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Searched refs:t1739 (Results 1 – 25 of 98) sorted by relevance

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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_k_ol1.c404 double t1701, t1708, t1710, t1713, t1726, t1728, t1737, t1739; in func_pol() local
1208 t1739 = t467 * t310; in func_pol()
1213 …v4rho3sigma[2] = 0.50e2 / 0.9e1 * t1737 + 0.50e2 / 0.9e1 * t1739 + 0.25e2 / 0.3e1 * t1741 - t1744 … in func_pol()
1233 …v4rho3sigma[5] = 0.50e2 / 0.27e2 * t1737 + 0.100e3 / 0.27e2 * t1739 + 0.25e2 / 0.9e1 * t1741 - t17… in func_pol()
1248 …0e3 / 0.27e2 * t1793 + t1796 - 0.50e2 / 0.9e1 * t1797 + 0.50e2 / 0.27e2 * t1739 - t1744 + 0.20e2 /… in func_pol()
H A Dgga_x_gg99.c5119 t1739 = t467 * t467; in func_pol()
5120 t1740 = t32 * t1739; in func_pol()
5124 t1756 = t938 * t1739; in func_pol()
5127 t1772 = t935 * t1739; in func_pol()
5128 t1776 = t943 * t1739; in func_pol()
7143 t5489 = t3001 * t1739; in func_pol()
7174 t5601 = t958 * t1739; in func_pol()
7508 t6372 = t1739 * t467; in func_pol()
7531 t6494 = t1739 * t123; in func_pol()
7533 t6501 = t1739 * t327; in func_pol()
[all …]
H A Dgga_x_ft97.c1049 double t1739, t1742, t1744, t1745, t1748, t1749, t1750, t1753; in func_pol() local
2070 t1739 = t1738 * t192; in func_pol()
2077 …t1717 + 0.288e3 * t1720 * t1722 - 0.96e2 * t184 * t1728 - 0.96e2 * t628 * t1739 - 0.48e2 * t176 * … in func_pol()
2153 …513 - 0.108e3 * t1885 * t1517 + 0.108e3 * t266 * t1728 + 0.108e3 * t745 * t1739 + 0.216e3 * t1888 … in func_pol()
2518 ….1536e4 * t1528 * t59 * t3551 + 0.176e3 * t482 * t748 + 0.864e3 * t1509 * t1739 + 0.2672e4 * t1498… in func_pol()
2594 …t184 * t249 * t1739 - 0.48e2 * t176 * t1903 - 0.96e2 * t628 * t4330 + 0.1728e4 * t179 * t640 * t59… in func_pol()
2649 …t4551 = 0.432e3 * t266 * t249 * t1739 + 0.216e3 * t752 * t3941 + 0.432e3 * t1888 * t1739 + 0.144e3… in func_pol()
H A Dgga_k_exp4.c528 double t1690, t1702, t1713, t1728, t1731, t1737, t1739, t1742; in func_pol() local
1333 t1739 = t112 * t248 * t840; in func_pol()
1341 …t1779 = t1731 / 0.5e1 + t79 * t190 * t828 / 0.2e1 + t1737 + t1739 / 0.3e1 - 0.2e1 / 0.27e2 * t1742… in func_pol()
1364 …13 * t1974 + 0.3e1 * t112 * t699 * t318 + 0.4e1 * t1737 + 0.4e1 / 0.3e1 * t1739 - 0.8e1 / 0.27e2 *… in func_pol()
H A Dgga_x_bayesian.c819 double t1720, t1725, t1727, t1729, t1731, t1733, t1739, t1741; in func_pol() local
1778 t1739 = t7 * t362 * t95; in func_pol()
1792 …2e1 / 0.9e1 * t1731 - t7 * t245 * t51 * t1733 / 0.2e1 - 0.20e2 / 0.27e2 * t1739 - 0.5e1 / 0.27e2 *… in func_pol()
1828 …t1971 = t1727 / 0.27e2 + t1731 / 0.9e1 - 0.5e1 / 0.9e1 * t1739 + t1752 / 0.27e2 + t1756 / 0.9e1 - … in func_pol()
