| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_ncap.c | 118 double t2387, t2388, t2435, t2439, t2440, t2446, t2447, t2448; in func_unpol() local
897 t2435 = t1053 * t269; in func_unpol()
903 …1 * t1832 * t990 + 0.28e2 / 0.27e2 * t1823 * t993 - 0.8e1 * t635 * t636 * t2435 + 0.2e1 * t627 * t… in func_unpol()
922 t2542 = t628 * t2435; in func_unpol()
945 …t2652 = t980 * t2542 / 0.6e1 - t980 * t2440 / 0.2e1 + 0.2e1 * t984 * t985 * t2435 - 0.6e1 * t984 *… in func_unpol()
1181 double t2411, t2414, t2415, t2417, t2435, t2485, t2488, t2491; in func_ferr() local
1939 …t2435 = 0.8e1 * t218 * t602 * t2394 + t298 * t1762 / 0.4e1 + 0.3e1 * t316 * t827 * t1761 - 0.4e1 /… in func_ferr()
2248 double t2425, t2426, t2427, t2428, t2431, t2434, t2435, t2438; in func_pol() local
3581 t2435 = t1794 * t2434; in func_pol()
4489 …t1683 * t2428 - 0.28e2 / 0.27e2 * t1689 * t2431 - 0.7e1 / 0.9e1 * t1683 * t2435 - 0.2e1 / 0.3e1 * … in func_pol()
[all …]
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| H A D | gga_c_w94.c | 560 double t2418, t2423, t2424, t2428, t2432, t2435, t2438, t2439; in func_pol() local
1629 t2435 = 0.12e2 * t734 * t2377 * t78; in func_pol()
1644 …t2471 = -0.25e2 / 0.36e2 * t323 * t2424 * t111 + 0.10e2 / 0.3e1 * t2428 + t2432 + t2435 + t2438 - … in func_pol()
1709 …t2645 = -0.5e1 / 0.6e1 * t2418 + 0.5e1 / 0.3e1 * t2428 + t2432 + t2435 + t2438 - t2442 - 0.5e1 / 0… in func_pol()
1738 … t2613 + t2398 - t2400 - t2403 + t2410 - t2412 - 0.10e2 * t2625 + t2432 + t2435 + t2438 - t2442 - … in func_pol()
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| H A D | gga_x_g96.c | 459 double t2388, t2417, t2423, t2428, t2435, t2440, t2441, t2443; in func_pol() local
1546 t2435 = t334 * t74; in func_pol()
1555 …2 * t2428 * t60 + t769 * t897 * t129 / 0.822e3 - 0.4e1 / 0.411e3 * t291 * t2435 * t60 - t2440 - 0.… in func_pol()
1579 …0.411e3 * t2510 + t769 * t897 * t200 / 0.822e3 - 0.2e1 / 0.411e3 * t291 * t2435 * t91 + t821 * t89… in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 1912 double t2429, t2430, t2431, t2433, t2435, t2436, t2437, t2439; in func_pol() local
4250 t2435 = t1683 * t73; in func_pol()
4253 t2439 = t1680 * t2435 * t2437; in func_pol()
5072 t4440 = t1680 * t2435 * t4438; in func_pol()
6202 t6997 = t1680 * t2435 * t6995; in func_pol()
6204 t7001 = t1680 * t2435 * t6999; in func_pol()
6257 t7093 = t6290 * t2435 * t7004; in func_pol()
7335 t9980 = t1680 * t2435 * t9978; in func_pol()
7427 t10151 = t6290 * t2435 * t10149; in func_pol()
7712 t10800 = t1680 * t2435 * t10798; in func_pol()
[all …]
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| H A D | gga_c_tca.c | 868 double t2428, t2430, t2431, t2432, t2433, t2434, t2435, t2436; in func_pol() local
2104 t2435 = 0.16832053627399993457e0 * t2258; in func_pol()
2127 …v4rho3sigma[1] = t2430 - t2431 - t2432 - t2433 + t2434 - t2435 + t2436 - t2437 - t2438 - 0.6502767… in func_pol()
2172 …68939192e-1 * t2481 - 0.21675893235834469596e-1 * t2485 - t2577 + t2578 - t2435 + t2436 - t2437 - … in func_pol()
2206 …t2686 = t2430 - t2431 - t2432 - t2433 + t2434 - t2577 + t2578 - t2435 + t2436 - t2437 - t2438 - 0.… in func_pol()
