| /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
1919 t2094 = 0.47129772651883579471e0 * t499 * t374 * t1722 * t141; in func_pol()
1932 …t2147 = -t2094 + t2097 - t2101 - t2104 - t2110 + t2112 - t2118 + t2124 + t2127 - t2129 + t2133 + 0… in func_pol()
1986 …t2477 = -t2469 / 0.2e1 - t2472 / 0.4e1 - t2475 / 0.6e1 + t2083 - t2087 - t2089 + t2094 - t2097 + t… in func_pol()
2087 …- t2469 / 0.4e1 - t2472 / 0.8e1 - t2475 / 0.8e1 + t2083 - t2087 - t2089 + t2094 - t2097 + t2101 + … in func_pol()
2175 …t3199 = t2094 - t2097 + t2101 + t2104 + t2110 - t2112 + t2118 - t2124 - t2127 + t2129 - t2133 - t2… in func_pol()
2208 …t3396 = -t2089 + t2094 - t2097 + t2101 + t2104 + t2110 - t2112 + t2118 - t2124 - t2127 + t2129 - t… in func_pol()
2237 …t3571 = t1999 + t2002 - t2008 + t2014 - t2022 + t2083 - t2087 - t2089 + t2094 - t2097 + t2101 + t2… in func_pol()
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| H A D | lda_c_vwn_4.c | 846 double t2094, t2096, t2098, t2100, t2102, t2106, t2109, t2113; in func_pol() local
1907 t2094 = t2047 * t1318; in func_pol()
1908 t2096 = 0.26860754033147841838e1 * t1314 * t129 * t2094; in func_pol()
1918 t2126 = 0.37129640917784654576e3 * t1315 * t2094; in func_pol()
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| H A D | lda_c_vwn_2.c | 842 double t2085, t2086, t2087, t2088, t2089, t2091, t2093, t2094; in func_pol() local
1929 t2094 = 0.80e2 * t1731; in func_pol()
1930 t2096 = t68 * (t1728 - t2093 - t2094 + t1736); in func_pol()
1980 t2173 = t68 * (-t1728 - t2093 + t2094 + t1736); in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_g96.c | 453 double t2080, t2094, t2096, t2097, t2105, t2107, t2118, t2120; in func_pol() local
1459 t2094 = t67 * t298; in func_pol()
1460 …90 * t298 * t146 + 0.2e1 / 0.411e3 * t111 * t990 / t22 / t992 * sigma[0] + 0.2e1 / 0.411e3 * t2094; in func_pol()
1485 …3 * t434 * t298 * t8 - t434 * t114 / 0.137e3 + t2169 + 0.4e1 / 0.1233e4 * t2094 - 0.10e2 / 0.411e3… in func_pol()
1513 …/ 0.411e3 * t2205 - 0.4e1 / 0.1233e4 * t2120 + t2063 + 0.2e1 / 0.1233e4 * t2094 + 0.4e1 / 0.1233e4… in func_pol()
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| H A D | gga_x_n12.c | 1100 double t2094, t2096, t2097, t2099, t2100, t2101, t2102, t2104; in func_pol() local
2126 t2094 = t14 * t673; in func_pol()
2127 t2096 = t7 * t2094 * t209; in func_pol()
2207 t2247 = t7 * t2094 * t371; in func_pol()
2873 t4607 = t7 * t2094 * t668; in func_pol()
2889 t4664 = t7 * t2094 * t661; in func_pol()
2926 t4846 = t7 * t2094 * t934; in func_pol()
2932 t4868 = t7 * t2094 * t947; in func_pol()
3121 t6086 = t7 * t2094 * t1078; in func_pol()
3124 t6098 = t7 * t2094 * t1074; in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1064 double t2091, t2094, t2097, t2102, t2106, t2108, t2119, t2141; in func_pol() local
2149 t2094 = t7 * t877 * t174; in func_pol()
