| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_pbetrans.c | 1325 double t2056, t2059, t2060, t2061, t2065, t2066, t2067, t2074; in func_pol() local
2356 t2065 = t290 * t682; in func_pol()
2373 …1625000000000000001e-1 * t293 * t2061 * t298 + 0.15487500000000000000e0 * t2065 * t2066 - 0.258125… in func_pol()
2374 …1625000000000000001e-1 * t293 * t2061 * t318 - 0.15487500000000000000e0 * t2065 * t2102 - 0.103250… in func_pol()
2375 …1625000000000000001e-1 * t293 * t2061 * t299 + 0.15487500000000000000e0 * t2065 * t2067 - 0.103250… in func_pol()
2977 …3e0 * t567 * t1861 + 0.13766666666666666666e0 * t1823 * t1846 - 0.2e-19 * t2065 * t1819 + 0.1e-19 … in func_pol()
2980 t5334 = t2065 * t2054; in func_pol()
2990 …372 * t2463 - 0.68833333333333333334e-1 * t293 * t5345 * t298 + 0.2e-19 * t2065 * t1772 + 0.803055… in func_pol()
2991 …00000000000000e0 * t2053 * t2055 * t141 + 0.2e-19 * t2065 * t1773 + 0.15487500000000000000e0 * t20… in func_pol()
3093 …6 - 0.46462500000000000000e0 * t5789 * t2067 + 0.61950000000000000000e0 * t2065 * t2066 * t226 + 0… in func_pol()
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| H A D | gga_x_2d_pbe.c | 437 double t2033, t2040, t2042, t2048, t2058, t2060, t2065, t2069; in func_pol() local
1427 t2065 = t1957 * t86; in func_pol()
1430 …0122335928791464423e-1 * t271 * t287 * t161 + 0.84352799406595536860e-3 * t2065 * t743 * t154 - 0.… in func_pol()
1449 …839503628e-2 * t753 * t243 * sigma[2] * t66 + 0.84352799406595536860e-3 * t2065 * t31 * t225 * t66… in func_pol()
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| H A D | gga_x_airy.c | 1142 double t2061, t2065, t2066, t2071, t2072, t2076, t2086, t2088; in func_pol() local
2233 t2065 = 0.10e2 / 0.27e2 * t7 * t52 * t1006 * t76; in func_pol()
2285 …e1 / 0.27e2 * t7 * t2048 * t46 * t2049 + 0.4e1 / 0.27e2 * t2056 + t2061 + t2065 - 0.3e1 / 0.8e1 * … in func_pol()
2319 … t2037 / 0.6e1 + t2040 / 0.3e1 - t2043 / 0.6e1 + t2056 / 0.27e2 + t2061 + t2065 - t2246 / 0.8e1 + … in func_pol()
2368 …t2756 = -0.10e2 / 0.27e2 * t2002 - 0.10e2 / 0.27e2 * t2017 + t2040 / 0.9e1 + t2061 + t2065 + t2249… in func_pol()
2388 …t2913 / 0.6e1 - 0.5e1 / 0.27e2 * t2002 - 0.5e1 / 0.27e2 * t2017 + t2061 + t2065 - 0.5e1 / 0.36e2 *… in func_pol()
2447 …/ 0.9e1 * t2351 - 0.2e1 / 0.3e1 * t2906 - 0.2e1 / 0.3e1 * t2913 + t2061 + t2065 - 0.20e2 / 0.27e2 … in func_pol()
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| H A D | gga_x_am05.c | 890 double t1966, t1969, t2003, t2023, t2033, t2043, t2065, t2069; in func_ferr() local
1502 …t2065 = t370 * t762 / 0.3e1 + 0.25e2 / 0.3456e4 * t232 * t2033 * t655 - 0.25e2 / 0.3456e4 * t698 *… in func_ferr()
1517 … * t1219 / 0.7776e4 + 0.25e2 / 0.3456e4 * t698 * t731 * t701 * t98 * t653 + t1934 + t2101 + t2065); in func_ferr()
1699 double t2019, t2022, t2025, t2027, t2050, t2057, t2060, t2065; in func_pol() local
