/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_xc_th2.c | 481 double t2067, t2069, t2090, t2101, t2114, t2132, t2135, t2138; in func_pol() local 1354 …t2090 = 0.160e3 / 0.27e2 * t2040 + 0.80e2 / 0.3e1 * t2043 + 0.16e2 / 0.3e1 * t2046 - 0.2464e4 / 0.… in func_pol() 1355 … * t67 * t2090 - 0.72032600000000000000e-1 * t78 * t2090 - 0.23044680000000000000e-2 * rho[1] * t8… in func_pol() 1928 … rho[0] * t2090 - 0.72032600000000000000e-1 * t78 * t4238 - 0.23044680000000000000e-2 * rho[1] * t… in func_pol() 1935 …59021874999999999999e-1 * t76 * t1840 + 0.51729500000000000000e-1 * t25 * t2090 + 0.10731250000000… in func_pol() 1971 …* rho[1] * t2090 + 0.44656200000000000000e-1 * t102 * t4557 - 0.52823906666666666668e0 * t76 * t20… in func_pol()
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H A D | gga_x_ncap.c | 2234 double t2076, t2079, t2084, t2085, t2090, t2091, t2093, t2094; in func_pol() local 3443 t2090 = t307 * params->alpha; in func_pol() 3444 t2091 = t2090 * t1376; in func_pol() 3646 t2676 = t2090 * t2094; in func_pol() 3649 t2682 = t2090 * t2084; in func_pol() 3820 t3215 = t2090 * t2684; in func_pol() 4544 …3 * t2678 * t5722 + 0.2e1 * t753 * t2678 * t5769 - t753 * t2090 * t5773 - 0.2e1 * t753 * t2090 * t… in func_pol() 4548 …t1979 * t2114 + 0.8e1 / 0.3e1 * t753 * t2102 - 0.2e1 * t753 * t2090 * t5749 - t753 * t2090 * t5780… in func_pol() 4716 …t3175 * t3824 - 0.3e1 / 0.2e1 * t753 * t2090 * t7313 + 0.3e1 * t753 * t2678 * t7343 - 0.3e1 / 0.2e… in func_pol() 4719 …e1 * t753 * t2090 * t7270 - 0.3e1 * t753 * t2090 * t7298 - 0.9e1 * t753 * t2678 * t7321 + 0.6e1 * … in func_pol() [all …]
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H A D | gga_c_gaploc.c | 9271 t2090 = t723 * t98; in func_pol() 9272 t2091 = t2090 * t739; in func_pol() 11059 t6200 = t2090 * t6199; in func_pol() 11062 t6205 = t2090 * t6204; in func_pol() 11701 t7603 = t2090 * t6350; in func_pol() 11727 t7665 = t2090 * t7664; in func_pol() 11733 t7691 = t2090 * t7690; in func_pol() 11758 t7730 = t2090 * t2076; in func_pol() 11807 t7833 = t2090 * t7832; in func_pol() 11858 t7953 = t2090 * t2095; in func_pol() [all …]
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H A D | gga_x_n12.c | 1099 double t2083, t2084, t2085, t2086, t2088, t2089, t2090, t2092; in func_pol() local 2124 t2090 = t650 * t214; in func_pol() 2125 t2092 = t7 * t2090 * t653; in func_pol() 2340 t2663 = t7 * t2090 * t1069; in func_pol() 2884 t4638 = t7 * t2090 * t2073; in func_pol() 2923 t4832 = t7 * t2090 * t2256; in func_pol() 3127 t6109 = t7 * t2090 * t2691; in func_pol() 3171 t6483 = t7 * t2090 * t3072; in func_pol()
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H A D | gga_k_apbeint.c | 754 double t2069, t2072, t2074, t2079, t2084, t2087, t2090, t2092; in func_pol() local 1807 t2090 = 0.1e1 / t16 / t1610; in func_pol() 1809 …4 + 0.2e1 / 0.3e1 * t2087 + 0.2e1 / 0.3e1 * t333 * t2090 * t81 * t2092 + 0.2e1 / 0.3e1 * t251 * t2… in func_pol()
