint.c | 707 double t898, t900, t902, t904, t907, t910, t912, t914; in func_pol() local
1339 t912 = t825 * t411; in func_pol()
1362 …e1 + t904 / 0.2e1 + 0.2e1 / 0.9e1 * t907 + t910 / 0.3e1 + 0.2e1 / 0.3e1 * t912 + t916 / 0.2e1 - t9… in func_pol()
1440 …t1093 = t1027 + 0.2e1 * t912 + t1031 + t1034 + t1080 + t1087 - 0.6e1 / 0.5e1 * t950 + 0.3e1 / 0.5e… in func_pol()
1823 …00 + t904 + 0.4e1 / 0.9e1 * t907 + 0.2e1 / 0.3e1 * t910 + 0.4e1 / 0.3e1 * t912 + t916 - 0.2e1 * t9… in func_pol()
1831 …t2294 = t1018 + t1022 + t1027 + 0.4e1 * t912 + 0.3e1 / 0.2e1 * t916 - 0.3e1 * t921 - 0.3e1 * t924 … in func_pol()
1873 …t2689 = 0.6e1 * t1026 + 0.8e1 * t912 + 0.4e1 * t1031 + 0.4e1 * t1034 + 0.6e1 / 0.5e1 * t1079 + 0.3… in func_pol()
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| H A D | gga_c_op_g96.c | 649 double t907, t908, t909, t912, t915, t916, t917, t921; in func_pol() local
1580 t912 = t14 * t15 * t23; in func_pol()
1584 …097e5 * t86 * t899 * t92 * t265 + 0.512e3 / 0.624838779e9 * t907 * t909 * t912 - 0.16e2 / 0.33291e… in func_pol()
2253 … t2590 * t912 + 0.24040515072343876723e-3 * t178 * t2594 - 0.24643251318303975310e-2 * t2599 * t26… in func_pol()
2940 … t2502 * t92 * t265 - 0.28672e5 / 0.1874516337e10 * M_PI * t4118 * t909 * t912 + 0.736e3 / 0.99873… in func_pol()
3302 …75958582749871227e-5 * t6107 * t1618 * t98 * t912 + 0.82879792913749356135e-6 * t1617 * t6112 * t1… in func_pol()
3447 …3195275832904090e-6 * t6107 * t1618 * t138 * t912 + 0.27626597637916452045e-6 * t1617 * t6112 * t1… in func_pol()
3870 …53865330713988864e-5 * t1460 * t912 + 0.53237968828788013481e-4 * t1467 * t912 + 0.148698937395118… in func_pol()
4584 …14680 - 0.22405999706339377167e-9 * t1085 * t3614 * t748 * t527 * t9666 * t912 + 0.460443293965274… in func_pol()
4992 …-7 * t3572 * t3588 * t17675 + 0.15539961171328004275e-6 * t3579 * t3588 * t912 + 0.250000000000000… in func_pol()
[all …]
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| H A D | gga_k_mpbe.c | 723 double t900, t902, t904, t906, t908, t910, t912, t914; in func_pol() local
1280 t912 = t196 * t405; in func_pol()
1281 t914 = t746 * t180 * t912; in func_pol()
1668 t1855 = t746 * t409 * t912; in func_pol()
1716 …80 * t472 * t405 - 0.4e1 / 0.27e2 * t2106 - 0.2e1 / 0.9e1 * t746 * t453 * t912 + 0.4e1 / 0.9e1 * t… in func_pol()
1821 … - t2685 + 0.5e1 / 0.9e1 * t2737 + t2740 - t2741 / 0.6e1 - t546 * t2686 * t912 / 0.9e1 - 0.2e1 / 0… in func_pol()
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| H A D | gga_x_dk87.c | 741 double t900, t902, t904, t907, t912, t914, t916, t918; in func_pol() local
1355 t912 = t400 * t92; in func_pol()
1356 t914 = t807 * t353 * t912; in func_pol()
1791 … t1540 / 0.27e2 - 0.10e2 / 0.27e2 * t1548 + 0.2e1 / 0.9e1 * t807 * t831 * t912 + t807 * t353 * t40… in func_pol()
1797 t2150 = t807 * t812 * t912; in func_pol()
1911 …* t2734 + t2713 - t2626 / 0.6e1 - 0.2e1 / 0.9e1 * t2845 + t1216 * t2786 * t912 / 0.9e1 - t200 * t3… in func_pol()
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| H A D | gga_x_2d_pbe.c | 412 double t908, t910, t912, t920, t923, t924, t929, t931; in func_pol() local
1193 t912 = t135 * t328; in func_pol()
1198 …e1 * t908 + 0.40489343715165857695e-1 * t910 + 0.26992895810110571796e0 * t912 + 0.365556502523891… in func_pol()
