| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_ssb_sw.c | 712 double t2376, t2404, t2414, t2428, t2433, t2453, t2459, t2473; in func_pol() local
1730 t2433 = 0.1e1 / t1077 / t79 * t1486 * t344; in func_pol()
1733 …e3 * t315 * t479 / t71 / t577 * t1080 + 0.2e1 / 0.2187e4 * t315 * t2428 * t2433 - 0.2618e4 / 0.243… in func_pol()
1807 …888e4 * t315 * t1074 * t1078 * t758 * t203 * t760 - t315 * t479 * t1092 * t2433 / 0.2916e4 + 0.154… in func_pol()
1869 ….3456e4 * t315 * t1268 * t1078 * t758 * t84 * t760 + t315 * t203 * t483 * t2433 / 0.7776e4 + 0.3e1… in func_pol()
1932 …7e1 / 0.3456e4 * t315 * t1357 * t1078 * t3019 * t75 - t315 * t84 * t579 * t2433 / 0.20736e5 + 0.11… in func_pol()
1977 …222 * t245 * (-t315 * t1411 * t1080 / 0.2304e4 + t315 * sigma[2] * t627 * t2433 / 0.55296e5 + 0.5e… in func_pol()
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| H A D | gga_x_sfat.c | 3064 double t2425, t2426, t2428, t2429, t2432, t2433, t2434, t2435; in func_pol() local
4472 t2433 = t4 * t2432; in func_pol()
4475 t2437 = t2433 * t185 * t2435; in func_pol()
4508 t2501 = t2433 * t185 * t2499; in func_pol()
4589 t2669 = t2433 * t185 * t2667; in func_pol()
4778 t3204 = t2433 * t185 * t3202; in func_pol()
5798 t5938 = t2433 * t624 * t2435; in func_pol()
5952 t6902 = t2433 * t624 * t2499; in func_pol()
5994 t7178 = t2433 * t624 * t2667; in func_pol()
6026 …t2433 * t185 * t964 * t637 / 0.9e1 - t618 * t185 * t970 * t637 / 0.6e1 - 0.7e1 / 0.9e1 * t7380 - t… in func_pol()
[all …]
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| H A D | gga_x_pbe.c | 528 double t2431, t2433, t2438, t2440, t2454, t2456, t2469, t2496; in func_pol() local
1573 t2433 = t282 * t958; in func_pol()
1577 …v4rho3sigma[2] = -t2429 / 0.36e2 - t2431 / 0.36e2 - t2433 / 0.12e2 + t2438 + t2440 * t124 * t380 *… in func_pol()
1604 …52 * t124 * t380 * t669 / 0.144e3 + t2531 * t124 * t380 * t674 / 0.72e2 - t2433 / 0.36e2 + t2438 -… in func_pol()
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| H A D | gga_x_n12.c | 1118 double t2412, t2413, t2416, t2421, t2430, t2433, t2463, t2464; in func_pol() local
2278 t2433 = t378 * t710; in func_pol()
2279 …9 * t2421 + 0.4e1 * t810 * t2430 + 0.12e2 * t814 * t2430 + 0.2e1 * t810 * t2433 - 0.2e1 * t681 * t… in func_pol()
2280 …0.3e1 * t324 * t2421 + 0.24e2 * t819 * t2430 + 0.6e1 * t814 * t2433 + 0.12e2 * t819 * t2433 - 0.6e… in func_pol()
2950 …t4976 = 0.72e2 * t1973 * t2430 + 0.36e2 * t1973 * t2433 + 0.36e2 * t1976 * t2430 + 0.18e2 * t4357 … in func_pol()
2977 …4927 - 0.72e2 * t1970 * t4946 + 0.18e2 * t1976 * t2433 + 0.12e2 * t1979 * t2430 + 0.6e1 * t1979 * … in func_pol()
3314 …2e2 * t3238 * t2430 + 0.4e1 * t3241 * t2430 + 0.6e1 * t3238 * t2433 + 0.2e1 * t3241 * t2433 - 0.2e… in func_pol()
3321 …t2421 - 0.3e1 * t1380 * t2421 + 0.24e2 * t3125 * t2430 + 0.12e2 * t3125 * t2433 - 0.4e1 * t3196 * … in func_pol()
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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
2102 t2433 = 0.20641498013057968718e-3 * t2248; in func_pol()
