/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_op_pw91.c | 2150 t2259 = t507 * t282; in func_pol() 2151 t2260 = t2259 * t309; in func_pol() 2210 t2436 = t2259 * t354; in func_pol() 3662 t8397 = t2259 * t833; in func_pol() 3722 t8823 = t2259 * t910; in func_pol() 3723 t8827 = t2259 * t862; in func_pol() 3727 t8837 = t2259 * t867; in func_pol() 3766 t9142 = t2259 * t914; in func_pol() 4190 t12010 = t2259 * t1019; in func_pol() 4203 t12099 = t2259 * t977; in func_pol() [all …]
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H A D | gga_xc_th2.c | 484 double t2229, t2248, t2252, t2253, t2256, t2259, t2262, t2265; in func_pol() local 1384 t2259 = t958 * t188; in func_pol() 1392 …50 + 0.60240942361111111110e-1 * t2256 * t50 - 0.18096311111111111111e0 * t2259 * t191 + 0.1049277… in func_pol() 1435 …7 + 0.20484160000000000000e-2 * t2503 * t87 - 0.90481555555555555555e-1 * t2259 * t274 + 0.5246388… in func_pol() 1995 ….39039703125000000000e0 * t2168 * t348 * t50 - 0.27144466666666666666e0 * t2259 * t496 + 0.1573916… in func_pol() 2048 …7 - 0.30160518518518518518e0 * t4787 * t2392 - 0.18096311111111111111e0 * t2259 * t495 + 0.1748796… in func_pol() 2101 … - 0.20484160000000000000e-2 * t2265 * t820 - 0.90481555555555555555e-1 * t2259 * t820 + 0.8743981… in func_pol()
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H A D | gga_xc_b97.c | 116 double t2175, t2189, t2231, t2259, t2265, t2268, t2274, t2279; in func_unpol() local 854 t2259 = t1765 * t59; in func_unpol() 862 …t2259 + 0.10342716049382716049e1 * t14 * t1771 * t24 + 0.66054320987654320988e-1 * t30 * t2265 + 0… in func_unpol() 1716 double t2235, t2237, t2249, t2252, t2255, t2258, t2259, t2260; in func_pol() local 3597 t2259 = t2258 * t471; in func_pol() 3598 t2260 = t2259 * t188; in func_pol() 5065 t5491 = t2259 * t503; in func_pol() 5226 t5949 = t2259 * t470; in func_pol() 5320 t6226 = t2259 * t2108; in func_pol() 5756 t7170 = t2259 * t7169; in func_pol() [all …]
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H A D | gga_x_lsrpbe.c | 611 double t2259, t2262, t2266, t2284, t2287, t2290, t2294, t2308; in func_pol() local 1539 t2259 = t7 * t80 * t929; in func_pol() 1543 … t153 * t702 * t161 * t488 / 0.9e1 - t987 * t988 * t497 / 0.2e1 - 0.4e1 * t2259 - 0.2e1 * t2262 + … in func_pol() 1565 … - t987 * t988 * t689 / 0.6e1 - t997 * t381 * t405 * t8 - 0.4e1 / 0.3e1 * t2259 - 0.2e1 / 0.3e1 * … in func_pol()
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H A D | gga_c_tca.c | 857 double t2253, t2256, t2258, t2259, t2261, t2262, t2263, t2267; in func_pol() local 2010 t2259 = 0.84160268136999967288e-1 * t2258; in func_pol() 2097 …v4rho3sigma[0] = t2238 - t2241 - t2246 - t2249 + t2252 - t2259 + t2262 - t2268 - t2273 - 0.3251383… in func_pol() 2142 … - 0.37587547805703561043e-2 * t2490 + 0.22542928965267848382e0 * t2493 - t2259 + t2262 - t2268 - … in func_pol() 2191 … - 0.37587547805703561042e-2 * t2490 + 0.22542928965267848380e0 * t2493 - t2259 + t2262 - t2268 - … in func_pol() 2223 …v4rho3sigma[9] = t2238 - t2241 - t2246 - t2249 + t2252 - t2259 + t2262 - t2268 - t2273 - 0.2819066… in func_pol()
