/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_op_g96.c | 1031 double t16894, t16911, t16914, t16924, t16927, t16933, t16982, t17005; in func_pol() local 4874 t16911 = t3302 * t157 * t92; in func_pol() 4878 …t3445 * t3299 * t16911 * t16914 + 0.12991170605756353570e-4 * t1982 * t3786 * t3788 + 0.1772916425… in func_pol() 4879 …t16982 = 0.37142013153537931598e-7 * t3437 * t3299 * t16911 * t16914 + 0.19606456262214940449e-4 *… in func_pol()
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H A D | gga_c_zpbeint.c | 2391 double t16901, t16903, t16908, t16911, t16912, t16918, t16920, t16922; in func_pol() local 8353 t16911 = 0.15e2 / 0.4e1 * t12230 * t1518; in func_pol() 8354 …16888 + t16894 + t16897 - t16901 + 0.3e1 / 0.8192e4 * t16903 + 0.3e1 / 0.16384e5 * t16908 + t16911; in func_pol() 8455 …17155 - t17157 + 0.3e1 / 0.4096e4 * t16903 + 0.3e1 / 0.8192e4 * t16908 + t16911 - 0.3e1 / 0.8192e4… in func_pol() 8624 …t17905 = 0.3e1 / 0.128e3 * t16893 - t17885 - 0.21e2 / 0.8192e4 * t16900 + t16911 - 0.3e1 / 0.16e2 … in func_pol() 8755 …330 + 0.3e1 / 0.32e2 * t18403 + 0.2e1 * t4421 * t14177 * t5344 - t17885 - t16901 + t16911 - t16923; in func_pol() 8906 …t19221 = t16911 + 0.3e1 / 0.16384e5 * t19201 + t16941 + t16944 + t19206 - 0.21e2 / 0.8192e4 * t192… in func_pol() 8989 …t2565 * t18429 - 0.9e1 / 0.4096e4 * t19189 + 0.3e1 / 0.4096e4 * t19193 + t16911 + 0.3e1 / 0.8192e4… in func_pol()
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H A D | gga_c_pbeloc.c | 2491 double t16903, t16905, t16907, t16909, t16911, t16913, t16916, t16919; in func_pol() local 8444 t16911 = t4087 * t1261; in func_pol() 8453 …0.5e1 / 0.384e3 * t16907 - 0.35e2 / 0.576e3 * t16909 + 0.7e1 / 0.576e3 * t16911 + 0.7e1 / 0.288e3 … in func_pol() 8642 …0.5e1 / 0.192e3 * t16907 - 0.35e2 / 0.288e3 * t16909 + 0.7e1 / 0.288e3 * t16911 + 0.7e1 / 0.144e3 … in func_pol() 8721 …803538319751e-2 * t14890 - 0.35e2 / 0.192e3 * t16909 + 0.7e1 / 0.192e3 * t16911 + 0.7e1 / 0.96e2 *… in func_pol() 8799 …25607076639502e-2 * t14890 - 0.35e2 / 0.96e2 * t16909 + 0.7e1 / 0.96e2 * t16911 + 0.7e1 / 0.48e2 *… in func_pol()
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H A D | gga_c_optc.c | 3029 double t16881, t16885, t16892, t16908, t16911, t16914, t16920, t16921; in func_pol() local 11143 t16911 = t16087 * t1075; in func_pol() 11151 …0870060394415080e2 * t2892 * t16908 + 0.55636233534648050268e1 * t2892 * t16911 + 0.55636233534648… in func_pol() 19025 …7246706929610054e2 * t55629 * t2894 + 0.11127246706929610054e2 * t8359 * t16911 + 0.11127246706929… in func_pol() 19419 …46706929610054e2 * t11318 * t16921 + 0.11127246706929610054e2 * t11318 * t16911 - 0.33381740120788… in func_pol() 20107 …5744277423614e-1 * t62177 + t61427 + 0.55636233534648050268e1 * t16432 * t16911 + 0.55636233534648… in func_pol() 20135 …50722651190743e0 * t62168 - t61635 + 0.11127246706929610054e2 * t16892 * t16911 + 0.10224091148855… in func_pol()