2127 …v4rho3sigma[1] = t2430 - t2431 - t2432 - t2433 + t2434 - t2435 + t2436 - t2437 - t2438 - 0.6502767… in func_pol()
2172 …t2581 = t2430 - t2431 - t2432 - t2433 + t2434 - 0.43351786471668939192e-1 * t2481 - 0.216758932358… 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_c_cs1.c | 732 double t2423, t2424, t2425, t2426, t2427, t2428, t2433, t2437; in func_pol() local
2009 t2433 = t517 * t1155; in func_pol()
2026 …v4rho3sigma[1] = 0.3e1 / 0.4e1 * t2433 + t2437 + t2441 + t2444 + t2453 + 0.58166666666666666665e-1… in func_pol()
2062 …11633333333333333333e0 * t2470 + 0.13533444444444444443e-1 * t2473 - t2477 + t2433 / 0.2e1 + t2437; in func_pol()
2102 …6666666666666664e-1 * t2470 + 0.67667222222222222217e-2 * t2473 - t2477 + t2433 / 0.4e1 + t2437 + … in func_pol()
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| H A D | gga_x_b86.c | 675 double t2425, t2433, t2442, t2451, t2479, t2485, t2486, t2498; in func_pol() local
1717 t2433 = t968 * t1019; in func_pol()
1721 …72 * t2367 * t776 / 0.9e1 + t2354 * t990 * t780 / 0.3e1 - 0.4e1 / 0.3e1 * t2433 - t972 * t239 * t4… in func_pol()
1735 …* t2507 + t2302 - 0.2e1 / 0.3e1 * t2361 - 0.2e1 / 0.3e1 * t2425 - 0.4e1 * t2433 - 0.2e1 * t2442 + … in func_pol()
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| H A D | gga_x_fd_lb94.c | 670 double t2411, t2414, t2415, t2417, t2430, t2433, t2446, t2458; in func_pol() local
1687 t2433 = 0.4e1 / 0.3e1 * t991 * t1024; in func_pol()
1689 …95 * t1013 * t704 / 0.6e1 + t1005 * t421 * t158 / 0.2e1 - t2430 / 0.6e1 - t2433 - t137 * t296 * t4… in func_pol()
1704 …+ 0.4e1 / 0.3e1 * t2415 - 0.2e1 / 0.9e1 * t2345 + t2352 - t2430 / 0.3e1 - t2433 - 0.2e1 / 0.9e1 * … in func_pol()
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| H A D | gga_x_am05.c | 894 double t2397, t2402, t2432, t2433, t2477, t2489, t2517, t2519; in func_ferr() local
1534 t2433 = t98 * t2225; in func_ferr()
1535 …t2477 = -t1209 * t2433 * t1460 / 0.20736e5 + t698 * t2433 * t1465 / 0.20736e5 + t792 * t2078 / 0.1… in func_ferr()
1713 double t2417, t2429, t2432, t2433, t2439, t2444, t2455, t2464; in func_pol() local
2963 t2433 = t206 * t2432; in func_pol()
2977 … * t911 / 0.288e3 + t853 * t887 / 0.6e1 - t199 * t2429 / 0.216e3 + t205 * t2433 / 0.216e3 + t199 *… in func_pol()
3728 …0.192e3 + t2530 * t4608 / 0.192e3 - t199 * t200 * t2815 / 0.36e2 + t366 * t2433 / 0.24e2 + t40 * t… in func_pol()
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| H A D | gga_xc_b97.c | 1727 double t2426, t2427, t2428, t2429, t2430, t2431, t2432, t2433; in func_pol() local
3686 t2433 = t2356 * t1070; in func_pol()
3687 t2434 = t2433 * t236; in func_pol()
5225 t5944 = t2433 * t545; in func_pol()
5346 t6272 = t2433 * t2115; in func_pol()
5664 t7059 = t2433 * t835; in func_pol()
6146 t8069 = t2433 * t1024; in func_pol()
7676 …8892190278239603e0 * t12979 + t10337 - 0.57896429720167256353e3 * t4313 * t2433 * t1068 - 0.600000… in func_pol()
7689 …000000000000000000e1 * t4357 * t5941 + 0.96494049533612093922e2 * t3456 * t2433 * t1150 + 0.4e1 * … in func_pol()