2828 …t2065 = 0.189e3 / 0.128e3 * t2027 * t1263 + 0.81e2 / 0.64e2 * t2027 * t1272 + t2027 * t1278 / 0.9e… in func_pol()
2829 t2066 = t213 * t2065; in func_pol()
3473 …* t1956 * t1979 + t33 * t854 * t3234 * t384 * t1406 + t33 * t854 * t537 * t2065 * t239 / 0.4e1 - t… in func_pol()
3475 t4684 = t531 * t2065; in func_pol()
3600 …t5534 = t2509 * t3282 / 0.1152e4 - t853 * t854 * t212 * t2065 / 0.12e2 - 0.5e1 / 0.216e3 * t522 * … in func_pol()
3611 …t5743 = -t366 * t367 * t4684 / 0.288e3 + t33 * t854 * t885 * t2065 / 0.6e1 + t33 * t854 * t2491 * … in func_pol()
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| H A D | gga_x_cap.c | 897 double t2030, t2032, t2035, t2041, t2045, t2052, t2059, t2065; in func_pol() local
1930 t2065 = t7 * t1623 * t397; in func_pol()
1942 …t2125 = -t7 * t315 * t454 * t316 / 0.6e1 - t2059 / 0.3e1 - t7 * t1909 * t137 / 0.3e1 + t2065 / 0.2… in func_pol()
1973 … * t7 * t369 * t454 * t8 - 0.3e1 / 0.2e1 * t7 * t123 * t173 * t982 - t2059 / 0.2e1 + t2065 / 0.9e1; in func_pol()
2011 … t2381 + 0.4e1 / 0.27e2 * t2384 - 0.2e1 / 0.3e1 * t2387 + 0.2e1 / 0.9e1 * t2065 + 0.4e1 / 0.3e1 * … 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
1610 t2065 = sigma[2] * t431; in func_pol()
1618 …t2065 * t50 + 0.11166459260704750972e1 * t848 * t134 + 0.66998755564228505832e0 * t329 * t337 - 0.… in func_pol()
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| H A D | gga_x_sg4.c | 747 double t2055, t2058, t2065, t2068, t2071, t2074, t2077, t2080; in func_pol() local
1729 t2065 = t7 * t335 * t954; in func_pol()
1738 …0.2e1 / 0.9e1 * t2055 - t2058 / 0.3e1 - t7 * t329 * t471 * t330 / 0.6e1 - t2065 / 0.3e1 + t2068 / … in func_pol()
1761 …t2335 = -t2065 / 0.2e1 + t2068 / 0.9e1 + t2071 / 0.3e1 - t2074 / 0.6e1 - t2077 / 0.2e1 - t2080 / 0… in func_pol()
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| H A D | gga_x_b88.c | 730 double t2059, t2062, t2065, t2068, t2071, t2074, t2076, t2078; in func_pol() local
1694 t2065 = t7 * t234 * t953; in func_pol()
1698 …7 * t227 * t2051 * t42 * t2053 / 0.3e1 - t2059 / 0.3e1 + t2062 / 0.27e2 - t2065 / 0.3e1 - 0.7e1 / … in func_pol()
1730 ….6e1 + t7 * t720 * t120 * t1014 / 0.9e1 - t2059 / 0.2e1 + t2062 / 0.9e1 - t2065 / 0.2e1 + t2068 - … in func_pol()
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| H A D | gga_x_pw86.c | 624 double t2049, t2065, t2079, t2099, t2104, t2111, t2114, t2117; in func_pol() local
1626 …t2065 = 0.2e1 / 0.15e2 * t820 - t824 / 0.3e1 + 0.14e2 / 0.225e3 * t829 - t833 / 0.15e2 - 0.2e1 / 0… in func_pol()
1629 v4rho4[2] = t2034 + t2049 + t2065 + t2079; in func_pol()
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| H A D | gga_k_pw86.c | 565 double t2002, t2065, t2077, t2080, t2083, t2086, t2089, t2092; in func_pol() local