2229 …v4rho3sigma[10] = t2430 - t2431 - t2432 - t2433 + t2434 - t2435 + t2436 - t2437 - t2438 - 0.563813… in func_pol()
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| H A D | gga_x_hcth_a.c | 694 double t2407, t2435, t2448, t2453, t2468, t2473, t2480, t2483; in func_pol() local
1683 t2435 = sigma[2] / t55 / t545; in func_pol()
1689 …t2483 = 0.11324444444444444444e1 * t59 * t619 * t63 + 0.53834666666666666666e1 * t2435 * t167 - 0.… in func_pol()
1691 …33 + t1737 - 0.3e1 / 0.8e1 * t7 * t52 * (0.24133004115226337449e0 * t21 * t2435 * t72 - 0.17035061… in func_pol()
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| H A D | gga_x_pbeint.c | 774 double t2395, t2397, t2403, t2409, t2415, t2420, t2424, t2435; in func_pol() local
1874 t2435 = t7 * t1746 * t1095; in func_pol()
1876 …t2454 = -t2420 / 0.6e1 - t7 * t89 * t51 * t2424 / 0.2e1 + t7 * t148 * t83 * t2424 / 0.2e1 + t2435 … in func_pol()
1897 …t2634 = -0.2e1 / 0.3e1 * t2420 + 0.4e1 / 0.27e2 * t2435 + 0.4e1 / 0.27e2 * t2438 + 0.2e1 / 0.3e1 *… in func_pol()
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| H A D | gga_k_apbeint.c | 759 double t2410, t2422, t2429, t2435, t2438, t2441, t2444, t2472; in func_pol() local
1847 t2435 = t333 * t338 * t1032; in func_pol()
1851 …0.3e1 + 0.2e1 / 0.3e1 * t2429 + t251 * t365 * t7 * t401 + 0.2e1 / 0.3e1 * t2435 + t2438 / 0.5e1 - … in func_pol()
1871 …t2661 = 0.8e1 / 0.3e1 * t2435 + 0.4e1 / 0.5e1 * t2438 + 0.4e1 / 0.3e1 * t251 * t88 * t997 * t156 +… in func_pol()
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| H A D | gga_c_lm.c | 849 double t2435, t2441, t2449, t2450, t2452, t2506, t2510, t2512; in func_pol() local
2166 t2435 = t374 * t1162; in func_pol()
2173 …e1 / 0.2e1 * t191 * t412 * t232 * t1007 - 0.4e1 * t2433 + 0.8e1 / 0.3e1 * t2435 + 0.3e1 / 0.4e1 * … in func_pol()
2217 …t2847 = -0.12e2 * t2423 - 0.6e1 * t2433 + 0.8e1 * t2435 - 0.3e1 / 0.2e1 * t2441 - 0.3e1 / 0.2e1 * … in func_pol()
2249 ….16e2 / 0.3e1 * t2737 + 0.9e1 / 0.2e1 * t2417 - 0.24e2 * t2423 + 0.16e2 * t2435 - 0.3e1 * t2441 + … in func_pol()
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| H A D | gga_c_regtpss.c | 2371 double t2427, t2429, t2430, t2432, t2435, t2437, t2441, t2442; in func_pol() local
4548 t2435 = t741 * t878; in func_pol()
4549 t2437 = t1026 * t755 * t2435; in func_pol()
4877 t3111 = t1026 * t1027 * t2435; in func_pol()
6378 t6505 = t2435 * t322; in func_pol()
6681 t7514 = t806 * t2328 * t808 * t2435; in func_pol()
6938 …77e2 * t1175 * t1165 * t6505 + 0.39512695097613069591e1 * t1175 * t2840 * t2435 + 0.11853808529283… in func_pol()
7081 t8844 = t3115 * t3101 * t2962 * t2435; in func_pol()
7174 t9241 = t806 * t2328 * t1049 * t2435; in func_pol()
7641 …1258 * t635 - t6856 + 0.42874018118069736972e-3 * t1024 * t1026 * t3720 * t2435 - 0.16006300097412… in func_pol()
[all …]
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| H A D | gga_c_am05.c | 908 double t2430, t2435, t2437, t2440, t2441, t2443, t2445, t2446; in func_pol() local
2041 t2435 = t157 * t1215; in func_pol()
2049 …10 + t1713 + t1716 + t1719 + 0.32530743900905219526e-1 * t1721 + 0.12e2 * t2435 - 0.12e2 * t2437 +… in func_pol()