7974 …48247024766806046961e2 * t1067 * t2006 * t17931 - 0.28948214860083628176e3 * t3456 * t2433 * t6268; in func_pol()
[all …]
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| H A D | gga_c_lm.c | 848 double t2408, t2412, t2415, t2417, t2419, t2421, t2423, t2433; in func_pol() local
2165 t2433 = t377 * t1158; in func_pol()
2173 …t819 * t546 * t427 + 0.3e1 / 0.2e1 * t191 * t412 * t232 * t1007 - 0.4e1 * t2433 + 0.8e1 / 0.3e1 * … 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()
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| H A D | gga_x_ev93.c | 934 double t2401, t2414, t2420, t2423, t2430, t2433, t2441, t2454; in func_pol() local
2386 t2433 = t115 * t723 * t406; in func_pol()
2392 …t2463 = t2423 / 0.2e1 - 0.5e1 / 0.27e2 * t2097 * t116 * t185 * t773 - t2430 / 0.3e1 + t2433 - t292… in func_pol()
2456 …- t2414 / 0.9e1 + t2423 / 0.3e1 - 0.2e1 / 0.9e1 * t2430 + 0.2e1 / 0.3e1 * t2433 + 0.2e1 / 0.9e1 * … in func_pol()
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| H A D | gga_x_sogga11.c | 1454 double t2433, t2436, t2452, t2453, t2454, t2457, t2458, t2459; in func_pol() local
2602 t2433 = t490 * t1182; in func_pol()
2604 …24 * t2385 / 0.128e3 + t2427 * t2375 / 0.768e3 + t2430 * t2380 / 0.96e2 - t2433 * t2385 / 0.64e2 +… in func_pol()
3237 …2391 * t5260 / 0.24e2 - t2427 * t5257 / 0.96e2 - t2430 * t5249 / 0.12e2 + t2433 * t5253 / 0.8e1 - … in func_pol()
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| H A D | gga_x_ft97.c | 1071 double t2396, t2402, t2407, t2410, t2412, t2414, t2422, t2433; in func_pol() local
2274 …t2433 = -t1079 - t1082 / 0.9e1 - t1085 / 0.3e1 - t1088 / 0.9e1 - 0.2e1 / 0.3e1 * t1091 - t1094 / 0… in func_pol()
2304 v4rho4[2] = t2422 + t2433 + t2448 + t2666; in func_pol()
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| H A D | gga_c_q2d.c | 2929 t2433 = t427 * t238; in func_ferr()
2930 t2434 = t2433 * t78; in func_ferr()
7235 t2433 = t148 * t767; in func_pol()
7236 t2434 = t2433 * t462; in func_pol()
7537 t2892 = t2433 * t694; in func_pol()
10208 t7932 = t2433 * t1237; in func_pol()
10214 t7944 = t2433 * t1258; in func_pol()
10831 t8979 = t2433 * t8978; in func_pol()
10836 t8990 = t2433 * t1848; in func_pol()
11292 t9703 = t2433 * t2160; in func_pol()
[all …]
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| H A D | gga_c_zvpbeloc.c | 2099 double t2413, t2421, t2422, t2425, t2426, t2429, t2432, t2433; in func_pol() local
4282 t2433 = t2432 * t145; in func_pol()
4283 t2435 = t340 * t341 * t2433; in func_pol()
4309 t2498 = t381 * t2433; in func_pol()
6600 …1 * t4275 * t2473 + 0.24e2 * t333 * t2507 * t2015 - 0.4e1 * t333 * t930 * t2433 - 0.36e2 * t3152 *… in func_pol()
6809 …* t3152 * t1182 * t2011 + 0.24e2 * t8632 * t1182 * t8633 - t333 * t1195 * t2433 - 0.3e1 * t333 * t… in func_pol()
6899 …5e2 / 0.192e3 * t9118 - t7530 * t1140 / 0.1024e4 - t686 * t1102 * t1103 * t2433 / 0.3072e4 - 0.7e1… in func_pol()
6957 …66 * t3057 / 0.256e3 + 0.595e3 / 0.2592e4 * t9390 + t686 * t688 * t1148 * t2433 / 0.768e3 - t2478 … in func_pol()