1491 …t2065 = 0.203e3 / 0.3375e4 * t126 * t873 * t874 * t128 + 0.4e1 / 0.27e2 * t1309 * t84 * t861 * t89… in func_pol()
1502 …t2130 = t8 * (t2002 + t2065 + t2100 + t2124) - 0.7e1 / 0.75e2 * t707 + t711 / 0.10e2 - t811 + t814… in func_pol()
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| H A D | gga_c_op_pbe.c | 762 double t2049, t2052, t2055, t2058, t2063, t2065, t2066, t2069; in func_pol() local
2111 t2065 = t211 * t160; in func_pol()
2112 t2066 = t981 * t2065; in func_pol()
2240 t2436 = t1117 * t2065; in func_pol()
2525 t3084 = t1778 * t2065; in func_pol()
3500 …t2065 + 0.30000000000000000000e1 * t1092 * t2069 + 0.36192584600000000000e1 * t164 * t981 * t6961 … in func_pol()
3810 …0000e2 * t164 * t4221 * t7993 - 0.10857775380000000000e2 * t334 * t4472 * t2065 + 0.54288876900000… in func_pol()
3811 …t8901 = 0.54288876900000000000e1 * t164 * t4466 * t2065 + 0.10857775380000000000e2 * t572 * t2436 … in func_pol()
4995 t15462 = t5252 * t2065; in func_pol()
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| H A D | gga_x_wc.c | 743 double t2049, t2050, t2052, t2059, t2065, t2070, t2077, t2086; in func_pol() local
1792 …t2065 = -t660 - t664 + t669 - t673 - 0.7e1 / 0.2e1 * t879 + t1131 + 0.7e1 / 0.2e1 * t886 + t1132 +… in func_pol()
1795 v4rho4[1] = t2050 + t2059 + t2065 + t2070; in func_pol()
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| H A D | gga_x_ncap.c | 115 double t2065, t2069, t2072, t2073, t2081, t2095, t2102, t2103; in func_unpol() local
871 t2065 = t586 * sigma[0]; in func_unpol()
875 t2081 = t2065 * t531; in func_unpol()
880 …t2134 = -0.35e2 / 0.81e2 * t164 * t677 + 0.32e2 / 0.81e2 * t687 * t2065 * t1576 + 0.22e2 / 0.27e2 … in func_unpol()
2233 double t2052, t2055, t2057, t2062, t2063, t2065, t2070, t2073; in func_pol() local
3436 t2065 = t1291 * t435 * sigma[0]; in func_pol()
3449 …* t2055 * t2057 + 0.4e1 / 0.3e1 * t729 * t1434 - 0.16e2 / 0.3e1 * t2063 * t2065 - 0.4e1 / 0.3e1 * … in func_pol()
4316 …* t1434 - 0.4e1 * t729 * t3658 + 0.592e3 / 0.9e1 * t114 * t1288 * t1248 * t2065 + 0.10e2 * t1961 *… in func_pol()
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| H A D | gga_c_wl.c | 463 double t2051, t2065, t2072, t2077, t2088, t2093, t2098, t2101; in func_pol() local
1659 …t2065 = 0.3e1 / 0.2e1 * t1754 - 0.8001333333333333333e-1 * t1756 - 0.12002000000000000000e0 * t176… in func_pol()
1681 v4rho4[3] = t2029 + t2051 + t2065 + t2098 + t2132 + t2147 + t2192 + t2219; 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 | 841 double t2055, t2065, t2068, t2078, t2079, t2080, t2082, t2084; in func_pol() local
1915 t2065 = t1436 * t392; in func_pol()
1917 …t435 + 0.8e1 / 0.3e1 * t58 * t432 - 0.8e1 * t964 * t73 - 0.8e1 / 0.27e2 * t2065 * t440 - 0.16e2 / … in func_pol()
2338 …* t435 + t4202 + 0.40e2 / 0.81e2 * t2435 * t392 * t1437 - 0.8e1 / 0.9e1 * t2065 * t242 * t443 + 0.… in func_pol()