2115 …710 + t1713 + t1716 + t1719 + 0.10843581300301739842e-1 * t1721 - 0.8e1 * t2435 - 0.8e1 * t2437 + … in func_pol()
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| H A D | gga_x_chachiyo.c | 1320 double t2429, t2430, t2431, t2432, t2433, t2434, t2435, t2436; in func_pol() local
3368 t2435 = 0.1e1 / t2434; in func_pol()
3369 t2436 = t1793 * t2435; in func_pol()
3378 t2445 = t1786 * t2435; in func_pol()
3434 t2506 = t1806 * t2435; in func_pol()
3454 … t116 * t2430 - 0.20e2 / 0.729e3 * t313 * t2528 * t521 + 0.64e2 / 0.19683e5 * t954 * t2435 * t2537; in func_pol()
3477 t2567 = t2435 * t1; in func_pol()
5029 t7981 = t5414 * t2435; in func_pol()
5388 t9997 = t2435 * t1701; in func_pol()
5408 …8 * t3234 * t10001 * t184 * t34 + 0.19e2 / 0.81e2 * t195 * t1857 * t241 * t2435 * t1 + t8655 * t25… in func_pol()
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| H A D | gga_x_gg99.c | 136 double t2435, t2436, t2441, t2444, t2448, t2451, t2455, t2474; in func_unpol() local
1106 t2436 = t2389 + t2435; in func_unpol()
3534 double t2429, t2430, t2431, t2433, t2434, t2435, t2436, t2437; in func_pol() local
5472 t2435 = t58 * t2434; in func_pol()
5473 t2436 = t2435 * t2347; in func_pol()
6116 t3553 = t2435 * t455 * t527; in func_pol()
6782 t4835 = t2435 * t1702 * t262; in func_pol()
7456 t6327 = t2435 * t6015; in func_pol()
9503 …66 * t1719 / 0.3e1 - 0.4e1 * t275 * t7851 * t6015 * t262 + 0.3e1 * t275 * t2435 * t1702 * t1278 - … in func_pol()
9506 …3e1 - t743 * t6330 - t275 * t561 * t1320 * t1681 + 0.4e1 / 0.3e1 * t177 * t2435 * t6015 * t183 + t… in func_pol()
[all …]
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| H A D | gga_c_lyp.c | 532 double t2432, t2435, t2436, t2438, t2439, t2441, t2444, t2446; in func_pol() local
1705 t2435 = t331 * t2432 * t908 / 0.9e1; in func_pol()
1749 …v3rho2sigma[0] = t2424 + t2429 + 0.2e1 * t2430 + t2435 + t2438 + 0.2e1 / 0.3e1 * t2441 + t2446 + 0… in func_pol()
1830 …v3rho2sigma[3] = t2424 + t2429 + t2430 + t2435 + t2438 + t2441 / 0.3e1 + t2446 + t2449 / 0.3e1 + t… in func_pol()
1879 …v3rho2sigma[6] = t2424 + t2429 + 0.2e1 * t2668 + t2435 + t2438 + 0.2e1 / 0.3e1 * t2671 + t2446 + 0… in func_pol()
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| H A D | gga_x_b88.c | 735 double t2435, t2440, t2445, t2450, t2455, t2477, t2488, t2512; in func_pol() local
1735 …t2435 = t847 + t855 - t859 + t738 + t758 - t1094 - 0.3e1 / 0.4e1 * t967 + 0.3e1 / 0.4e1 * t878 - t… in func_pol()
1737 v4rho4[3] = t2420 + t2424 + t2432 + t2435; in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1074 double t2434, t2435, t2437, t2445, t2447, t2449, t2473, t2477; in func_pol() local
2232 t2435 = t2434 / 0.3e1; in func_pol()
2235 …* t249 * t884 / 0.2e1 - t2427 / 0.2e1 - t7 * t110 * t995 * t191 / 0.2e1 + t2435 + 0.7e1 / 0.2e1 * … in func_pol()
2280 …t2833 = t2420 / 0.3e1 + t2435 - t2445 / 0.3e1 - 0.5e1 / 0.27e2 * t2173 - 0.5e1 / 0.27e2 * t2198 + … in func_pol()
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| H A D | gga_c_p86.c | 951 double t2406, t2408, t2413, t2418, t2424, t2425, t2435, t2443; in func_pol() local
2279 t2435 = t378 * t389 * t497 * t196; in func_pol()