2162 …t2158 = -0.3e1 / 0.8e1 * t7 * t17 * (t2021 + t2085) - t2091 / 0.2e1 - 0.5e1 / 0.9e1 * t2094 + t209… in func_pol()
2207 …0.2e1 * t2295 - 0.5e1 / 0.36e2 * t2298 - t2091 / 0.8e1 - 0.5e1 / 0.12e2 * t2094 + t2097 / 0.4e1 + … in func_pol()
2251 …t2575 = -t2289 / 0.3e1 + t2295 / 0.3e1 - 0.5e1 / 0.18e2 * t2298 - 0.5e1 / 0.18e2 * t2094 + t2097 /… in func_pol()
2278 …t2783 = -0.5e1 / 0.12e2 * t2298 - 0.5e1 / 0.36e2 * t2094 + t2102 + t2106 + t1026 * t1035 * t491 * … in func_pol()
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| H A D | gga_c_chachiyo.c | 782 double t2074, t2077, t2079, t2081, t2086, t2087, t2091, t2094; in func_pol() local
1711 t2094 = t336 * t537 * t343; in func_pol()
1712 t2095 = t2094 / 0.18e2; in func_pol()
1727 t2124 = t2094 / 0.9e1; in func_pol()
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| H A D | gga_c_am05.c | 895 double t2085, t2086, t2088, t2092, t2094, t2096, t2099, t2102; in func_pol() local
1937 t2094 = t822 * t1 * t213; in func_pol()
1943 …- 0.22787578869697033845e-2 * t2088 - t2092 - 0.73245789224026180216e-3 * t2094 - t1861 + t1865 + … in func_pol()
2071 …- 0.17090684152272775383e-2 * t2088 - t2092 - 0.18311447306006545054e-3 * t2094 - 0.35089341735807… 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
3446 t2094 = t2093 * t179; in func_pol()
3447 t2095 = t1374 * t2094; in func_pol()
3450 t2102 = t1380 * t2094; in func_pol()
3646 t2676 = t2090 * t2094; in func_pol()
4301 t5403 = t3729 * t2094; in func_pol()
4347 t5756 = t3833 * t2094; in func_pol()
4357 …1 * t415 * t5791 + t415 * t5794 / 0.3e1 - 0.28e2 / 0.3e1 * t440 * t3843 * t2094 - 0.7e1 / 0.9e1 * … in func_pol()
4527 …t7052 = t7010 * t1384 + 0.8e1 / 0.3e1 * t5382 * t5383 * t2094 - 0.8e1 / 0.3e1 * t7020 * t2015 - 0.… 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
2218 t2094 = t378 * t389 * t458 * t196; in func_pol()
2224 …- 0.9e1 / 0.2e1 * t1767 - 0.3e1 / 0.2e1 * t2087 + t2091 + 0.9e1 / 0.2e1 * t2094 - 0.45e2 / 0.8e1 *… in func_pol()
2264 …- t1765 / 0.2e1 - 0.3e1 * t1767 - 0.3e1 * t2087 + 0.6e1 * t2090 + 0.3e1 * t2094 + 0.3e1 / 0.2e1 * … in func_pol()
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| H A D | gga_x_ft97.c | 1062 double t2060, t2066, t2069, t2083, t2085, t2087, t2092, t2094; in func_pol() local
2196 t2094 = 0.1e1 / t367 / t2092; in func_pol()
2197 t2095 = t2094 * t16; in func_pol()
2240 t2276 = t4 * t6 * t2094; in func_pol()
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| H A D | gga_x_vmt84.c | 901 double t2066, t2069, t2079, t2085, t2092, t2094, t2096, t2099; in func_pol() local
1890 …t2094 = -0.2e1 * t7 * t116 * t170 * t875 - t7 * t116 * t66 * t1895 / 0.2e1 - 0.2e1 / 0.3e1 * t1901… in func_pol()
1915 … 0.2e1 * t890 - t1884 + t897 - 0.3e1 / 0.2e1 * t900 - 0.3e1 / 0.2e1 * t1007 + t9 * (t2094 + t2174); in func_pol()
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| H A D | gga_c_revtca.c | 452 double t2051, t2055, t2077, t2094, t2101, t2104, t2113, t2117; in func_ferr() local
