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Searched refs:t1884 (Results 1 – 25 of 101) sorted by relevance

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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_pw.c581 double t1806, t1836, t1849, t1880, t1884, t1889, t1893, t1897; in func_pol() local
1488 t1884 = 0.18e2 * t851 * t380 * t750 * t335; in func_pol()
1498 … t76 - 0.8e1 * t440 * t215 * t882 + 0.36e2 * t471 * t442 * t466 - t1880 + t1884 - t1889 - t1893 - … in func_pol()
1509 …t1950 = t1880 - t1884 + t1889 + t1893 + t1897 - t1904 - t1907 + t1910 + t1921 - 0.6e1 * t1941 - t1… in func_pol()
1608 … 0.4e1 - t2163 / 0.2e1 - 0.36e2 * t1935 + t2167 + 0.3e1 * t1938 + t1880 - t1884 + t1889 - 0.12e2 *… in func_pol()
1658 … t2161 / 0.2e1 - t2163 - 0.24e2 * t1935 + 0.8e1 * t2166 + t1938 + t1880 - t1884 + t1889 + 0.2e1 * … in func_pol()
1680 … 0.4e1 * t2161 - 0.3e1 / 0.2e1 * t2163 - 0.12e2 * t1935 - t2167 + t1880 - t1884 + t1889 + 0.6e1 * … in func_pol()
1703 …t2654 = -0.2e1 * t2163 - 0.48e2 * t2166 + t1880 - t1884 + t1889 + 0.12e2 * t2396 - 0.48e2 * t2169 … in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_xc_th1.c539 double t1872, t1873, t1876, t1877, t1880, t1881, t1884, t1903; in func_pol() local
1393 …t1884 = -0.16e2 / 0.27e2 * t215 * t871 - 0.8e1 / 0.27e2 * t33 * t1844 + 0.8e1 / 0.9e1 * t1695 * t1… in func_pol()
1394 …t1884 / 0.2e1 + 0.3e1 / 0.4e1 * t231 * t890 + 0.3e1 / 0.2e1 * t323 * t754 + 0.55e2 / 0.72e2 * t943… in func_pol()
1434 …t353 * t705 + t72 * t1884 / 0.2e1 + 0.11e2 / 0.12e2 * t241 * t890 + 0.11e2 / 0.6e1 * t343 * t754 +… in func_pol()
1971 …72e2 * t580 * t857 + 0.3e1 / 0.4e1 * t583 * t842 + 0.4e1 / 0.3e1 * t225 * t1884 + t30 * t4134 / 0.… in func_pol()
2010 …t1884 + 0.11e2 / 0.6e1 * t343 * t1727 + t72 * t4134 / 0.2e1 + 0.5e1 / 0.3e1 * t236 * t1884 + 0.5e1… in func_pol()
2073 …e1 + 0.11e2 / 0.12e2 * t241 * t2228 + 0.11e2 / 0.4e1 * t343 * t1884 + 0.5e1 / 0.2e1 * t338 * t1884; in func_pol()
2074 …t1884 + t55 * t4629 / 0.2e1 + 0.7e1 / 0.2e1 * t3998 + 0.8e1 * t4002 + 0.27e2 / 0.2e1 * t4006 + 0.2… in func_pol()
H A Dgga_x_hcth_a.c685 double t1846, t1848, t1874, t1875, t1877, t1879, t1884, t1891; in func_pol() local
1607 t1884 = t7 * t375 * t149; in func_pol()
1612 …875 + 0.7e1 / 0.2e1 * t1877 - t7 * t1879 * t88 / 0.2e1 - 0.5e1 / 0.27e2 * t1884 + t7 * t668 * t181… in func_pol()
1640 …t1846 + 0.4e1 / 0.9e1 * t1874 - 0.2e1 / 0.3e1 * t1877 - 0.10e2 / 0.27e2 * t1884 - t1891 / 0.9e1 - … in func_pol()
1667 …- t2084 / 0.3e1 + t2103 / 0.3e1 + t1798 + t1843 + t1875 - 0.5e1 / 0.9e1 * t1884 - 0.5e1 / 0.9e1 * … in func_pol()