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H A D | gga_x_bayesian.c | 830 double t2236, t2243, t2250, t2253, t2259, t2262, t2265, t2268; in func_pol() local 1870 t2259 = t7 * t680 * t412; in func_pol() 1875 …50 / 0.3e1 + t2253 / 0.27e2 + t7 * t1916 * t157 / 0.3e1 + 0.2e1 / 0.9e1 * t2259 + t2262 / 0.9e1 + … in func_pol() 1887 …/ 0.2e1 - t2243 / 0.6e1 - t2250 / 0.2e1 + t2253 / 0.9e1 + 0.2e1 / 0.3e1 * t2259 + t2262 / 0.3e1 + … in func_pol() 1913 …3e1 * t881 * t348 * t395 * t401 + 0.2e1 / 0.9e1 * t2253 + 0.4e1 / 0.3e1 * t2259 + 0.2e1 / 0.3e1 * … in func_pol()
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H A D | gga_k_lc94.c | 999 double t2184, t2189, t2204, t2216, t2227, t2252, t2259, t2261; in func_pol() local 2090 t2259 = t183 * t2115 * t200; in func_pol() 2091 … t1963 - t2252 / 0.15e2 - t6 * t1017 * t248 - 0.2e1 / 0.3e1 * t422 * t2133 - 0.2e1 / 0.9e1 * t2259; in func_pol() 2126 …422 * t1098 * t459 + t323 * t114 * t1124 * t119 / 0.3e1 - 0.2e1 / 0.3e1 * t2259 - t2263 / 0.3e1 - … in func_pol() 2170 …* t1153 + 0.8e1 / 0.3e1 * t2467 + 0.8e1 / 0.3e1 * t2473 - 0.4e1 / 0.3e1 * t2259 - 0.2e1 / 0.3e1 * … in func_pol()
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H A D | gga_x_mpbe.c | 790 double t2214, t2219, t2221, t2259, t2270, t2295, t2311, t2320; in func_pol() local 1802 t2259 = t462 * t1925 * t1043; in func_pol() 1803 …t493 * t341 / 0.6e1 + t946 * t463 * t498 * t427 / 0.9e1 - 0.7e1 / 0.9e1 * t2259 - t1919 / 0.9e1 + … in func_pol() 1822 …90 / 0.6e1 + t2197 / 0.9e1 - t2200 / 0.3e1 - t2207 / 0.6e1 + t2214 / 0.9e1 + t2259 / 0.3e1 + t1966; in func_pol()
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H A D | gga_x_sg4.c | 749 double t2178, t2221, t2228, t2237, t2250, t2259, t2263, t2282; in func_pol() local 1751 …t2259 = -0.5e1 / 0.27e2 * t1766 * t375 * t1031 * t149 + t1943 / 0.9e1 - t1950 / 0.3e1 + t1957 / 0.… in func_pol() 1762 …t2340 = t9 * (t2237 + t2259 + t2314 + t2335) + t1026 + t1035 - t999 - t1003 - t1007 - t1011 - t101… in func_pol()
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H A D | gga_x_hjs_b88_v2.c | 1168 t2259 = t2258 * t210; in func_unpol() 4373 t2259 = t278 * t112; in func_ferr() 9183 t2259 = t384 * t335; in func_pol() 9184 t2261 = t672 * t2259 * t675; in func_pol() 9444 t2939 = t672 * t2259 * t895; in func_pol() 10415 t5963 = t2100 * t2259 * t2102; in func_pol() 10421 t5984 = t672 * t2259 * t2118; in func_pol() 11998 t10393 = t2100 * t2259 * t3427; in func_pol() 12000 t10400 = t672 * t2259 * t3436; in func_pol() 14745 t21281 = t672 * t2259 * t5939; in func_pol() [all …]
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H A D | gga_x_ncap.c | 117 double t2251, t2254, t2259, t2262, t2263, t2267, t2314, t2334; in func_unpol() local 889 t2259 = t589 * t1001; in func_unpol() 890 …t2251 + 0.32e2 / 0.81e2 * t1950 * t2254 - 0.64e2 / 0.9e1 * t1955 * t1269 - 0.768e3 * t1931 * t2259; in func_unpol() 970 …9e1 + 0.2e1 * t2815 * t1032 - 0.192e3 * t2243 * t2251 + 0.384e3 * t2243 * t2259 - 0.192e3 * t2243 … in func_unpol() 1034 … 0.16e2 * t56 * t57 * (-0.3e1 / 0.8e1 * t3476 * t1032 - 0.108e3 * t2797 * t2259 + 0.54e2 * t2797 *… in func_unpol() 2241 double t2249, t2250, t2252, t2256, t2258, t2259, t2263, t2266; in func_pol() local 3515 t2259 = t2258 * t557; in func_pol() 3520 …v3rho2sigma[5] = -0.2e1 / 0.3e1 * t2220 - t2224 - 0.2e1 / 0.3e1 * t2256 - t2240 * t2259 / 0.6e1 + … in func_pol() 4394 t5996 = 0.4e1 / 0.9e1 * t5973 * t2259; in func_pol()