1023 t2094 = t797 * t518; in func_ferr()
1024 …t817 + 0.12215953036853657338e-2 * t231 * t428 * t2094 - 0.8453598361975443142e-2 * t111 * t634 * … in func_ferr()
1217 double t2087, t2089, t2090, t2091, t2093, t2094, t2095, t2096; in func_pol() local
2980 t2094 = 0.61913095002824568187e-5 * t2093; in func_pol()
3034 …t2164 = t2087 - t2089 + t2094 - t2100 - t2105 + t2108 + 0.2e1 * t508 * t2111 + t2117 + t2121 - t21… in func_pol()
3275 …t2501 = -t2087 - t2089 + t2094 - t2100 - t2105 + t2108 + t2117 + t2121 - t2124 - t2128 + 0.2e1 * t… in func_pol()
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| H A D | gga_x_q2d.c | 1114 double t2092, t2093, t2094, t2095, t2096, t2097, t2098, t2099; in func_pol() local
2581 t2094 = t518 * t2093; in func_pol()
2582 t2095 = t2094 / 0.768e3; in func_pol()
3412 … + t1914 / 0.768e3 + t2083 / 0.1536e4 - t2087 / 0.32e2 - t2091 / 0.96e2 + t2094 / 0.256e3 + t2098 … in func_pol()
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| H A D | gga_c_op_pw91.c | 83 double t1939, t1947, t1976, t1986, t2026, t2034, t2093, t2094; in func_unpol() local
568 …t2094 = (-0.20362654320987654321e3 * t853 * t994 + 0.24241255144032921811e3 * t246 / t10 / t1125 *… in func_unpol()
572 …t2094 + 0.53959999086813443434e3 * t406 * t822 * t1055 * t140 + 0.18168302181113725303e2 * t75 * t… in func_unpol()
574 …7 * t2107 + 0.30185403127672500000e1 * t86 * t87 * t2104 + 0.18168302181113725303e2 * t159 * t2094; in func_unpol()
575 …0000000e1 * t148 * t920 * t432 - 0.16906082062500000000e0 * t176 * t177 * t2094 * t92 + 0.25000000… in func_unpol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_gx.c | 2404 double t2089, t2090, t2092, t2094, t2095, t2097, t2099, t2100; in func_pol() local
3740 t2094 = t489 * t223; in func_pol()
3741 t2095 = t856 * t2094; in func_pol()
3742 t2097 = t830 * t2094; in func_pol()
3763 t2144 = t2094 * t235; in func_pol()
4993 …t1668 * t1670 + 0.500e3 / 0.81e2 * t5205 * t96 * t651 + 0.50e2 / 0.81e2 * t2094 * t637 - 0.25e2 / … in func_pol()
5006 …t5338 = -0.275e3 / 0.243e3 * t830 * t5167 + 0.50e2 / 0.81e2 * t2086 * t2094 - 0.25e2 / 0.216e3 * t… in func_pol()
5016 …0e2 / 0.81e2 * t2076 * t2094 - 0.25e2 / 0.216e3 * t5353 * t800 + 0.25e2 / 0.81e2 * t2089 * t2094 +… in func_pol()
5229 … / 0.324e3 * t6373 * t800 + 0.100e3 / 0.243e3 * t2608 * t2094 + 0.100e3 / 0.243e3 * t2638 * t2094 … in func_pol()
5368 …685 * t800 - 0.25e2 / 0.648e3 * t6688 * t800 + 0.50e2 / 0.243e3 * t2777 * t2094 + 0.50e2 / 0.27e2 … in func_pol()
[all …]
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| H A D | mgga_k_pc07.c | 132 double t2075, t2078, t2084, t2087, t2094, t2095, t2098, t2103; in func_unpol() local
1337 t2094 = t208 * t140; in func_unpol()
1338 t2095 = t351 * t2094; in func_unpol()
2386 t6683 = t2094 * t153; in func_unpol()