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H A D | gga_x_chachiyo.c | 1294 double t2086, t2087, t2088, t2089, t2090, t2091, t2092, t2093; in func_pol() local 3134 t2090 = t141 * t2089; in func_pol() 3135 t2091 = t2090 * t400; in func_pol() 3919 …t3044 / 0.1944e4 + t2658 * t234 / 0.16e2 - 0.3e1 / 0.32e2 * t640 * t826 - t2090 * t817 / 0.24e2 + … in func_pol() 4745 …2e1 / 0.81e2 * t6721 - 0.8e1 / 0.27e2 * t6724 * t400 - 0.64e2 / 0.729e3 * t2090 * t1073 + t3295 * … in func_pol() 4756 …0.2e1 / 0.9e1 * t6752 * t1104 - 0.4e1 / 0.9e1 * t6756 + 0.56e2 / 0.81e2 * t2090 * t1108 - t6762 / … in func_pol() 5200 …81e2 * t2040 * t1934 + 0.4e1 / 0.81e2 * t6316 * t665 + 0.16e2 / 0.243e3 * t2090 * t1967 - t1090 * … in func_pol() 5454 …e4 * t284 * t10599 * t10605 + 0.2e1 / 0.2187e4 * t284 * t10612 * t10605 - t2090 * t2676 / 0.27e2 -… in func_pol() 5461 …t10715 = t386 * t3091 / 0.64e2 + t8943 * t650 / 0.4e1 + t2090 * t2647 / 0.18e2 - t6724 * t817 / 0.… in func_pol() 5604 ….104976e6 * t143 * t11267 * t11269 - t143 * t11260 * t11269 / 0.34992e5 + t2090 * t3021 / 0.54e2 -… in func_pol() [all …]
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H A D | gga_x_lsrpbe.c | 608 double t2048, t2080, t2085, t2090, t2095, t2100, t2128, t2139; in func_pol() local 1515 t2090 = t327 * t327; in func_pol() 1518 …0 / 0.2e1 - 0.5e1 / 0.27e2 * t7 * t1257 * t47 * t2085 - t7 * t181 * t47 * t2090 / 0.2e1 - 0.5e1 / … in func_pol()
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H A D | gga_x_2d_b88.c | 657 double t2037, t2046, t2055, t2063, t2065, t2081, t2082, t2090; in func_pol() local 1613 t2090 = t355 * t355; in func_pol() 1618 …8e0 * t40 * t858 * t336 * t355 + 0.27916148151761877430e-1 * t40 * t335 * t2090 + 0.37221530869015… in func_pol()
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H A D | gga_c_lm.c | 836 double t2074, t2077, t2081, t2085, t2088, t2090, t2092, t2096; in func_pol() local 2064 t2090 = 0.32e2 * t108 * t2088; in func_pol() 2072 … * t954 + 0.40e2 / 0.81e2 * t108 * t2081 + 0.8e1 / 0.3e1 * t108 * t2085 + t2090 + 0.40e2 / 0.81e2 … in func_pol() 2183 …4 + 0.8e1 / 0.9e1 * t115 * t2404 + 0.4e1 / 0.9e1 * t115 * t2406 - t2074 + t2090 + 0.64e2 / 0.27e2 … in func_pol()
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H A D | gga_c_p86.c | 944 double t2078, t2087, t2090, t2091, t2094, t2102, t2104, t2105; in func_pol() local 2216 t2090 = t378 * t648 * t842; in func_pol() 2217 t2091 = 0.9e1 / 0.2e1 * t2090; in func_pol() 2264 …- 0.3e1 * t1763 - t1765 / 0.2e1 - 0.3e1 * t1767 - 0.3e1 * t2087 + 0.6e1 * t2090 + 0.3e1 * t2094 + … in func_pol()
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H A D | gga_k_dk.c | 893 double t2064, t2066, t2068, t2090, t2101, t2104, t2107, t2110; in func_pol() local 2357 t2090 = t1378 * t889; in func_pol() 2363 …t312 * t319 * t377 - 0.2e1 * t311 * t312 * t121 * t854 + 0.24e2 / 0.5e1 * t2090 + 0.12e2 * t311 * … in func_pol() 2474 …+ 0.2e1 / 0.3e1 * t2059 - 0.2e1 * t2062 - t2064 - t2066 + 0.6e1 / 0.5e1 * t2090 + 0.2e1 * t404 * t… in func_pol()