1691 …t1099 - 0.2e1 / 0.3e1 * t2296 - 0.2e1 / 0.3e1 * t2303 - 0.20e2 / 0.27e2 * t1884 - 0.20e2 / 0.27e2 … in func_pol()
H A Dgga_x_2d_b86_mgc.c476 double t1880, t1883, t1884, t1900, t1901, t1904, t1916, t1922; in func_pol() local
1339 t1884 = t430 * t139; in func_pol()
1341 …v4rho3sigma[2] = -0.6e1 * t797 * t139 * t82 * t206 + t120 * t1884 * t432 - 0.4e1 * t120 * t328 * t… in func_pol()
1387 … * t671 / t1715 / t33 * t1726) - 0.36e2 * t2001 - 0.18e2 * t2010 + t120 * t1884 * t698 - 0.6e1 * t… in func_pol()
H A Dgga_x_vmt84.c896 double t1877, t1881, t1884, t1891, t1893, t1895, t1901, t1911; in func_pol() local
1847 t1884 = 0.5e1 / 0.9e1 * t894; in func_pol()
1915 …t2177 = -0.6e1 * t865 - 0.6e1 * t869 - 0.2e1 * t878 - t1881 - 0.2e1 * t885 - 0.2e1 * t890 - t1884 … in func_pol()
1957 … + 0.3e1 / 0.2e1 * t1022 + t1217 - 0.3e1 / 0.4e1 * t900 - t1008 - t1881 - t1884 + 0.3e1 / 0.4e1 * … in func_pol()
1993 …t2615 = -t1881 - t1884 + t897 / 0.2e1 - t1158 / 0.3e1 - t1161 / 0.9e1 - 0.2e1 / 0.3e1 * t1164 - t1… in func_pol()
2015 …e1 - t1146 / 0.2e1 + t1150 / 0.3e1 - 0.3e1 / 0.4e1 * t1153 + 0.3e1 / 0.4e1 * t1025 - t1881 - t1884; in func_pol()
2021 …t2832 = 0.4e1 / 0.3e1 * t1057 - t1881 - t1884 + t1025 - 0.3e1 / 0.2e1 * t1153 - 0.2e1 * t1223 - 0.… in func_pol()
H A Dgga_x_sfat_pbe.c1691 double t1883, t1884, t1885, t1888, t1890, t1893, t1894, t1898; in func_ferr() local
2450 t1884 = t437 * t9; in func_ferr()
2451 t1885 = t1884 * t1863; in func_ferr()
2947 t4623 = t1884 * t11; in func_ferr()
3249 double t1881, t1884, t1886, t1887, t1888, t1891, t1902, t1912; in func_pol() local
4565 t1884 = t1759 * t373; in func_pol()
4566 t1886 = t1884 * t418 * t1556; in func_pol()
5964 t5153 = t1884 * t1173; in func_pol()
5969 t5167 = t1884 * t1179 * t1556; in func_pol()
6210 t5724 = t1884 * t1619; in func_pol()
[all …]
H A Dgga_c_revtca.c2868 t1884 = t167 * t126; in func_pol()
2869 t1885 = t510 * t1884; in func_pol()
2913 t1963 = t566 * t1884; in func_pol()
3761 t3697 = t3208 * t1884 * t37 * t742; in func_pol()
4513 t6171 = t1606 * t1501 * t1884 * t128; in func_pol()
4514 t6175 = t1606 * t1506 * t1884 * t128; in func_pol()
4663 t6591 = t1606 * t1787 * t1884 * t128; in func_pol()
4664 t6595 = t1606 * t1792 * t1884 * t128; in func_pol()
5600 t9031 = t1606 * t2221 * t1884 * t128; in func_pol()
5617 t9104 = t7648 * t2109 * t1884 * t128; in func_pol()
[all …]
H A Dgga_x_pbea.c460 double t1884, t1898, t1901, t1904, t1907, t1933, t1955, t1966; in func_pol() local