7756 t14149 = t1465 * t336 * t2433; in func_pol()
7824 …139 * t148 * t14263 - 0.24674011002723396548e-1 * t14267 - t333 * t1517 * t2433 - t14272 + 0.6e1 *… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 2159 double t2364, t2371, t2375, t2379, t2382, t2391, t2405, t2433; in func_ferr() local
3125 t2433 = t583 * t1458; in func_ferr()
3379 …t2433 * t2779 + t2433 * t2776 / 0.3e1 - 0.4e1 * t2433 * t3242 + 0.6e1 * t3562 * t3246 + 0.2e1 * t2… in func_ferr()
3490 …50 - t183 * t3853 + 0.2e1 * t584 * t1179 * t4213 + t672 + t2433 * t3892 / 0.3e1 - 0.4e1 * t2433 * … in func_ferr()
3535 … * t93 * t4636 + 0.2e1 * t3575 * t93 * t4635 * t250 + t2433 * t289 * t4636 / 0.3e1 - 0.2e1 * t2433… in func_ferr()
3765 … - t4906 - t5190 + t5191 + t672 + 0.4e1 * t2436 * t5193 - 0.6e1 * t2433 * t5198 + t2433 * t5196 + … in func_ferr()
3884 …3e1 * t2433 * t289 * t5826 - t3546 * t1415 * t5814 / 0.9e1 + 0.2e1 * t2436 * t5599 + 0.2e1 * t3575… in func_ferr()
3926 …05 - t5596 + t5597 - 0.2e1 * t2433 * t302 * t6192 + 0.2e1 * t2436 * t93 * t6192 + 0.2e1 * t3575 * … in func_ferr()
4014 …e1 * t4555 * t1141 * t951 - t6226 - 0.2e1 * t2433 * t302 * t6956 + 0.2e1 * t3575 * t93 * t4635 * t… in func_ferr()
4202 double t2419, t2423, t2431, t2433, t2437, t2440, t2443, t2444; in func_pol() local
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_vt84.c | 147 double t2417, t2419, t2420, t2422, t2424, t2427, t2430, t2433; in func_unpol() local
1392 t2433 = t36 * t36; in func_unpol()
1393 t2434 = 0.1e1 / t2433; in func_unpol()
3102 t13628 = 0.1e1 / t38 / t2433; in func_unpol()
6638 double t2433, t2437, t2438, t2441, t2442, t2447, t2452, t2455; in func_pol() local
8484 t2433 = t487 * t2401; in func_pol()
12843 t19708 = t1288 * t2433; in func_pol()
12862 …0e-4 * t14665 * t1704 * t4294 - t492 * t4466 * t781 - t4538 * t2433 - 0.2e1 * t5208 * t2433 - 0.20… in func_pol()
14165 …000000000000000e-3 * t7428 * t6700 + 0.74520000000000000000e-3 * t21617 * t2433 - t27981 * t490 + … in func_pol()
14673 …0.3e1 * t2402 * t2214 + 0.10e2 / 0.81e2 * t7868 * t1991 - 0.6e1 * t8270 * t2433 - 0.6e1 * t25655 *… in func_pol()
[all …]
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| H A D | mgga_c_m06l.c | 181 double t2429, t2430, t2432, t2433, t2435, t2436, t2437, t2439; in func_unpol() local
1633 t2433 = t914 * t2432; in func_unpol()
4667 t2433 = t2431 * t2432; in func_ferr()
8617 t2433 = t2432 * t46; in func_pol()
8737 t2656 = t2433 * t118; in func_pol()
11071 t6671 = t2433 * t522; in func_pol()
11364 t7330 = t2433 * t785; in func_pol()
13663 t11583 = t2433 * t1128; in func_pol()
13683 t11620 = t2433 * t1132; in func_pol()
13696 t11643 = t2433 * t1181; in func_pol()
[all …]
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| H A D | mgga_xc_b98.c | 1614 t2433 = t1439 * t9; in func_unpol()
1615 t2434 = t2433 * t2316; in func_unpol()
1676 t2550 = t2433 * t2460; in func_unpol()
1767 t2755 = t2433 * t2680; in func_unpol()
2483 t6245 = t2433 * t6105; in func_unpol()
2606 t6898 = t2433 * t6741; in func_unpol()
8441 t2433 = t372 * t2432; in func_pol()