1853 …t2141 = t1731 / 0.27e2 - 0.10e2 / 0.27e2 * t1739 + t1756 / 0.27e2 - 0.10e2 / 0.27e2 * t1764 + 0.2e… in func_pol()
1883 … t1880 / 0.3e1 + t1884 + t1905 - 0.5e1 / 0.9e1 * t1907 - 0.5e1 / 0.27e2 * t1739 - 0.5e1 / 0.27e2 *… in func_pol()
H A Dgga_x_c09x.c570 double t1718, t1721, t1724, t1730, t1733, t1736, t1739, t1745; in func_pol() local
1434 t1739 = t7 * t271 * t757; in func_pol()
1436 … * t130 / 0.3e1 - t1730 / 0.3e1 - t1733 / 0.3e1 - 0.7e1 / 0.3e1 * t1736 - t1739 / 0.3e1 - t7 * t14… in func_pol()
1459 …t1998 = -t1730 / 0.2e1 - t1733 / 0.2e1 + t1736 - t1739 / 0.2e1 + t1745 / 0.9e1 - 0.5e1 / 0.9e1 * t… in func_pol()
H A Dgga_x_mpbe.c777 double t1731, t1734, t1739, t1742, t1744, t1746, t1748, t1757; in func_pol() local
1691 t1739 = t7 * t348 * t411; in func_pol()
1704 …t1793 = t1649 + t1653 - 0.5e1 / 0.9e1 * t1655 - 0.3e1 / 0.8e1 * t7 * t17 * t1734 + t1739 / 0.2e1 -… in func_pol()
1768 … * t440 * t1015 * t123 / 0.3e1 + t1649 + t1653 - 0.5e1 / 0.12e2 * t1655 + t1739 / 0.4e1 - t1742 / … in func_pol()
1804 ….9e1 * t931 * t940 * t441 * t8 + t1649 + t1653 - 0.5e1 / 0.18e2 * t1655 + t1739 / 0.12e2 - t2026 /… in func_pol()
H A Dgga_x_sfat_pbe.c3243 double t1739, t1743, t1744, t1749, t1750, t1751, t1755, t1758; in func_pol() local
4501 t1739 = t192 * t1710; in func_pol()
4525 …7450726162391803e-4 * t1778 * t1736 - 0.21236248369722271421e-4 * t1778 * t1739 + t45 * t46 * t180… in func_pol()
4526 …2614107906551256e-3 * t1735 * t1736 + 0.22651998261037089516e-3 * t1735 * t1739 - 0.4e1 / 0.3e1 * … in func_pol()
5796 …* t1739 + 0.97033631296112195838e-4 * t709 * t4809 * t1 * t1726 + 0.77788887448253553550e-4 * t482… in func_pol()
5798 …t4560 * t4566 - 0.12836132347921017392e-2 * t4552 * t1739 + 0.22651998261037089516e-3 * t4556 * t1… in func_pol()
6115 …2352178487175408e-4 * t5505 * t1736 - 0.63708745109166814263e-4 * t5505 * t1739 + 0.29110089388833… in func_pol()
6117 …7842323719653769e-3 * t5372 * t1736 + 0.67955994783111268548e-3 * t5372 * t1739 - 0.15997666368920… in func_pol()
7198 …t1739 + 0.55316542185424749189e-2 * t11711 * t1736 + 0.8e1 / 0.9e1 * t45 * t237 * t4827 + 0.996053… in func_pol()
7211 …t1739 - 0.30154890683508550269e-5 * t11776 * t3550 - 0.46649356890158273110e-5 * t11776 * t3554 - … in func_pol()
[all …]
H A Dgga_x_lcgau.c1103 double t1693, t1694, t1696, t1700, t1707, t1708, t1715, t1739; in func_pol() local
1780 t1739 = 0.1e1 / t184 / t1138 / t5 / t608 / t1141 / 0.4e1; in func_pol()
1781 t1740 = t319 * t1739; in func_pol()
1817 t1947 = t1739 * t163; in func_pol()
1906 …t2670 = -0.2e1 * t2 * t618 * t198 * t50 * t322 * t931 + 0.36e2 * t2591 * t834 * t1739 * t1742 * t2… in func_pol()