3204 t12137 = t614 * t2094; in func_unpol()
4055 double t2087, t2090, t2091, t2094, t2097, t2098, t2105, t2108; in func_ferr() local
5242 t2094 = t1922 * t461; in func_ferr()
7993 double t2083, t2086, t2087, t2088, t2091, t2094, t2097, t2100; in func_pol() local
9957 t2094 = t627 * t244; in func_pol()
12708 … * t2094 * t3049 - 0.1568231334e2 * t2094 * t3053 + 0.12676797988389e2 * t8669 * t4478 + 0.8451198… in func_pol()
[all …]
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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
1253 t2094 = 0.2e1 * t2083 + 0.2e1 * t2088 + 0.18e2 * t2090 + 0.9e1 * t2092; in func_unpol()
1254 t2095 = t2094 * t26; in func_unpol()
2089 t5413 = t2094 * t254; in func_unpol()
3260 t13350 = t2094 * t763; in func_unpol()
4321 double t2079, t2080, t2082, t2084, t2086, t2087, t2094, t2097; in func_ferr() local
5446 t2094 = t1634 * t510; in func_ferr()
5453 ….6e1 * t1628 * t513 + 0.12e2 * t256 * t2082 + 0.6e1 * t256 * t2084 - 0.54e2 * t762 * t2094 - t2087; in func_ferr()
6629 …t6810 = 0.108e3 * t4499 * t2094 + 0.108e3 * t4516 * t2094 + 0.108e3 * t1562 * t6564 + t6794 - 0.64… in func_ferr()
6676 t7007 = t692 * t2094; in func_ferr()
[all …]
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| H A D | mgga_x_tau_hcth.c | 1398 double t2085, t2089, t2093, t2094, t2117, t2120, t2123, t2134; in func_pol() local
2515 t2094 = t2093 * t594; in func_pol()
2519 …t2094 - 0.200e3 / 0.9e1 * t263 * t196 + 0.850e3 / 0.3e1 * t1335 * t2094 - 0.40e2 / 0.9e1 * t248 * … in func_pol()
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| H A D | mgga_c_vsxc.c | 153 double t2094, t2095, t2097, t2099, t2102, t2103, t2105, t2106; in func_unpol() local
1290 t2094 = t1591 * t856; in func_unpol()
1291 t2095 = t278 * t2094; in func_unpol()
1761 …8746731337668e1 * t628 * t2094 + 0.13309410491666666666e-3 * t427 * t163 * t238 * t394 + 0.1250000… in func_unpol()
3142 double t2070, t2086, t2087, t2089, t2090, t2093, t2094, t2103; in func_pol() local
5271 t2094 = t2093 * t333; in func_pol()
7282 …1 * t408 * t2090 + 0.10000000000000000000e1 * t287 * t2094 + 0.10000000000000000000e1 * t305 * t20… in func_pol()
7680 ….96491876992155210402e2 * t24 * t6805 + 0.30000000000000000000e1 * t591 * t2094 - 0.17544670867903… in func_pol()
11504 …0000000000000000000e1 * t978 * t2094 + 0.20000000000000000000e1 * t981 * t2094 + 0.100000000000000… in func_pol()
11799 …12637 - t12572 + 0.30000000000000000000e1 * t1712 * t2094 + 0.30000000000000000000e1 * t1721 * t20… in func_pol()
[all …]
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| H A D | mgga_x_vt84.c | 8325 t2095 = t341 * t2094; in func_pol()
9739 t5606 = t2094 * t40; in func_pol()
9765 t5696 = t973 * t2094; in func_pol()
10487 t7616 = t1469 * t2094; in func_pol()
10488 t7619 = t45 * t2094; in func_pol()
10671 t8055 = t1826 * t2094; in func_pol()
12222 t15590 = t2094 * t343; in func_pol()