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H A D | gga_c_pbe_vwn.c | 1959 double t2259, t2260, t2261, t2262, t2263, t2264, t2265, t2266; in func_pol() local 3632 t2259 = 0.50631328524251801694e2 * t2258; in func_pol() 3655 …955426118383e-2 * t318 * t786 + 0.22478670955426118383e-2 * t2247 * t82 - t2259 - t2265 - t2272 + … in func_pol() 3659 …t2291 = t2026 - t2030 + t2034 + t2036 + t2038 + t2077 + t2079 - t2081 + t2290 + t2259 + t2265 + t2… in func_pol() 3750 …- t2030 + t2034 + t2036 + t2038 + t2077 + t2079 - t2081 + t2290 + t2509 + t2259 + t2265 + t2272 - … in func_pol() 3917 …- t2030 + t2034 + t2036 + t2038 + t2077 - t2824 - t2825 + t2827 + t2290 + t2259 + t2265 + t2272 - … in func_pol() 3964 …t2994 = t2077 - t2824 - t2825 + t2827 + t2290 + 0.6e1 * t2992 + t2259 + t2265 + t2272 - t2280 + t2… in func_pol() 4091 …- t2030 + t2034 + t2036 + t2038 + t2077 + t3153 + t2825 + t3154 + t2290 + t2259 + t2265 + t2272 - … in func_pol() 4135 t3418 = t3153 + t2825 + t3154 + t2290 - t3157 + t2259 + t2265 + t2272 - t2280 + t2285 + t3417; in func_pol() 4188 …t3512 = t2038 + t2077 + t2081 + t3499 + t2290 - t3502 - t3504 - t3506 - t3511 + t2259 + t2265 + t2… in func_pol() [all …]
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H A D | gga_x_ityh.c | 123 double t2230, t2236, t2242, t2258, t2259, t2263, t2266, t2270; in func_unpol() local 949 t2259 = t2258 * t2056; in func_unpol() 963 …* t279 * t338 - 0.9e1 * t962 * t67 * t947 * t957 + 0.81e2 * t962 * t963 * t2259 - 0.2e1 * t360 * t… in func_unpol() 976 …44 + 0.6e1 * t408 * t371 + 0.6e1 * t161 * t1005 - 0.810e3 * t953 * t954 * t2259 - 0.90e2 * t2263 *… in func_unpol() 977 …t1039 + 0.448e3 / 0.81e2 * t44 * t1011 * t183 + 0.1080e4 * t953 * t1052 * t2259 + 0.120e3 * t2263 … in func_unpol() 2527 double t2253, t2256, t2259, t2261, t2263, t2264, t2266, t2268; in func_pol() local 3836 t2259 = t497 * t507 * t806; in func_pol() 3847 …t2279 = -t2250 / 0.3e1 - t2253 / 0.6e1 - t2256 / 0.18e2 - t2259 / 0.6e1 - t2099 - t1947 + t2263 + … in func_pol() 4971 …95 - 0.2e1 / 0.3e1 * t2246 - 0.2e1 / 0.3e1 * t2250 - t2253 / 0.3e1 - t2256 / 0.9e1 - t2259 / 0.3e1; in func_pol() 5018 …t6375 = -t2256 / 0.3e1 - t2259 / 0.2e1 - t2098 - t4817 - t2361 + 0.3e1 * t2263 + 0.3e1 * t2266 - 0… in func_pol()
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H A D | gga_x_bpccac.c | 1439 double t2232, t2234, t2239, t2240, t2242, t2252, t2255, t2259; in func_pol() local 2583 t2259 = t971 * t213; in func_pol() 2586 …201 * t2273 - t213 * t2242 + t2240 * t77 + 0.4e1 * t2255 * t506 + 0.2e1 * t2259 * t506 - t501 * t9… in func_pol() 3117 …59 + 0.2e1 * t506 * t521 * t971 + 0.8e1 * t1160 * t2255 + 0.4e1 * t1160 * t2259 + 0.8e1 * t1848 * … in func_pol() 3222 …2 * t4328 * t2252 + 0.12e2 * t1848 * t2255 - 0.3e1 * t1845 * t971 + 0.6e1 * t1848 * t2259 + t5696); in func_pol()