1247 …1 * t908 + 0.20244671857582928847e-1 * t910 + 0.67482239525276429490e-1 * t912 + t929 / 0.2e1 + 0.… in func_pol()
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| H A D | gga_k_pw86.c | 533 double t901, t902, t906, t907, t908, t909, t912, t916; in func_pol() local
1149 t912 = t395 * t89; in func_pol()
1157 …9 * t901 * t902 / 0.45e2 - 0.14e2 / 0.225e3 * t907 * t909 + t179 * t378 * t912 / 0.15e2 + t179 * t… in func_pol()
1536 t2392 = t83 * t105 * t912; in func_pol()
1637 …406e3 / 0.3375e4 * t907 * t2844 * t215 - 0.28e2 / 0.225e3 * t907 * t908 * t912 + 0.812e3 / 0.5625e… in func_pol()
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| H A D | gga_x_lv_rpw86.c | 536 double t831, t834, t842, t851, t854, t857, t874, t912; in func_ferr() local
868 …t912 = 0.81890917951233497255e-20 * t265 * t762 + 0.15639316753717095020e-5 * t14 * t372 * t68 * t… in func_ferr()
880 …69 / 0.2e1 - 0.3e1 / 0.2e1 * t216 * t522 - 0.3e1 / 0.8e1 * t58 * t59 * (t874 + t912 + t948 + t992); in func_ferr()
1014 double t907, t909, t910, t911, t912, t915, t916, t919; in func_pol() local
1660 t912 = t910 * t911; in func_pol()
1692 …14492144949529386507e-6 * t138 * t385 + 0.11674227876009783576e-7 * t38 * t912 - 0.181151811869117… in func_pol()
2147 …6085860909152895713e-5 * t372 * t385 - 0.37357529203231307441e-6 * t138 * t912 - 0.342444017696286… in func_pol()
2337 …3476434848588159524e-6 * t610 * t385 + 0.35022683628029350728e-7 * t262 * t912 - 0.465818944806301… in func_pol()
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| H A D | gga_x_n12.c | 1716 t912 = 0.1e1 / t358 / t168; in func_pol()
1717 t913 = t193 * t912; in func_pol()
2022 t1798 = t180 * t912; in func_pol()
2250 t2354 = t483 * t912; in func_pol()
2548 t3300 = t639 * t912; in func_pol()
2759 t4086 = t163 * t912; in func_pol()
3003 t5285 = t464 * t912; in func_pol()
3057 t5616 = t1267 * t912; in func_pol()
3301 t7710 = t622 * t912; in func_pol()
3345 t7953 = t1516 * t912; in func_pol()
[all …]
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| H A D | gga_x_g96.c | 423 double t912, t913, t914, t917, t920, t923, t926, t927; in func_pol() local
1165 t912 = t38 * t349 / 0.274e3; in func_pol()
1169 v3rhosigma2[5] = -t905 - t906 * t908 / 0.548e3 + t912 + t306 * t914 / 0.274e3; in func_pol()
1196 … t906 * t923 / 0.548e3 - t117 * t928 / 0.1096e4 + t117 * t931 / 0.548e3 + t912 + t306 * t934 / 0.2… in func_pol()
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| H A D | gga_k_exp4.c | 505 double t911, t912, t914, t917, t920, t921, t922, t926; in func_pol() local
1062 t912 = t911 * t390; in func_pol()
1069 …v3rho2sigma[3] = 0.5e1 / 0.6e1 * t849 + t853 + t855 / 0.2e1 + 0.5e1 / 0.6e1 * t912 + t357 * t914 /… in func_pol()
1086 v3rho2sigma[6] = 0.5e1 / 0.3e1 * t912 + t853 + t357 * t941 / 0.3e1 + t357 * t944 / 0.2e1; in func_pol()
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| H A D | gga_x_ol2.c | 534 double t887, t888, t892, t895, t911, t912, t915, t920; in func_pol() local
1155 t912 = t581 * sigma[0]; in func_pol()
1156 …e1 * params->cc * t218 * t97 + 0.192e3 * params->cc * t232 * t386 - 0.1024e4 / 0.3e1 * t911 * t912; in func_pol()
1492 …27e2 * params->cc * t571 * t386 + 0.50176e5 / 0.9e1 * params->cc * t579 * t912 - 0.65536e5 / 0.9e1… in func_pol()