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H A D | gga_x_hjs_b88_v2.c | 117 double t2088, t2089, t2090, t2093, t2096, t2099, t2100, t2103; in func_unpol() local 1120 t2090 = t2089 * t254; in func_unpol() 1138 …t2090 - 0.64e2 / 0.27e2 * t2129 * t2096 + 0.128e3 / 0.81e2 * t2129 * t2100 - 0.448e3 / 0.9e1 * t21… in func_unpol() 1145 …t2090 - 0.16e2 / 0.27e2 * t2159 * t2096 + 0.32e2 / 0.81e2 * t2159 * t2100 - 0.16e2 / 0.9e1 * t2166… in func_unpol() 1204 …t2090 + 0.56e2 / 0.27e2 * t2368 * t2096 - 0.112e3 / 0.81e2 * t2368 * t2100 + 0.8e1 / 0.9e1 * t2363… in func_unpol() 3286 double t2083, t2086, t2087, t2088, t2089, t2090, t2093, t2095; in func_ferr() local 4322 t2090 = t2087 * t2089; in func_ferr() 4509 …t2090 * t2749 + 0.69368074529891691809e-1 * t2753 * t2117 - 0.11561345754981948635e0 * t2756 * t21… in func_ferr() 6526 double t2087, t2089, t2090, t2091, t2093, t2094, t2096, t2097; in func_pol() local 9104 t2090 = t2089 / 0.2e1; in func_pol() [all …]
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H A D | gga_k_meyer.c | 1307 double t2090, t2091, t2092, t2093, t2096, t2097, t2098, t2099; in func_pol() local 2378 t2090 = t913 * t2081 * t914; in func_pol() 2379 t2091 = t2090 / 0.13824e5; in func_pol() 3020 …e4 * t360 * t5171 * t741 - t2079 / 0.20736e5 + 0.5e1 / 0.6912e4 * t2097 - t2090 / 0.10368e5 - t752; in func_pol()
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H A D | gga_x_pw91.c | 1016 double t2078, t2083, t2085, t2087, t2090, t2092, t2095, t2101; in func_pol() local 2117 …t2090 = -0.6e1 * t845 - 0.6e1 * t849 - 0.2e1 * t858 - t1818 - 0.2e1 * t865 - 0.2e1 * t870 - t1821 … in func_pol() 2119 v4rho4[0] = t1814 + t2090; in func_pol()
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H A D | gga_c_tca.c | 853 double t2090, t2093, t2101, t2114, t2124, t2130, t2131, t2134; in func_pol() local 1969 …t2090 = t1238 - 0.75175095611407122087e-2 * t1261 + 0.45085857930535696764e0 * t1263 + 0.289011909… in func_pol() 1981 v4rho4[3] = t2043 + t2058 + t2068 + t2090 + t2101 + t2114 + t2130 + t2147; in func_pol()
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H A D | gga_x_lg93.c | 996 double t2083, t2084, t2085, t2086, t2087, t2088, t2089, t2090; in func_pol() local 2510 t2090 = t2089 * t243; in func_pol() 2511 t2091 = t1556 * t2090; in func_pol() 3326 t5650 = t3859 * t2090; in func_pol()
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H A D | gga_x_q2d.c | 1113 double t2084, t2085, t2086, t2087, t2088, t2089, t2090, t2091; in func_pol() local 2577 t2090 = t2089 * t267; in func_pol() 2578 t2091 = t518 * t2090; in func_pol() 3371 t5266 = t1260 * t2090; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_mvs.c | 1967 double t2079, t2081, t2083, t2085, t2090, t2091, t2093, t2094; in func_pol() local 3499 t2090 = t63 * t44; in func_pol() 3501 t2093 = t2090 * t2091 * t1390; in func_pol() 3532 t2150 = t2090 * t2147 * t2148; in