H A Dgga_x_am05.c100 double t1704, t1712, t1713, t1719, t1726, t1730, t1739, t1751; in func_unpol() local
717 t1739 = t677 / t10 / t1299; in func_unpol()
720 …181 * t658 / 0.288e3 - 0.2e1 / 0.729e3 * t1297 * t1739 * t1306 * t1521 + 0.2e1 / 0.729e3 * t676 * … in func_unpol()
731 …t916 * t1272 / 0.18e2 + t919 * t1269 / 0.18e2 + 0.2e1 / 0.729e3 * t1297 * t1739 * t1308 + 0.17e2 /… in func_unpol()
1686 double t1728, t1729, t1730, t1734, t1735, t1736, t1739, t1740; in func_pol() local
2720 t1739 = params->c * t754; in func_pol()
2721 t1740 = t1739 * t756; in func_pol()
3056 t2630 = t1739 * t1129; in func_pol()
H A Dgga_x_vmt.c723 double t1713, t1719, t1722, t1725, t1727, t1732, t1739, t1742; in func_pol() local
1639 t1739 = t7 * t643 * t860; in func_pol()
1645 …t132 / 0.2e1 - 0.5e1 / 0.27e2 * t1732 + t7 * t637 * t178 * t638 / 0.9e1 - t1739 / 0.6e1 + t1743 - … in func_pol()
1702 …0e2 / 0.27e2 * t1719 - 0.41e2 / 0.9e1 * t1725 - 0.10e2 / 0.27e2 * t1732 - t1739 / 0.9e1 + 0.4e1 / … in func_pol()
H A Dgga_x_ak13.c789 double t1696, t1710, t1716, t1719, t1720, t1733, t1736, t1739; in func_pol() local
1726 t1739 = t7 * t316 * t781; in func_pol()
1738 … 0.2e1 - 0.3e1 / 0.2e1 * t7 * t347 * t304 * t8 + 0.25e2 / 0.6e1 * t1736 - t1739 / 0.2e1 - t1742 / … in func_pol()
1794 …t934 - t7 * t232 * t1960 * t45 * t1962 / 0.3e1 + 0.41e2 / 0.9e1 * t1736 - t1739 / 0.3e1 - t1742 / … in func_pol()
H A Dgga_x_pbeint.c761 double t1739, t1740, t1741, t1746, t1748, t1750, t1752, t1754; in func_pol() local
1754 t1739 = 0.1e1 / t261 / t1737; in func_pol()
1755 t1740 = t1739 * t16; in func_pol()
1786 t1896 = t4 * t6 * t1739; in func_pol()
H A Dgga_x_hjs_b88_v2.c1023 t1739 = t531 * t531; in func_unpol()
1024 t1740 = t853 * t1739; in func_unpol()
1724 t4723 = t2537 * t1739; in func_unpol()
1797 t5069 = t2906 * t1739; in func_unpol()
1882 t5662 = t1739 * t531; in func_unpol()
1909 t5753 = t1739 * t576; in func_unpol()
1949 t5918 = t4710 * t1739; in func_unpol()
1963 t5948 = t5947 * t1739; in func_unpol()
2933 t14391 = t1739 * t430; in func_unpol()
3095 t16180 = t1739 * t1739; in func_unpol()
[all …]
H A Dgga_c_gaploc.c4215 t1739 = t684 * t62; in func_ferr()
4216 t1740 = 0.1e1 / t1739; in func_ferr()
9109 t1739 = t1738 * t132; in func_pol()
9112 t1742 = t1739 * t1741; in func_pol()
9500 t2553 = t1739 * t2552; in func_pol()
9667 t2931 = t1739 * t2930; in func_pol()
10837 t5571 = t1739 * t5570; in func_pol()
10860 t5614 = t1739 * t5613; in func_pol()
11603 t7354 = t1739 * t5136; in func_pol()
11631 t7421 = t1739 * t7420; in func_pol()
[all …]
H A Dgga_k_meyer.c695 double t1709, t1739, t1745, t1756, t1782, t1824, t1829, t1836; in func_ferr() local
1157 t1739 = 0.1e1 / t820; in func_ferr()