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| H A D | gga_x_pbe.c | 491 double t904, t905, t907, t909, t910, t912, t915, t917; in func_pol() local
1179 t912 = t88 * t354 * t160; in func_pol()
1193 …v3rho2sigma[0] = -t899 / 0.18e2 - t904 - t905 / 0.108e3 + t907 / 0.9e1 - t910 * t912 / 0.144e3 - t… in func_pol()
1553 t2367 = t436 * t912; in func_pol()
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| H A D | gga_x_c09x.c | 545 double t909, t910, t912, t913, t914, t916, t917, t918; in func_pol() local
1140 t912 = t7 * t520 * t910; in func_pol()
1141 t913 = t912 / 0.9e1; in func_pol()
1483 … * t772 - 0.2e1 * t775 + 0.4e1 / 0.9e1 * t903 - 0.2e1 * t907 + 0.4e1 / 0.9e1 * t912 - 0.2e1 * t916; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_x_1d_exponential.c | 273 double t912, t925, t940, t952, t955, t963, t984, t999; in func_pol() local
688 t912 = 0.24e2 * t161 + 0.24e2 * t459; in func_pol()
690 … * t892 * t351 + t297 * t903 * t5 * t3 + 0.2e1 * t297 * t345 * t49 * t3 + t912 * t9 + 0.3e1 * t333… in func_pol()
695 …* t952 * t379 + t318 * t963 * t20 * t3 + 0.2e1 * t318 * t373 * t54 * t3 - t912 * t23 + 0.3e1 * t36… in func_pol()
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| H A D | lda_c_1d_csc.c | 506 double t902, t903, t904, t905, t907, t908, t909, t912; in func_pol() local
988 t912 = 0.72e2 * t273; in func_pol()
991 …t915 = t1 * (t900 + t905 + t909) + t873 + t912 - t875 - t876 + t877 - t878 - t913 + t914 + t881 - … in func_pol()
1004 …t934 = t1 * (t900 + t930 + t909) + t873 - t912 - t875 - t876 + t877 - t878 + t913 - t914 + t881 - … in func_pol()
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| H A D | lda_c_vwn.c | 788 double t907, t908, t909, t910, t911, t912, t913, t914; in func_pol() local
1454 t912 = 0.21533839358987498253e-3 * t911; in func_pol()
1539 … * t398 - 0.11515074074074074074e-2 * t236 * t1153 - t902 - t906 - t910 + t912 - 0.499526021231691… in func_pol()
1624 …t1358 = t882 + t885 - t891 - t895 + t898 + t902 + t906 + t910 - t912 - t1089 + t1093 - t1095 + t13… in func_pol()
1719 …t1505 = -t912 - t1089 - t1441 / 0.24e2 - t1443 / 0.24e2 - t1473 / 0.24e2 - t1475 / 0.12e2 - t1479 … in func_pol()
1761 …t1587 = t910 - t912 - t1089 - t1441 / 0.12e2 - t1443 / 0.12e2 - t1479 - t1481 - t1494 - t1496 - 0.… in func_pol()
1803 …t1669 = t906 + t910 - t912 - t1089 - t1633 - t1634 - t1635 - t1636 - t1638 - t1643 - t1664 - t1666… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_tpss.c | 2492 t912 = t828 * t60; in func_ferr()
2493 t913 = t151 * t912; in func_ferr()
7817 t1113 = t97 * t912; in func_pol()
8485 t2383 = t912 * t443; in func_pol()
8783 t3103 = t96 * t912; in func_pol()
8802 t3152 = t912 * t912; in func_pol()
9276 t4272 = t3763 * t912; in func_pol()
9332 t4396 = t1204 * t912; in func_pol()
9343 t4418 = t1208 * t912; in func_pol()
13233 t14501 = t73 * t912; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_2d_prp10.c | 1300 double t906, t907, t911, t912, t913, t917, t922, t926; in func_pol() local
2102 t912 = t700 * t72; in func_pol()
2103 t913 = t203 * t912; in func_pol()
2113 t939 = t938 * t912; in func_pol()
2189 t1070 = t290 * t912; in func_pol()
2191 t1074 = t1073 * t912; in func_pol()
2193 t1080 = t1079 * t912; in func_pol()
2196 t1087 = t275 * t912; in func_pol()
2201 t1101 = t75 * t912; in func_pol()
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