func_pol() 4939 …38 * t261 * t313 * t120 * t1193 / 0.20736e5 + t5644 / 0.13824e5 + t1543 * t2090 * t2147 * t3878 / … in func_pol() 4960 …t2090 * t2091 * t3850 / 0.20736e5 + t5787 - t1389 * t2090 * sigma[0] * t193 * t1390 / 0.1296e4 + t… in func_pol() 4997 …1 - t5932 - t4173 * t2090 * t2147 * t218 * t492 / 0.20736e5 + t5939 + t1543 * t2090 * t2147 * t218… in func_pol() 5015 …- t6039 / 0.18e2 + t3857 * t2090 * t2091 * t4302 / 0.6912e4 - t3849 * t2090 * t2091 * t573 * t140 … in func_pol() 5052 …t2090 * sigma[2] * t264 * t2148 / 0.1296e4 - t4173 * t2090 * t2147 * t584 * t201 / 0.20736e5 - t41… in func_pol() 5058 …458 * t190 * t289 * t69 * t1708 / 0.20736e5 + t6002 / 0.13824e5 + t1389 * t2090 * t2091 * t4625 / … in func_pol() [all …]
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H A D | mgga_c_cs.c | 742 double t2085, t2086, t2087, t2088, t2090, t2092, t2100, t2103; in func_pol() local 2275 t2090 = t128 * t217 * t562; in func_pol() 2282 …t2111 = -t2086 - t2088 + 0.13311495955555555556e-2 * t2090 - 0.4918e-1 * t4 * (t2092 - t1661) * t7… in func_pol() 2308 …* t2085 - 0.15256728888888888888e-1 * t2087 + 0.26622991911111111109e-2 * t2090 - 0.11442546666666… in func_pol() 2330 …057 - t2064 - t2071 - t2079 - t2086 - t2088 + 0.39934487866666666664e-2 * t2090 - t2106 - 0.139371… in func_pol() 2368 …054 - 0.4918e-1 * t84 * t13 * t2769 - 0.19672e0 * t129 * t1049 + 0.53245983822222222220e-2 * t2090; in func_pol()
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H A D | hyb_mgga_x_js18.c | 119 double t2088, t2090, t2092, t2094, t2095, t2102, t2105, t2110; in func_unpol() local 1251 t2090 = t678 * t505; in func_unpol() 1253 t2094 = 0.2e1 * t2083 + 0.2e1 * t2088 + 0.18e2 * t2090 + 0.9e1 * t2092; in func_unpol() 1262 …t2136 = 0.6e1 * t1219 * t680 + 0.6e1 * t1630 * t508 + 0.12e2 * t255 * t2090 + 0.6e1 * t255 * t2092… in func_unpol() 2398 …05 - 0.24e2 * t5225 * t2090 + 0.108e3 * t4423 * t2102 + 0.108e3 * t4440 * t2102 + 0.108e3 * t1563 … in func_unpol() 2422 …t2090 + 0.108e3 * t5030 * t2102 - 0.12e2 * t255 * t6700 + t683 * t1997 + t6704 * t215 + t194 * t67… in func_unpol() 2460 t6833 = t690 * t2090; in func_unpol() 2489 t6956 = t117 * t2090; in func_unpol() 3261 …3 * t1192 * t4160 * t648 - 0.6e1 * t8647 * t721 - 0.12e2 * t8813 * t2090 - 0.24e2 * t10292 * t2090; in func_unpol() 3784 …t9982 * t6982 - 0.24e2 * t14368 * t2090 + 0.108e3 * t18244 * t1637 - 0.648e3 * t3896 * t18812 - 0.… in func_unpol() [all …]
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H A D | mgga_c_vsxc.c | 152 double t2080, t2082, t2084, t2086, t2088, t2090, t2091, t2092; in func_unpol() local 1287 t2090 = t1591 * t394; in func_unpol() 1288 t2091 = t163 * t2090; in func_unpol() 3142 double t2070, t2086, t2087, t2089, t2090, t2093, t2094, t2103; in func_pol() local 5269 t2090 = t2089 * t433; in func_pol() 5272 …000000e1 * t618 * t711 + t206 * t2087 + 0.10000000000000000000e1 * t117 * t2090 + 0.10000000000000… in func_pol() 7282 …1 * t2019 * t532 + 0.10000000000000000000e1 * t393 * t2090 + 0.10000000000000000000e1 * t408 * t20… in func_pol() 7680 …1 * t117 * t6797 + 0.30000000000000000000e1 * t610 * t2090 + 0.30000000000000000000e1 * t618 * t20… in func_pol() 11504 …10000000000000000000e1 * t939 * t2090 + 0.20000000000000000000e1 * t942 * t2090 + 0.10000000000000… in func_pol() 11781 …000000000000000000e1 * t1726 * t2090 + 0.30000000000000000000e1 * t1729 * t2090 + 0.30000000000000… in func_pol() [all …]
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H A D | mgga_x_rscan.c | 154 double t2082, t2084, t2087, t2090, t2094, t2095, t2097, t2098; in func_unpol() local 1851 t2090 = t495 * t619; in func_unpol() 7176 double t2076, t2083, t2090, t2091, t2094, t2097, t2098, t2105; in func_ferr() local 8864 t2090 = t1892 * t327; in func_ferr() 10444 t6697 = t2090 * t6696; in func_ferr() 10567 t6944 = t2090 * t6943; in func_ferr() 12596 …472 * t15811 - 0.31828156850352e2 * t2090 * t15828 - 0.63656313700704e2 * t2090 * t15831 - 0.31828… in func_ferr() 13072 t18827 = t2090 * t18826; in func_ferr() 13148 t19129 = t2090 * t19128; in func_ferr() 13296 t19631 = t2090 * t19630; in func_ferr() [all …]
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H A D | mgga_x_ms.c | 1485 double t2046, t2061, t2090, t2095, t2097, t2098, t2100, t2101; in func_ferr() local 2361 …t2090 = -t99 * t140 * t548 - 0.3e1 * t99 * t254 * t312 - 0.3e1 * t99 * t117 * t696 - t99 * t63 * t… in func_ferr() 2374 …t802 - 0.3e1 / 0.8e1 * t71 * t72 * (t1799 + t1837 + t1880 + t1919 + t1966 + t2018 + t2090 + t2142); in func_ferr() 2809 double t2085, t2086, t2087, t2089, t2090, t2091, t2094, t2097; in func_pol() local 4268 t2090 = t234 * t2089; in func_pol() 4269 t2091 = t233 * t2090; in func_pol() 5760 …0.125000e6 / 0.6561e4 * t2711 * t2081 * t2129 + 0.550e3 / 0.81e2 * t612 * t2090 + 0.550e3 / 0.81e2… in func_pol() 5986 … * t2762 + 0.200e3 / 0.81e2 * t2190 * t2762 + 0.1100e4 / 0.243e3 * t811 * t2090 - 0.100e3 / 0.27e2… in func_pol() 6144 …00e4 / 0.729e3 * t4959 * t690 * t1036 * t631 - 0.550e3 / 0.243e3 * t896 * t2090 - 0.100e3 / 0.27e2… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_c_vwn.c | 847 double t2085, t2087, t2089, t2090, t2094, t2097, t2101, t2104; in func_pol() local 1918 …t2090 = -0.42921743488160883383e0 * t243 * t118 * t1792 * t246 + 0.49053421129326723867e0 * t409 *… in func_pol() 1953 t2389 = (t1773 + t1827 + t1934 + t2036 + t2090 + t2147 + t2188 + t2384) * t63 * t102; in func_pol()
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H A D | lda_c_vwn_3.c | 859 double t2088, t2089, t2090, t2091, t2095, t2102, t2108, t2111; in func_pol() local 2128 t2090 = t9 * t2089; in func_pol() 2132 …2081 * t453 / 0.2e1 + t150 * t446 * t473 / 0.4e1 - 0.3e1 / 0.2e1 * t150 * t2090 * t2091 + 0.3e1 / … in func_pol() 2493 …t446 * t2102 / 0.3e1 + 0.6e1 * t150 * t9 * t2920 * t2922 - 0.9e1 * t150 * t2090 * t2856 + 0.3e1 / … in func_pol()
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