2282 … t1854 - t1856 - 0.15e2 / 0.4e1 * t2166 + 0.3e1 * t2168 + 0.3e1 / 0.2e1 * t2435 - 0.15e2 / 0.2e1 *… in func_pol()
2318 …5 * t53 + t1847 + t1850 - t1852 + t1854 - t1856 + t2169 + 0.9e1 / 0.4e1 * t2435 - 0.45e2 / 0.8e1 *… in func_pol()
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| H A D | gga_x_q2d.c | 1139 double t2426, t2428, t2429, t2431, t2432, t2434, t2435, t2436; in func_pol() local
2824 t2435 = t2432 * t2434; in func_pol()
2825 t2436 = t1114 * t2435; in func_pol()
3573 … / 0.25165824e8 + 0.3e1 / 0.1024e4 * t186 * t1658 * t837 + t186 * t2846 * t2435 / 0.201326592e9 + … in func_pol()
3669 …832 / 0.131072e6 + 0.3e1 / 0.512e3 * t186 * t2168 * t837 + t186 * t4548 * t2435 / 0.50331648e8 - t… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_2.c | 866 double t2428, t2430, t2433, t2435, t2436, t2442, t2450, t2456; in func_pol() local
2108 t2435 = 0.1e1 / t438 / t2433; in func_pol()
2111 …/ 0.9e1 * t1427 * t1432 + 0.4e1 / 0.3e1 * t58 * t2430 + 0.40e2 / 0.81e2 * t2435 * t2436 - 0.16e2 /… in func_pol()
2338 … * t240 + 0.8e1 / 0.3e1 * t2055 * t432 * t435 + t4202 + 0.40e2 / 0.81e2 * t2435 * t392 * t1437 - 0… in func_pol()
2411 …* t2199 * t240 + 0.4e1 / 0.9e1 * t2194 * t435 + t4202 + 0.40e2 / 0.81e2 * t2435 * t1014 * t440 + 0… in func_pol()
2440 …1 * t427 * t2254 * t240 + 0.4e1 / 0.3e1 * t58 * t4684 + 0.40e2 / 0.81e2 * t2435 * t2257 * t242 + 0… in func_pol()
2468 … / 0.9e1 * t961 * t2254 + 0.4e1 / 0.3e1 * t58 * t4837 + 0.40e2 / 0.81e2 * t2435 * t4840 - 0.16e2 /… in func_pol()
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| H A D | lda_c_pk09.c | 2420 double t2434, t2435, t2437, t2438, t2439, t2441, t2442, t2443; in func_pol() local
4160 t2435 = t1224 * t2434; in func_pol()
4164 t2441 = t1258 - 0.2e1 * t2435 + t1260 + 0.2e1 / 0.3e1 * t2439; in func_pol()
4190 t2506 = t1330 - 0.1187931309903801598e2 * t2435 + t1332 + 0.39597710330126719933e1 * t2439; in func_pol()
4193 …t1541 + 0.51076760170689440000e0 * t2491 + t1543 - 0.3056501876701794e0 * t2435 + t1545 + 0.101883… in func_pol()
4196 …t1522 + 0.49234783862717706667e0 * t2491 + t1524 - 0.2946275542389858e0 * t2435 + t1526 + 0.982091… in func_pol()
4203 …1505 + 0.25538380085344749333e0 * t2491 + t1507 - 0.15282509383508946e0 * t2435 + t1509 + 0.509416… in func_pol()
4209 t2556 = t1290 - 0.156250e1 * t2435 + t1292 + 0.52083333333333333333e0 * t2439; in func_pol()
4216 …6e1 * t2487 + t1215 + 0.10694947305092268853e1 * t2491 + t1223 - 0.64e0 * t2435 + t1232 + 0.213333… in func_pol()
4219 t2582 = t1414 - 0.942121195869983724e0 * t2435 + t1416 + 0.31404039862332790800e0 * t2439; in func_pol()
[all …]
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| H A D | lda_c_vwn_4.c | 853 double t2411, t2417, t2423, t2426, t2428, t2429, t2435, t2443; in func_pol() local
1969 t2435 = t343 * t343; in func_pol()
1970 …28 * t2429 - 0.16e2 / 0.9e1 * t800 * t340 * t343 + 0.4e1 / 0.3e1 * t339 * t2435 + 0.16e2 / 0.9e1 *… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_tau_hcth.c | 1409 double t2434, t2435, t2436, t2439, t2443, t2447, t2451, t2454; in func_pol() local
2706 t2435 = t104 * t454; in func_pol()
2707 t2436 = t2435 * t1015; in func_pol()
2727 t2443 = t2435 * t1024; in func_pol()