1411 …t1884 = -t591 * t570 * t268 * t8 / 0.3e1 - t229 * t230 * t97 * t669 / 0.2e1 + t229 * t570 * t8 * t… in func_pol()
1428 …t2030 = t9 * (t1884 + t1933 + t1979 + t2020) + t736 + t740 + t744 - t748 + 0.48162486048679292933e… in func_pol()
H A Dgga_k_pearson.c558 double t1854, t1856, t1858, t1861, t1863, t1870, t1878, t1884; in func_pol() local
1415 …t1884 = 0.2e1 * t730 + 0.4e1 / 0.3e1 * t733 + 0.4e1 * t736 + 0.2e1 * t739 + t785 + t787 + t790 + t… in func_pol()
1418 v4rho4[3] = t1870 + t1878 + t1884 + t1890; in func_pol()
H A Dgga_xc_b97.c1694 double t1874, t1875, t1877, t1879, t1880, t1882, t1884, t1885; in func_pol() local
3418 t1884 = t700 * t521; in func_pol()
3419 t1885 = t1884 * t237; in func_pol()
3503 …53159941e-3 * t1530 + t1433 + t1441 - t1423 + 0.15545000000000000000e-1 * t1884 * t210 + 0.1554500… in func_pol()
4757 t4752 = t1884 * t526; in func_pol()
5362 t6299 = t1884 * t836; in func_pol()
6020 t7758 = t1884 * t1025; in func_pol()
7217 t12410 = t1884 * t1066; in func_pol()
7262 t12651 = t1884 * t1304; in func_pol()
7724 …72 - 0.10000000000000000000e1 * t4956 * t861 - 0.20000000000000000000e1 * t1884 * t2032 - 0.100000… in func_pol()
[all …]
H A Dgga_x_cap.c893 double t1883, t1884, t1886, t1889, t1892, t1894, t1899, t1901; in func_pol() local
1889 t1884 = t1883 / 0.3e1; in func_pol()
1895 … + t814 * t338 * t851 * t77 / 0.3e1 + t829 * t361 * t838 * t124 / 0.3e1 + t1884 - 0.5e1 / 0.27e2 *… in func_pol()
1976 …t2461 = t1873 + t829 * t361 * t1126 * t124 / 0.3e1 + t814 * t338 * t1117 * t77 / 0.3e1 + t1884 - 0… in func_pol()
H A Dgga_x_bayesian.c823 double t1856, t1861, t1866, t1869, t1872, t1880, t1883, t1884; in func_pol() local
1814 t1884 = t1883 / 0.3e1; in func_pol()
1816 … t1872 - 0.3e1 / 0.2e1 * t7 * t362 * t319 * t8 + 0.25e2 / 0.6e1 * t1880 + t1884 + 0.7e1 / 0.2e1 * … in func_pol()
1883 … 0.36e2 * t1577 - 0.5e1 / 0.9e1 * t1866 + t1872 / 0.3e1 - t1880 / 0.3e1 + t1884 + t1905 - 0.5e1 / … in func_pol()
H A Dgga_x_ncap.c111 double t1877, t1878, t1884, t1887, t1890, t1891, t1896, t1897; in func_unpol() local
838 t1884 = t280 * t297; in func_unpol()
850 …1 * t627 * t1878 - 0.32e2 * t635 * t1012 * t1877 + 0.8e1 / 0.9e1 * t619 * t1884 - 0.8e1 / 0.9e1 * … in func_unpol()
895 …0.18e2 * t138 * t557 + t138 * t570 / 0.6e1 - t138 * t567 / 0.6e1 - t311 * t1884 / 0.6e1 + t311 * t… in func_unpol()
954 …- 0.4e1 / 0.9e1 * t1981 * t1002 + 0.2e1 / 0.9e1 * t1981 * t1009 + t1259 * t1884 / 0.48e2 - t1259 *… in func_unpol()
2224 double t1883, t1884, t1886, t1887, t1891, t1892, t1894, t1895; in func_pol() local
3357 t1884 = t1744 + t1883; in func_pol()
3358 t1886 = t7 * t63 * t1884; in func_pol()