1160 … * t783 - 0.7e1 / 0.1152e4 * t531 * t771 - 0.25e2 / 0.32e2 * t110 * t71 * t1739 * t64 - t1745 * t4… in func_ferr()
1163 t1836 = t9 * t1739; in func_ferr()
1165 …t1873 = -0.5e1 / 0.384e3 * t19 * t822 * t22 * t29 + 0.5e1 / 0.2304e4 * t10 * t1739 * t294 - t1824 … in func_ferr()
1166 … * t802 + 0.11e2 / 0.16e2 * t311 * t806 - 0.25e2 / 0.32e2 * t110 * t184 * t1739 + 0.5e1 / 0.192e3 … in func_ferr()
H A Dgga_x_ssb_sw.c701 double t1723, t1725, t1730, t1737, t1739, t1741, t1742, t1744; in func_pol() local
1633 …t1739 = -0.5e1 / 0.2e1 * t1683 - 0.5e1 / 0.36e2 * t1686 - 0.3e1 / 0.2e1 * t7 * t391 * t156 - t1692… in func_pol()
1657 …t1876 = t9 * (t1739 + t1790 + t1844 + t1867) + 0.3e1 / 0.2e1 * t808 + t1030 - 0.3e1 / 0.2e1 * t814… in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_x_m11.c4255 t1739 = t369 * t377; in func_pol()
4256 t1741 = t375 * t1739 * t379; in func_pol()
4272 t1787 = t375 * t1739 * t395; in func_pol()
4324 t1905 = t375 * t1739 * t689; in func_pol()
4339 t1952 = t375 * t1739 * t700; in func_pol()
5175 t4709 = t375 * t1739 * t1760; in func_pol()
5179 t4719 = t375 * t1739 * t1755; in func_pol()
5193 t4770 = t375 * t1739 * t1800; in func_pol()
5196 t4779 = t375 * t1739 * t1796; in func_pol()
5762 t6351 = t375 * t1739 * t2685; in func_pol()
[all …]
H A Dmgga_k_pc07.c5135 t1739 = t994 * t217; in func_ferr()
5140 t1772 = t1739 * t310; in func_ferr()
5541 t3098 = t1739 * t639; in func_ferr()
6076 t5489 = t1739 * t304; in func_ferr()
6083 t5545 = t1739 * t64; in func_ferr()
9747 t1740 = t350 * t1739; in func_pol()
11235 t5445 = t1739 * t343; in func_pol()
11247 t5481 = t899 * t1739; in func_pol()
11268 t5550 = t865 * t1739; in func_pol()
11989 t7609 = t159 * t1739; in func_pol()
[all …]
H A Dhyb_mgga_x_js18.c105 double t1721, t1731, t1736, t1739, t1742, t1747, t1751, t1756; in func_unpol() local
1132 t1739 = t251 * t10; in func_unpol()
4308 double t1733, t1736, t1739, t1740, t1743, t1749, t1754, t1759; in func_ferr() local
5329 t1739 = t256 * t691; in func_ferr()
6327 …t1739 * t5670 - 0.35217405827160493826e-1 * t5673 * t1263 - 0.62888224691358024692e0 * t4364 * t21… in func_ferr()
6583 t6623 = t1739 * t6622; in func_ferr()
7518 …t1739 * t13837 + 0.13583856533333333333e1 * t4376 * t13842 - 0.30186347851851851852e0 * t4370 * t5… in func_ferr()
7933 …t1739 * t17469 - 0.30186347851851851851e0 * t5665 * t5460 - 0.30186347851851851852e0 * t1739 * t17… in func_ferr()
7968 …t1739 * t18499 - 0.30186347851851851852e0 * t1739 * t18503 + 0.15093173925925925926e1 * t4370 * t7… in func_ferr()
8225 …t1739 * t21304 + 0.22639760888888888889e1 * t1739 * t21307 - 0.10187892400000000000e2 * t4376 * t2… in func_ferr()
[all …]
H A Dmgga_x_tau_hcth.c1385 double t1730, t1733, t1736, t1739, t1742, t1745, t1748, t1749; in func_pol() local