12299 t16165 = t974 * t2094; in func_pol()
13255 t22025 = t81 * t2094; in func_pol()
13256 t22030 = t72 * t2094; in func_pol()
[all …]
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| H A D | mgga_c_scanl.c | 14846 t2094 = t318 * t643; in func_pol()
15126 t2664 = t307 * t2094; in func_pol()
19385 t12447 = t3621 * t2094; in func_pol()
22984 t23039 = t2094 * t1682; in func_pol()
23825 t26516 = t2094 * t2084; in func_pol()
29000 t49085 = t2094 * t300; in func_pol()
29917 t54101 = t2094 * t610; in func_pol()
30001 t54434 = t2094 * t615; in func_pol()
30280 t56001 = t2094 * t740; in func_pol()
30339 t56372 = t2094 * t819; in func_pol()
[all …]
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| H A D | mgga_x_sa_tpss.c | 9232 t2094 = t286 * t817; in func_pol()
9476 t2708 = t255 * t2094 * t613; in func_pol()
11316 t7656 = t255 * t2094 * t1716; in func_pol()
12066 t9592 = t944 * t2094 * t2449; in func_pol()
13590 t16366 = t2094 * t3321; in func_pol()
13591 t16369 = t2094 * t3305; in func_pol()
14276 t21172 = t2094 * t13694 * t945; in func_pol()
14277 t21176 = t2094 * t13566 * t945; in func_pol()
15048 t25725 = t2094 * t3557; in func_pol()
16097 t31274 = t2094 * t4894; in func_pol()
[all …]
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| H A D | mgga_c_bc95.c | 4338 t2094 = t2093 * t663; in func_pol()
4339 t2095 = t530 * t2094; in func_pol()
6304 t5470 = t5469 * t2094; in func_pol()
7385 t7017 = t7016 * t2094; in func_pol()
9609 t16050 = t16048 * t60 * t2094; in func_pol()
10484 t23110 = t5407 * t5418 * t60 * t2094; in func_pol()
10585 t24047 = t6218 * t2094; in func_pol()
10717 t24570 = t1744 * t1750 * t60 * t2094; in func_pol()
10744 t24790 = t6841 * t2094; in func_pol()
10873 t24890 = t1936 * t60 * t2094; in func_pol()
[all …]
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| H A D | mgga_x_tm.c | 2125 double t2094, t2106, t2109, t2115, t2138, t2139, t2142, t2165; in func_ferr() local
2971 t2094 = t86 * t2004; in func_ferr()
2974 … 0.9720e4 * t2089 - 0.146e3 / 0.135e3 * t2091 * t90 - 0.146e3 / 0.135e3 * t2094 * t90 + 0.292e3 / … in func_ferr()
3491 …2091 * t108 - 0.146e3 / 0.135e3 * t86 * t5046 * t90 + 0.584e3 / 0.135e3 * t2094 * t108 + 0.292e3 /… in func_ferr()
3703 … * t2499 + t2674 + 0.584e3 / 0.135e3 * t2091 * t199 + 0.584e3 / 0.135e3 * t2094 * t199 + 0.584e3 /… in func_ferr()
4118 double t2080, t2083, t2084, t2091, t2094, t2096, t2097, t2100; in func_pol() local
5492 t2094 = t215 * t664; in func_pol()
5497 t2107 = 0.2e1 * t25 * t2100 + 0.54e2 * t2077 + 0.18e2 * t2083 + 0.6e1 * t2094 + 0.9e1 * t2105; in func_pol()
7632 …100e3 * t757 * t474 * t2158 - 0.1944e4 * t2936 * t2937 * t2094 + 0.972e3 * t1068 * t2919 * t2094 -… in func_pol()
7869 …* t552 * t39 * t259 * t2174 + 0.972e3 * t1068 * t3564 * t2094 - 0.1944e4 * t2936 * t3548 * t2094 +… in func_pol()
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