4151 …10 / 0.2e1 + t7 * t98 * t56 * t4528 / 0.2e1 + t4292 / 0.4e1 - t7 * t186 * t1884 * t187 / 0.2e1 - t… in func_pol()
4157 t4583 = t7 * t192 * t1884; in func_pol()
[all …]
H A Dgga_c_pbe_vwn.c114 double t1872, t1883, t1884, t1900, t1916, t1934, t1935, t1956; in func_unpol() local
848 t1884 = t473 * t177; in func_unpol()
1008 double t1840, t1874, t1884, t1905, t1915, t1926, t1927, t1949; in func_ferr() local
1731 t1884 = t418 * t896; in func_ferr()
1732 … * t171 * t386 + 0.2e1 * t195 * t421 * t190 * t814 - 0.24e2 * t1884 * t900 + 0.12e2 * t1884 * t912… in func_ferr()
1936 double t1884, t1885, t1886, t1887, t1888, t1889, t1890, t1891; in func_pol() local
3448 t1884 = t100 * t1883; in func_pol()
3449 t1885 = 0.144e3 * t1884; in func_pol()
3792 t2582 = 0.48e2 * t1884; in func_pol()
4822 t4863 = 0.576e3 * t1884; in func_pol()
[all …]
H A Dgga_x_lv_rpw86.c1057 double t1881, t1884, t1887, t1888, t1891, t1899, t1906, t1907; in func_pol() local
2076 t1884 = t622 * t746; in func_pol()
2077 …* t262 * t738 + 0.11674227876009783576e-7 * t38 * t1881 - 0.18115181186911733135e-7 * t621 * t1884; in func_pol()
2534 …t4227 = 0.14492144949529386508e-6 * t1454 * t1884 - 0.71575668358831090340e-13 * t1839 * t389 + 0.… in func_pol()
2618 …058701456e-7 * t1450 * t1650 * t746 - 0.21738217424294079762e-6 * t1664 * t1884 + 0.16733077019798… in func_pol()
H A Dgga_k_meyer.c696 double t1840, t1873, t1884; in func_ferr() local
1166 …t1884 = -t42 * t280 * t745 * t64 / 0.864e3 - 0.3e1 / 0.8e1 * t778 * t315 - 0.3e1 / 0.8e1 * t778 * … in func_ferr()
1168 …v4sigma4[0] = 0.3e1 / 0.10e2 * t50 * t5 * (0.5e1 / 0.72e2 * (t1782 + t1884) * sigma[0] * t42 + 0.5… in func_ferr()
1299 double t1876, t1877, t1884, t1885, t1886, t1897, t1898, t1901; in func_pol() local
2280 …t1884 = -t1819 * t1460 / 0.3e1 - t160 * t1823 / 0.864e3 - t160 * t1826 / 0.864e3 + t31 * t1829 * t… in func_pol()
2281 …22 - t586 * t1807 * t588 / 0.144e3 + t586 * t587 * t1811 / 0.288e3 - t1815 * t1455 / 0.3e1 + t1884; in func_pol()
H A Dgga_k_pw86.c563 double t1844, t1858, t1881, t1884, t1900, t1911, t1927, t1943; in func_pol() local
1474 …t1884 = 0.8e1 / 0.675e3 * t1368 - 0.4e1 / 0.9e1 * t6 * t545 * t294 * t1608 * t663 + 0.4e1 / 0.45e2… in func_pol()
1475 …t1900 = t8 * (t1674 + t1715 + t1758 + t1776 + t1801 + t1831 + t1844 + t1884) - 0.14e2 / 0.225e3 * … in func_pol()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/
H A Dmpfr_cutoff_gamma.f90242 TYPE(mpfr_type) :: t1852,t1856,t1859,t1878,t1882,t1884,t1886,t1888,t1890,& local
1123 t1884 = t662 * t1082