8442 t2434 = t348 * t2433; in func_pol()
11420 t8029 = t1047 * t2433; in func_pol()
11424 t8033 = t1192 * t2433; in func_pol()
[all …]
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| H A D | mgga_c_cs.c | 748 double t2429, t2433, t2436, t2438, t2447, t2454, t2472, t2478; in func_pol() local
2326 t2433 = t856 * t159; in func_pol()
2329 …866666666663e-2 * t2134 - 0.34327639999999999998e-1 * t2136 - 0.14754e0 * t2433 - 0.4918e-1 * t243… in func_pol()
2368 …t2776 = -0.19672e0 * t2429 - 0.79868975733333333327e-2 * t2134 - 0.59016e0 * t2433 - 0.19672e0 * t… in func_pol()
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| H A D | mgga_x_gvt4.c | 1358 double t2429, t2431, t2433, t2435, t2437, t2439, t2441, t2443; in func_pol() local
3049 t2433 = t1793 * t1099; in func_pol()
3056 …t2471 = -0.2e1 / 0.3e1 * t2216 + 0.4e1 / 0.9e1 * t2431 - 0.8e1 / 0.81e2 * t2433 - 0.8e1 / 0.81e2 *… in func_pol()
3094 …2618 + t64 * (t2670 + t2724) + 0.16e2 / 0.9e1 * t2431 - 0.32e2 / 0.81e2 * t2433 - 0.32e2 / 0.81e2 … in func_pol()
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| H A D | mgga_x_tm.c | 119 double t2391, t2392, t2407, t2408, t2415, t2425, t2428, t2433; in func_unpol() local
1051 t2433 = t748 * t254; in func_unpol()
1067 …t2469 = -0.27e2 / 0.100e3 * t1325 * t748 + 0.171e3 / 0.1000e4 * t1156 * t2433 - 0.27e2 / 0.100e3 *… in func_unpol()
1648 …t6521 = 0.3e1 * t210 * t1868 + 0.171e3 / 0.1000e4 * t3233 * t2433 + 0.3e1 * t699 * t525 + 0.3e1 * … in func_unpol()
1658 …t6613 = -0.27e2 / 0.100e3 * t1160 * t2436 - 0.4959e4 / 0.10000e5 * t3242 * t2433 * t195 - 0.27e2 /… in func_unpol()
1889 …t9116 = -0.4959e4 / 0.10000e5 * t3242 * t301 * t2433 + 0.972e3 * t1753 * t2679 + 0.162e3 * t1753 *… in func_unpol()
2134 double t2419, t2422, t2423, t2424, t2427, t2430, t2433, t2434; in func_ferr() local
3061 t2433 = t199 * t673; in func_ferr()
3062 t2434 = 0.6e1 * t2433; in func_ferr()
3827 …t8636 = (0.6e1 * t8623 + 0.8e1 * t2433 + t675 + 0.108e3 * t8599 + 0.54e2 * t8627 + 0.72e2 * t2394 … in func_ferr()
[all …]
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| H A D | mgga_x_pbe_gx.c | 2544 double t2424, t2426, t2427, t2428, t2430, t2431, t2433, t2435; in func_pol() local
4239 t2433 = t203 * t572 * t885; in func_pol()
4246 …t10 * (-t2417 - t2421 - t2424 + t2427 + t2431 + 0.33851633333333333334e-3 * t2433 + t2438 - t2441); in func_pol()
4303 …* t2524 - 0.50777450000000000000e-3 * t2528 + 0.16925816666666666667e-3 * t2433 - t2441 + 0.507774… in func_pol()
5852 …+ t6660 + 0.50777450000000000000e-3 * t2430 + 0.10155490000000000000e-2 * t2433 + 0.15233235000000… in func_pol()
5903 …7703266666666666666e-3 * t2516 + t2752 - t7022 + t2431 + 0.67703266666666666667e-3 * t2433 + t2438; in func_pol()
5922 …3333333e-2 * t2516 + 0.67703266666666666667e-3 * t2524 - t7022 + 0.33851633333333333333e-3 * t2433; 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
2107 t2433 = t60 * t60; in func_pol()
2108 t2435 = 0.1e1 / t438 / t2433; in func_pol()
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