3636 …[5] = -t5160 - 0.4e1 / 0.3e1 * t5161 - t969 * t5163 * t2148 / 0.6e1 - t969 * t2435 * t2152 / 0.2e1; in func_pol()
3659 … * t2181 / 0.6e1 + t2173 * t2435 * t2185 / 0.2e1 - t5196 / 0.2e1 - t969 * t5198 * t1015 / 0.2e1 - … in func_pol()
3677 … t969 * t5163 * t2211 / 0.6e1 - t969 * t5198 * t1024 - t969 * t2435 * t2217 - t969 * t2435 * t2220… in func_pol()
4158 v4rhosigmatau2[8] = -t969 * t2435 * t2496 / 0.2e1 - t5640 / 0.2e1; in func_pol()
4185 …v4rhosigmatau2[17] = -t5640 / 0.2e1 - t969 * t2435 * t2505 / 0.2e1 - 0.3e1 / 0.8e1 * t377 * t419 *… in func_pol()
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| H A D | mgga_x_pbe_gx.c | 1364 double t2374, t2398, t2399, t2406, t2409, t2416, t2429, t2435; in func_ferr() local
2214 t2435 = t1506 * t487; in func_ferr()
2219 …1 * t491 + 0.125e3 / 0.486e3 * t1633 * t1131 + 0.125e3 / 0.972e3 * t650 * t2435 + 0.10e2 / 0.9e1 *… in func_ferr()
2222 …t2435 + (-0.26392318244170096021e0 * t1036 - 0.98971193415637860078e0 * t1040 - 0.2537722908093278… in func_ferr()
2544 double t2424, t2426, t2427, t2428, t2430, t2431, t2433, t2435; in func_pol() local
4240 t2435 = t351 * t576; in func_pol()
4241 t2437 = t203 * t204 * t2435; in func_pol()
5847 t6703 = t203 * t572 * t2435; in func_pol()
5887 …* t634 * t2518 * t567 + t6927 + 0.50777450000000000000e-3 * t203 * t625 * t2435 - 0.13540653333333… in func_pol()
6231 …703266666666666666e-3 * t8905 + 0.10155490000000000000e-2 * t203 * t878 * t2435 - t8912 - 0.343779… in func_pol()
[all …]
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| H A D | mgga_x_mbrxh_bg.c | 15778 t2435 = t2434 * t648; in func_pol()
15781 t2438 = t2435 * t2437; in func_pol()
15968 t2717 = t2435 * t2716; in func_pol()
16116 t2948 = t2435 * t2947; in func_pol()
16891 t3951 = t2435 * t3950; in func_pol()
16983 t4087 = t2435 * t4086; in func_pol()
17168 t4319 = t2435 * t4318; in func_pol()
17849 t5174 = t2435 * t5173; in func_pol()
17913 t5282 = t2435 * t5281; in func_pol()
18181 t5598 = t2435 * t5597; in func_pol()
[all …]
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| H A D | mgga_x_m08.c | 103 double t2435, t2440, t2460, t2469, t2472, t2479, t2482, t2487; in func_unpol() local
822 …t2435 = t155 * (-0.19497235401641845081e-5 * t2415 * t861 + 0.11536045301808000000e-2 * t488 * t86… in func_unpol()
824 v3rhosigma2[0] = -t854 * t1164 / 0.4e1 - 0.3e1 / 0.16e2 * t154 * t2435; in func_unpol()
1165 …v4rho2sigma2[0] = -t1879 * t1164 / 0.12e2 - t854 * t2435 / 0.2e1 - 0.3e1 / 0.16e2 * t154 * t155 * … in func_unpol()
2752 double t2399, t2406, t2409, t2412, t2415, t2418, t2435, t2440; in func_pol() local
3952 t2435 = t108 * t2399; in func_pol()
3953 …322 + 0.72e2 * t2418 * t329 + 0.30e2 * t2418 * t70 + 0.200e3 * t2435 * t358 + 0.90e2 * t2435 * t94; in func_pol()
3959 …2418 + 0.6e1 * t1029 * t2449 + 0.132e3 * t106 * t2446 + 0.110e3 * t1078 * t2435 + 0.12e2 * t1089 *… in func_pol()
3961 …231 * t2406 + 0.110e3 * t145 * t2441 + 0.132e3 * t148 * t2446 + 0.200e3 * t2435 * t428 + 0.242e3 *… in func_pol()
3962 …t2435 + 0.72e2 * t1238 * t2409 + 0.12e2 * t124 * t2459 + 0.20e2 * t127 * t2415 + 0.30e2 * t130 * t… in func_pol()
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