1128 * t1083 + .CONVERT."0.11927552E8" * t1882 - .CONVERT."0.11927552E8" * t1884 + &
1278 …t2233 = .CONVERT."-0.1353777152E10" * t1884 + .CONVERT."0.9390391296E10" * t1886 + .CONVERT."0.58…
1592 …- .CONVERT."0.637894656E9" * t1852 + t2725 + .CONVERT."0.99779936256E11" * t1884 - .CONVERT."0.546…
1665 …t3038 = .CONVERT."0.6168840437760E13" * t1882 - .CONVERT."0.6168840437760E13" * t1884 + .CONVERT."…
1893 - .CONVERT."0.351100404695040E15" * t1884 + .CONVERT."0.1362751859589120E16" * t1886 &
2155 t1882 + .CONVERT."0.19236671329075200E17" * t1884 - .CONVERT."0.65642226664734720E17" * &
2435 * t1884 - .CONVERT."0.3181515994160824320E19" * t1886 &
/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/
H A Dmpfr_cutoff_gamma.f90242 TYPE(mpfr_type) :: t1852,t1856,t1859,t1878,t1882,t1884,t1886,t1888,t1890,& local
1123 t1884 = t662 * t1082
1128 * t1083 + .CONVERT."0.11927552E8" * t1882 - .CONVERT."0.11927552E8" * t1884 + &
1278 …t2233 = .CONVERT."-0.1353777152E10" * t1884 + .CONVERT."0.9390391296E10" * t1886 + .CONVERT."0.58…
1592 …- .CONVERT."0.637894656E9" * t1852 + t2725 + .CONVERT."0.99779936256E11" * t1884 - .CONVERT."0.546…
1665 …t3038 = .CONVERT."0.6168840437760E13" * t1882 - .CONVERT."0.6168840437760E13" * t1884 + .CONVERT."…
1893 - .CONVERT."0.351100404695040E15" * t1884 + .CONVERT."0.1362751859589120E16" * t1886 &
2155 t1882 + .CONVERT."0.19236671329075200E17" * t1884 - .CONVERT."0.65642226664734720E17" * &
2435 * t1884 - .CONVERT."0.3181515994160824320E19" * t1886 &
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_c_tpssloc.c1119 t1884 = t321 * t1883; in func_unpol()
3253 t1884 = t652 * t1883; in func_ferr()
9814 t1884 = t1881 * t1883; in func_pol()
12574 t7729 = t1884 * t7728; in func_pol()
14568 t12829 = t1884 * t12828; in func_pol()
22740 t34834 = t1884 * t34832 * t7758; in func_pol()
22741 t34855 = t1884 * t7727 * t7753; in func_pol()
22754 t34919 = t1884 * t7727 * t7731; in func_pol()
22774 t35019 = t1884 * t7727 * t7723; in func_pol()
22923 t35650 = t1884 * t7727 * t7710; in func_pol()
[all …]
H A Dmgga_x_sa_tpss.c4894 t1884 = t11 * t478 * t158; in func_ferr()
5083 t2428 = t1884 * t2425; in func_ferr()
5331 t3251 = t1884 * t3250; in func_ferr()
5348 t3286 = t1884 * t3274; in func_ferr()
5417 t3461 = t1884 * t3455; in func_ferr()
5425 t3479 = t1884 * t3478; in func_ferr()
5634 t4203 = t1884 * t4196; in func_ferr()
5682 t4323 = t1884 * t4322; in func_ferr()
5689 t4337 = t1884 * t4334; in func_ferr()
5842 t4773 = t1884 * t4772; in func_ferr()
[all …]
H A Dmgga_c_m08.c1986 double t1871, t1874, t1875, t1876, t1878, t1883, t1884, t1885; in func_ferr() local