2363 t1739 = t157 * t168; in func_pol()
2369 …e2 * t1733 * t155 - 0.4250e4 / 0.9e1 * t1736 * t1730 - 0.6500e4 / 0.9e1 * t1739 * t1730 + 0.2500e4… in func_pol()
2582 …0.3e1 * t1736 * t2244 - 0.40e2 / 0.9e1 * t349 * t297 + 0.1300e4 / 0.3e1 * t1739 * t2244 + 0.80e2 /… in func_pol()
2810 …1] - 0.170e3 * t1736 * t2518 + 0.100e3 / 0.3e1 * t802 * t1035 - 0.260e3 * t1739 * t2518 + 0.120e3 … in func_pol()
3080 …t2691 = 0.6e1 * t2678 * t161 + 0.102e3 * t1736 * t2678 + 0.156e3 * t1739 * t2678 - 0.180e3 * t1742… in func_pol()
3281 …t3809 = 0.68000e5 / 0.9e1 * t1736 * t3784 + 0.104000e6 / 0.9e1 * t1739 * t3784 - 0.40000e5 / 0.3e1… in func_pol()
3479 …1 * t352 * t730 - 0.11050e5 / 0.3e1 * t1736 * t4799 - 0.16900e5 / 0.3e1 * t1739 * t4799 + 0.6500e4… in func_pol()
3783 …t5434 = 0.4760e4 / 0.3e1 * t1736 * t5394 + 0.7280e4 / 0.3e1 * t1739 * t5394 - 0.2800e4 * t1742 * t… in func_pol()
4311 …t5746 = 0.200e3 * t5721 * t355 * tau[1] - 0.510e3 * t1736 * t2514 - 0.780e3 * t1739 * t2514 + 0.90… in func_pol()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_pbe.F1542 t1640, t165, t167, t1674, t1677, t1680, t1698, t171, t1711, t1712, t1713, t1739, t1741, & local
2370 t1739 = t268*t97
2373 trhoanorm_drho = -t1739*t776/0.2e1_dp - t1741*t789/ &
2394 trhobnorm_drho = -t1739*t1520/0.2e1_dp - t1741*t1529/ &
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_pbe.F1542 t1640, t165, t167, t1674, t1677, t1680, t1698, t171, t1711, t1712, t1713, t1739, t1741, & local
2370 t1739 = t268*t97
2373 trhoanorm_drho = -t1739*t776/0.2e1_dp - t1741*t789/ &
2394 trhobnorm_drho = -t1739*t1520/0.2e1_dp - t1741*t1529/ &
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_vwn_2.c823 double t1731, t1732, t1734, t1736, t1738, t1739, t1740, t1742; in func_pol() local
1772 t1739 = t118 * t1738; in func_pol()
1773 …40 = t1675 - t1678 + t1681 + t1683 + t1687 + t1692 - t1696 + t1702 + t1712 + t1719 - t1727 - t1739; in func_pol()
2077 …33 - t2334 + t2335 + t2336 + t2337 + t2338 - t2339 + t2340 + t2341 + t2342 - t2343 - 0.4e1 * t1739; in func_pol()
2389 …t4368 = t2337 + t2338 - t2339 + t2340 + t2341 + t2342 - t2343 - t1739 - 0.3e1 / 0.8e1 * t1742 + t2… in func_pol()
H A Dlda_c_pmgb06.c3382 t1739 = t1096 - t1098; in func_pol()
3383 t1740 = t3 * t1739; in func_pol()
3436 t1819 = t1739 * t174; in func_pol()
3588 t2050 = t119 * t1739; in func_pol()
3631 t2172 = t1739 * t196; in func_pol()
4791 t4556 = t390 * t1739; in func_pol()
4797 t4576 = t75 * t1739; in func_pol()
4809 t4597 = t1739 * t517; in func_pol()
5346 t5502 = t300 * t1739; in func_pol()
5372 t5591 = t1739 * t557; in func_pol()
[all …]

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