2411 …t435 + t4202 + 0.40e2 / 0.81e2 * t2435 * t1014 * t440 + 0.64e2 / 0.27e2 * t2065 * t242 * t54 * t43… in func_pol()
2440 … * t2435 * t2257 * t242 + 0.16e2 / 0.9e1 * t2202 * t433 - 0.8e1 / 0.9e1 * t2065 * t1017 * t242 - 0… in func_pol()
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| H A D | lda_c_vwn_3.c | 858 double t2057, t2062, t2065, t2069, t2075, t2077, t2079, t2081; in func_pol() local
2120 t2065 = t346 * t1286; in func_pol()
2139 …9683e2 * t511 * t2057 + t341 * t2062 / 0.3e1 + 0.14420896359956903410e1 * t2065 * t1288 * t351 + 0… in func_pol()
2495 … * t526 * t94 - 0.2e1 / 0.9e1 * t479 * t2153 - 0.11536717087965522728e2 * t2065 * t3080 * t351 + 0… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_revtpss.c | 4687 double t2049, t2050, t2051, t2062, t2065, t2066, t2067, t2070; in func_pol() local
10478 t2065 = t541 * t2027; in func_pol()
13512 t8613 = t2065 * t2030; in func_pol()
15734 …t2065 * t14628 - 0.13170898365871023197e1 * t570 * t14631 - 0.65854491829355115987e0 * t2015 * t44… in func_pol()
23629 t35940 = t2065 * t8484; in func_pol()
23909 …t2065 * t8758 * t1910 + 0.23707617058567841754e2 * t3395 * t37425 * t8402 - 0.15805078039045227836… in func_pol()
25680 t47245 = t2065 * t47244; in func_pol()
27740 …t2065 * t3378 * t63110 + 0.39512695097613069591e1 * t11379 * t14660 - 0.79025390195226139182e1 * t… in func_pol()
27971 …t2065 * t57479 * t1126 - 0.39512695097613069591e1 * t8766 * t63777 * t8311 - 0.1975634754880653479… in func_pol()
28434 …t2065 * t65405 * t1126 + 0.15805078039045227836e2 * t37460 * t14780 * t4353 - 0.158050780390452278… in func_pol()
[all …]
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| H A D | hyb_mgga_x_m05.c | 2198 double t2028, t2031, t2040, t2041, t2044, t2053, t2060, t2065; in func_pol() local
3484 t2065 = t75 * t58; in func_pol()
3489 …t2092 = 0.8750e4 / 0.9e1 * t71 * t1999 + 0.5000e4 / 0.9e1 * t2065 * t2041 + 0.2500e4 * t802 * t199… in func_pol()
4015 …50 + 0.300e3 * t802 * t3270 + 0.720e3 * t267 * t3238 - 0.1000e4 / 0.3e1 * t2065 * t3286 - 0.1500e4… in func_pol()
4363 …71 * t3956 + 0.100e3 * t2053 * t3960 + 0.500e3 * t793 * t3964 + 0.200e3 * t2065 * t3964 + 0.900e3 … in func_pol()
4695 …028 * t4373 - 0.24e2 * t2044 * t4386 - 0.60e2 * t2053 * t4391 - 0.120e3 * t2065 * t4422 - 0.450e3 … in func_pol()
5328 …e1 * t71 * t7873 - 0.16400e5 / 0.9e1 * t802 * t7839 + 0.13000e5 / 0.3e1 * t2065 * t7808 + 0.19500e… in func_pol()
5758 …0.50400e5 * t2019 * t9524 - 0.5600e4 / 0.3e1 * t2065 * t9424 + 0.1000e4 * t5046 * t9451 + 0.8000e4… in func_pol()
6329 …8 * t3983 + 0.120e3 * t2044 * t4000 + 0.300e3 * t2053 * t3959 + 0.600e3 * t2065 * t3963 + 0.2250e4… in func_pol()
6340 …t10498 = -0.2000e4 * t10284 * t2053 - 0.600e3 * t10284 * t5046 - 0.4800e4 * t10288 * t2065 - 0.140… in func_pol()
[all …]