2824 t1884 = 0.1e1 / t1883; in func_ferr()
2825 t1885 = t164 * t1884; in func_ferr()
3623 t6782 = t1059 * t1884; in func_ferr()
3879 double t1871, t1874, t1877, t1880, t1881, t1884, t1887, t1890; in func_pol() local
5851 t1884 = t72 * t86; in func_pol()
8072 …63 * t9533 - 0.480e3 * t1881 * t9527 - 0.280e3 * t1884 * t9527 - 0.10e2 * t863 * t9530 + 0.84e2 * … in func_pol()
10273 …44e3 * t1881 * t21851 + 0.432e3 * t1881 * t21858 + 0.84e2 * t1884 * t21851 + 0.252e3 * t1884 * t21… in func_pol()
10884 …2e2 * t1821 * t27718 + 0.432e3 * t1881 * t27715 + 0.252e3 * t1884 * t27715 + 0.252e3 * t1884 * t27… in func_pol()
12772 …63 * t48023 + 0.640e3 * t1881 * t47879 + 0.1120e4 / 0.3e1 * t1884 * t47879 - 0.280e3 * t1884 * t47… in func_pol()
[all …]
H A Dmgga_x_revtm.c106 double t1860, t1861, t1864, t1865, t1868, t1879, t1881, t1884; in func_unpol() local
951 t1884 = t318 * t456; in func_unpol()
1194 …t697 + 0.324e3 * t545 * t2748 + 0.108e3 * t545 * t2751 - 0.9e1 / 0.50e2 * t1884 * t743 - 0.9e1 / 0… in func_unpol()
1298 … * t234 - 0.12e2 * t690 * t814 - 0.6e1 * t133 * t3031 - 0.9e1 / 0.100e3 * t1884 * t854 - 0.9e1 / 0… in func_unpol()
1438 … t133 * t3502 - 0.18e2 * t2717 * t307 + t3529 * t108 - 0.27e2 / 0.100e3 * t1884 * t1050 + 0.226397… in func_unpol()
1785 …t1789 * t288 + (t6369 + t6409 + t6448 + t6489) * t108 - 0.9e1 / 0.100e3 * t1884 * t1502 - 0.12e2 *… in func_unpol()
1919 …t7886 = t2962 - 0.9e1 / 0.50e2 * t1884 * t2179 - 0.648e3 * t4461 * t2995 + 0.108e3 * t1955 * t2315… in func_unpol()
1969 … t234 - 0.12e2 * t2270 * t550 - 0.12e2 * t2270 * t556 - 0.9e1 / 0.100e3 * t1884 * t2217 - t822 + t… in func_unpol()
2033 …7 * t343 * t2433 - 0.9e1 / 0.50e2 * t1884 * t2460 + 0.11319880444444444445e2 * t6209 * t3294 - 0.9… in func_unpol()
2035 …* t5120 * t953 - 0.9e1 / 0.100e3 * t457 * t3260 * t217 - 0.9e1 / 0.50e2 * t1884 * t2463 + 0.171e3 … in func_unpol()
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_vwn.F1239 t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & local
2191 t1884 = t1826*t12
2200 t773 + t1884*t126 - 0.80e1_dp*t1886*t92 + 0.40e1_dp*t352*t832 &
2203 t1939 = -t1884 - 0.80e1_dp*t1886 - 0.1200e2_dp*t1894 - 0.40e1_dp*t1829 &
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_vwn.F1239 t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & local
2191 t1884 = t1826*t12
2200 t773 + t1884*t126 - 0.80e1_dp*t1886*t92 + 0.40e1_dp*t352*t832 &
2203 t1939 = -t1884 - 0.80e1_dp*t1886 - 0.1200e2_dp*t1894 - 0.40e1_dp*t1829 &

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