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H A D | gga_x_lag.c | 812 double t2248, t2259, t2265, t2266, t2268, t2269, t2271, t2275; in func_pol() local 2569 t2259 = t173 * t179 * t572; in func_pol() 2579 …6146807406580e-4 * t608 * t59 * t175 * t200 - 0.40097346146807406580e-4 * t2259 - 0.40097346146807… in func_pol() 2683 …* t2235 - 0.10024336536701851645e-4 * t2248 - 0.10024336536701851645e-4 * t2259 + 0.25060841341754… in func_pol()
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H A D | gga_c_gaploc.c | 157 double t2259, t2260, t2263, t2266, t2269, t2270, t2271, t2272; in func_unpol() local 1411 t2259 = t1063 * t138; in func_unpol() 1412 t2260 = t2259 * t535; in func_unpol() 1812 t3319 = t2259 * t1228; in func_unpol() 1822 t3349 = t2259 * t1218; in func_unpol() 3158 double t2249, t2250, t2251, t2254, t2255, t2258, t2259, t2260; in func_ferr() local 4416 t2259 = t157 * t2258; in func_ferr() 9341 t2259 = t1167 * t2258; in func_pol() 9342 t2260 = t2259 * t1173; in func_pol() 9343 t2262 = t2259 * M_PI; in func_pol() [all …]
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H A D | gga_c_lm.c | 842 double t2259, t2267, t2269, t2270, t2271, t2273, t2275, t2276; in func_pol() local 2107 …t2259 = -t1824 + 0.616e3 / 0.9e1 * t1826 - t1830 + 0.22e2 * t1861 + t1865 - 0.6e1 * t1866 + 0.12e2… in func_pol() 2125 …t2307 = t2003 + t1944 - t1947 + t1941 + t2042 / 0.144e3 + t68 * t69 * (t2220 + t2246 + t2259 + t22… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_lta.c | 792 double t2259, t2260, t2273, t2282, t2299, t2302, t2303, t2306; in func_pol() local 2308 t2259 = t64 * t2 * t112; in func_pol() 2309 t2260 = t2259 * t309; in func_pol() 2315 t2299 = t2259 * t314; in func_pol() 2320 t2324 = t2259 * t319; in func_pol() 2574 t2484 = t2259 * t325 / 0.6e1; in func_pol() 2579 t2512 = t2259 * t328 / 0.6e1; in func_pol() 2588 t2533 = t2259 * t334 / 0.6e1; in func_pol() 2590 t2545 = t2259 * t337 / 0.6e1; in func_pol()
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H A D | mgga_xc_cc06.c | 1073 double t2235, t2238, t2239, t2242, t2254, t2258, t2259, t2263; in func_pol() local 2426 t2259 = t2258 * t870; in func_pol() 2429 …t2259 * t251 - 0.26000000000000000000e-3 * t656 * t2194 * t2263 + 0.18493142438399490044e-5 * t871… in func_pol() 3577 …t2259 * t2141 - 0.60666666666666666667e-3 * t5817 * t1259 * t251 * t1972 + 0.61643808127998300145e… in func_pol() 3599 …5283198895094e-4 * t1287 * t2259 * t290 - 0.40068475283198895094e-4 * t2304 * t5839 * t286 - 0.123… in func_pol() 4097 …v4rholapl3[6] = t6110 + t276 * t2309 + t232 * (-0.61643808127998300147e-5 * t2259 * t2301 + 0.6164… in func_pol()
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H A D | mgga_x_scan.c | 1110 t2259 = 0.1e1 / t21 / t127; in func_unpol() 1111 t2260 = t19 * t2259; in func_unpol() 1500 t5979 = t50 * t2259; in func_unpol() 4824 t2259 = t212 * t402; in func_pol() 4825 t2261 = t313 * t2259 * t316; in func_pol() 4920 t2434 = t313 * t2259 * t333; in func_pol() 7018 t6715 = t313 * t2259 * t806; in func_pol() 7028 t6745 = t795 * t2259 * t797; in func_pol() 7088 t7131 = t795 * t2259 * t841; in func_pol() 7166 t7524 = t313 * t2259 * t902; in func_pol() [all …]