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| H A D | mgga_x_tpss.c | 1845 double t2028, t2031, t2032, t2035, t2038, t2046, t2049, t2065; in func_ferr() local
2706 …t2065 = (t21 * t2035 * t32 + 0.3e1 * t21 * t2038 - 0.3e1 / 0.16e2 * t1530 * t514 + t21 * t2049 * t… in func_ferr()
2718 …t2104 = t2065 * t45 / 0.24e2 + t727 * t243 / 0.8e1 + 0.292e3 / 0.675e3 * t260 * t743 + 0.292e3 / 0… in func_ferr()
3503 double t2057, t2058, t2059, t2065, t2068, t2076, t2079, t2082; in func_pol() local
4895 t2065 = t30 * t750; in func_pol()
4911 …t2108 = (t30 * t2059 * t41 + 0.3e1 * t30 * t273 * t760 + 0.3e1 / 0.16e2 * t2065 * t765 + t30 * t20… in func_pol()
5291 ….8e1 + 0.3e1 / 0.512e3 * t1153 * t2084 - 0.3e1 / 0.16e2 * t1153 * t2087 - t2065 * t1157 / 0.16e2 -… in func_pol()
5475 ….8e1 + 0.3e1 / 0.512e3 * t1410 * t2084 - 0.3e1 / 0.16e2 * t1410 * t2087 + t2065 * t1413 / 0.16e2 +… in func_pol()
6681 …t2065 * t2087 - 0.9e1 / 0.8e1 * t2079 * t2087 - 0.27e2 / 0.128e3 * t763 * t5996 + t5999 * t765 / 0… in func_pol()
6966 …84 + 0.3e1 / 0.4096e4 * t1153 * t6006 - 0.9e1 / 0.512e3 * t2065 * t2958 + 0.3e1 / 0.8e1 * t2065 * … in func_pol()
[all …]
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| H A D | mgga_x_pbe_gx.c | 119 double t2047, t2049, t2062, t2065, t2077, t2084, t2087, t2092; in func_unpol() local
978 t2065 = t37 * t679; in func_unpol()
1005 …43189e-1 * t344 * t20 * t679 * t2062 + 0.76556371177522216641e-1 * t185 * t2065 * t682 + 0.5037956… in func_unpol()
1084 …421758845223108740e-1 * t1288 * t2467 + 0.15311274235504443328e0 * t582 * t2065 * t889 - 0.3018359… in func_unpol()
2519 double t2045, t2049, t2053, t2056, t2059, t2063, t2064, t2065; in func_pol() local
4031 t2065 = t707 * t2064; in func_pol()
4034 …91796422897717740e-1 * t2059 * t709 * t1556 + 0.19139092794380554160e-1 * t2065 * t48 * t2045 * t1… in func_pol()
5082 t3796 = t2065 * t48 * t3783 * t1563; in func_pol()
5203 t3903 = t2065 * t48 * t3890 * t1563; in func_pol()
5338 t4010 = t2065 * t48 * t3997 * t1563; in func_pol()
[all …]
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| H A D | mgga_x_gvt4.c | 1350 double t2049, t2051, t2063, t2064, t2065, t2068, t2070, t2087; in func_pol() local
2981 t2065 = t388 * t169; in func_pol()
2983 …5 * t159 + 0.4e1 / 0.3e1 * t157 * t213 * t705 - t2064 + 0.40e2 / 0.81e2 * t2065 + 0.100e3 / 0.9e1 … in func_pol()
3031 …9 + 0.80e2 / 0.81e2 * t2051 - 0.32e2 / 0.27e2 * t2063 + 0.80e2 / 0.81e2 * t2065 + 0.328e3 / 0.27e2… in func_pol()
3057 …9e1 * t2045 - t2048 + 0.40e2 / 0.27e2 * t2051 - t2064 + 0.40e2 / 0.27e2 * t2065 - 0.8e1 / 0.9e1 * … in func_pol()
3095 … - 0.32e2 / 0.9e1 * t2271 + 0.160e3 / 0.81e2 * t2051 + 0.160e3 / 0.81e2 * t2065 + 0.40e2 / 0.27e2 … in func_pol()
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| H A D | mgga_xc_cc06.c | 1067 double t2039, t2051, t2055, t2065, t2072, t2076, t2077, t2080; in func_pol() local
2228 …t2065 = 0.22222222222222222222e-2 * t300 * t1804 * t2031 - 0.26000000000000000000e-3 * t1809 * t20… in func_pol()
2230 … v3rho2lapl[4] = t232 * t2065 + 0.2e1 * t276 * t816 + t704 * t308 + 0.2e1 * t1892 + 0.2e1 * t1895; in func_pol()
3263 t4858 = t94 * t2065; in func_pol()
3274 …2e1 * t4852 + 0.2e1 * t626 * t816 + 0.2e1 * t276 * t1956 + t4858 + t230 * t2065 + t232 * (-0.55555… in func_pol()
3299 …v4rho3lapl[6] = t1714 * t308 + 0.3e1 * t2065 * t276 + t232 * t5267 + 0.3e1 * t704 * t816 + 0.3e1 *… in func_pol()
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| H A D | mgga_x_mbeefvdw.c | 10182 t2065 = t812 * t2064; in func_ferr()
10183 t2066 = t834 * t2065; in func_ferr()
10184 t2068 = t840 * t2065; in func_ferr()
10185 t2072 = t811 * t2065; in func_ferr()
10186 t2076 = t824 * t2065; in func_ferr()
11350 t5820 = t2815 * t2065; in func_ferr()
11370 t5869 = t2912 * t2065; in func_ferr()
11371 t5875 = t2960 * t2065; in func_ferr()
11455 t6191 = t2839 * t2065; in func_ferr()
11879 t7769 = t3831 * t2065; in func_ferr()
[all …]
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| H A D | mgga_c_vsxc.c | 150 double t2043, t2048, t2051, t2053, t2054, t2056, t2063, t2065; in func_unpol() local
1273 t2065 = t1534 * t2028; in func_unpol()
1274 …* t369 + 0.24e2 * t1943 * t814 + 0.10e2 * t915 + 0.48e2 * t2063 - 0.240e3 * t2065 - 0.208e3 * t917; in func_unpol()
1779 …t4783 = 0.3200e4 * t2065 + 0.320e3 * t2029 - 0.640e3 * t2035 + 0.1280e4 * t2043 - 0.160e3 * t2054 … in func_unpol()
3141 double t2054, t2057, t2060, t2063, t2064, t2065, t2068, t2069; in func_pol() local
5262 t2065 = t2064 * t333; in func_pol()
7280 …1 * t591 * t1836 - 0.50000000000000000001e0 * t287 * t2065 - 0.50000000000000000001e0 * t305 * t20… in func_pol()
7645 …30000000000000000000e1 * t583 * t2094 - 0.15000000000000000000e1 * t583 * t2065 - 0.48245938496077… in func_pol()
11466 … * t978 * t2065 - 0.10000000000000000000e1 * t981 * t2065 - 0.10000000000000000000e1 * t287 * t594… in func_pol()
11780 …t2065 - 0.15000000000000000000e1 * t583 * t5942 - 0.48245938496077605201e2 * t1707 * t2070 - 0.150… in func_pol()
[all …]
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| H A D | mgga_x_tau_hcth.c | 1397 double t2065, t2067, t2069, t2070, t2071, t2075, t2078, t2081; in func_pol() local
2504 t2065 = t8 * t190 * t471 / 0.6e1; in func_pol()
2522 …v3rho2tau[0] = -0.4e1 / 0.3e1 * t2061 - t2065 - t2067 - t2069 - t969 * t2070 * t2071 / 0.6e1 - t96… in func_pol()
2545 …v3rho2tau[2] = -0.2e1 / 0.3e1 * t2061 - t2065 - t2067 / 0.2e1 - t2069 / 0.2e1 - 0.2e1 / 0.3e1 * t2… in func_pol()
2566 v3rho2tau[4] = -0.4e1 / 0.3e1 * t2160 - t2065 - t969 * t2203 / 0.6e1 - t969 * t2207 / 0.2e1; in func_pol()
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