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H A D | mgga_x_gdme.c | 788 double t2229, t2253, t2256, t2257, t2259, t2261, t2263, t2265; in func_pol() local 2310 t2259 = t98 * t921; in func_pol() 2315 …2 / 0.27e2 * t2253 - t2256 - 0.20e2 / 0.81e2 * t2257 + 0.160e3 / 0.81e2 * t2259 + 0.16e2 / 0.81e2 … in func_pol() 2330 …/ 0.81e2 * t2253 - t2256 - 0.40e2 / 0.243e3 * t2257 + 0.160e3 / 0.243e3 * t2259 + 0.16e2 / 0.243e3… in func_pol()
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H A D | mgga_k_pc07.c | 140 double t2253, t2258, t2259, t2267, t2268, t2271, t2272, t2278; in func_unpol() local 1402 t2259 = t2203 + t2258; in func_unpol() 1471 t2520 = -t2259; in func_unpol() 1477 t2538 = t143 * t2259; in func_unpol() 1486 …t2589 = t96 * (t140 * t806 + t745 * t167 + t195 * t633 + t563 * t214 + t2259 * t89 + t234 * t532 +… in func_unpol() 2567 t7812 = t331 * t2259; in func_unpol() 2572 t7838 = t340 * t2259; in func_unpol() 3357 t13270 = t464 * t2259; in func_unpol() 3377 t13394 = t82 * t2259; in func_unpol() 4062 double t2252, t2253, t2254, t2259, t2264, t2272, t2276, t2279; in func_ferr() local [all …]
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H A D | mgga_c_vsxc.c | 1368 t2259 = t1343 * t2258; in func_unpol() 1369 t2260 = t1348 * t2259; in func_unpol() 1372 t2265 = t1354 * t2259; in func_unpol() 1376 t2272 = t1342 * t2259; in func_unpol() 5355 t2260 = t339 * t2259; in func_pol() 5361 t2273 = t357 * t2259; in func_pol() 5367 t2292 = t378 * t2259; in func_pol() 7845 t7052 = t1489 * t2259; in func_pol() 7847 t7056 = t1511 * t2259; in func_pol() 8815 t8786 = t2285 * t2259; in func_pol() [all …]
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H A D | mgga_x_mvs.c | 99 double t2162, t2168, t2224, t2231, t2238, t2242, t2246, t2259; in func_unpol() local 831 t2259 = t90 * t942; in func_unpol() 835 … t758 * t1928 - 0.25e2 / 0.72e2 * t845 * t1818 - 0.5e1 / 0.288e3 * t128 * t2259 - 0.25e2 / 0.144e3… in func_unpol() 853 …0.36e2 * t1061 - 0.25e2 / 0.48e2 * t845 * t1928 + 0.5e1 / 0.12e2 * t156 * t2259 + 0.25e2 / 0.64e2 … in func_unpol() 1979 double t2257, t2258, t2259, t2260, t2262, t2263, t2264, t2265; in func_pol() local 3608 t2259 = t2258 / 0.4608e4; in func_pol() 3658 …t2346 = t2241 - t2242 - t2069 + t2247 - t2252 + t2254 + t2259 + t2264 - t2266 + t2267 - t2336 - t2… in func_pol() 5054 …t6234 = t2170 / 0.73728e5 - t2176 / 0.864e3 - t5616 + t2247 - t2252 + t2254 + t2259 + t2264 - t226… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_x_erf.c | 488 double t2247, t2248, t2251, t2253, t2255, t2257, t2259, t2261; in func_pol() local 1600 t2259 = t115 * t116 * t2257; in func_pol() 1713 …t2617 = -t2259 / 0.4e1 - t2263 / 0.24e2 - t2267 - 0.3e1 / 0.32e2 * t2589 - t2594 + t2597 / 0.36e2 … in func_pol() 2645 …t6613 = -0.3e1 / 0.4e1 * t2259 - t1792 - t1796 - t1800 - t2263 / 0.8e1 - t6604 - t1804 - t1808 - 0… in func_pol() 2906 … t2244 - t2247 / 0.3e1 - t1779 / 0.6e1 - t1782 / 0.12e2 - t2253 / 0.4e1 - t2259 / 0.2e1 - t2263 / … in func_pol()
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