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H A D | gga_x_hjs.c | 5108 double t16908, t16911, t16919, t16924, t16927, t16930, t16932, t16934; in func_pol() local 11731 t16911 = t2325 * t6338; in func_pol() 11740 … t16903 + 0.6e1 * t2298 * t6236 + 0.6e1 * t910 * t16908 + 0.2e1 * t910 * t16911 - 0.6e1 * t6355 * … in func_pol() 12655 …56e2 / 0.243e3 * t16987 + 0.2e1 * t1089 * t6287 * t901 + 0.2e1 * t1216 * t16911 + 0.6e1 * t1216 * … in func_pol() 15138 …045 + 0.26366444444444444444e-1 * t1451 * t6217 * t414 + 0.2e1 * t1524 * t16911 - 0.2e1 * t1478 * … in func_pol()
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H A D | gga_c_acgga.c | 3184 double t16865, t16886, t16911, t16917, t16922, t16932, t16938, t16974; in func_pol() local 9665 …t16911 = 0.16006300097412701803e-1 * t16863 + 0.80031500487063509015e-2 * t16865 - 0.8574803623613… in func_pol() 9666 … t15701 + t15238 + t14869 + t15774 + t14982 + t15445 + t15102 + t16254 + t16911 + t15188 + t15993 … in func_pol()
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H A D | gga_c_gaploc.c | 6943 double t16886, t16887, t16911, t16923, t16928, t16931, t16939, t16945; in func_pol() local 15645 t16911 = t551 * t3790; in func_pol() 15647 …1353 * t1438 * t3846 * t419 - 0.17484374234987861853e3 * t1357 * t1353 * t16911 * t393 + 0.3680920… in func_pol() 15700 …t17682 = -0.15176003539027279785e0 * t1005 * t3775 * t502 * t16911 + 0.75880017695136398928e-1 * t… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_m11_l.c | 4450 double t16896, t16904, t16909, t16911, t16914, t16917, t16920, t16923; in func_pol() local 9230 t16911 = t45 * t1883 * t915; in func_pol() 9236 …t16946 = t16909 - 0.64e2 / 0.243e3 * t16911 - 0.8e1 / 0.81e2 * t16914 + 0.8e1 / 0.27e2 * t16917 - … in func_pol() 9912 …* t8136 * t20980 - 0.16e2 / 0.81e2 * t21153 + t16909 - 0.16e2 / 0.81e2 * t16911 + 0.4e1 / 0.27e2 *… in func_pol() 10238 …0.81e2 * t21124 - 0.32e2 / 0.81e2 * t21127 + t16909 - 0.32e2 / 0.243e3 * t16911 - 0.4e1 / 0.243e3 … in func_pol() 10476 …t25483 = (t16909 - 0.16e2 / 0.243e3 * t16911 - 0.16e2 / 0.81e2 * t21118 - t21122 - 0.8e1 / 0.27e2 … in func_pol()
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H A D | mgga_x_mggac.c | 677 double t16911, t16916, t16917, t16918, t16921, t16922, t16923, t16930; in func_unpol() local 6608 t16911 = t4290 * t2049; in func_unpol() 24923 double t16901, t16902, t16904, t16905, t16907, t16909, t16911, t16912; in func_pol() local 40345 t16911 = t737 * t16734; in func_pol() 40346 t16912 = t16911 * t1883; in func_pol() 40372 t16967 = t16911 * t1872; in func_pol() 42565 t20860 = t16911 * t3108; in func_pol() 42566 t20862 = t16911 * t3116; in func_pol() 43210 t22019 = t16911 * t22018; in func_pol() 43212 t22023 = t16911 * t22022; in func_pol() [all …]
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H A D | mgga_c_vsxc.c | 3838 double t16903, t16907, t16911, t16927, t16933, t16938, t16974, t17004; in func_pol() local 11438 t16911 = t24 * t5402 * t3351; in func_pol() 11441 …- 0.25000000000000000000e0 * t16907 * t5214 + 0.25863006459636700150e3 * t16911 * t5214 + 0.998228… in func_pol() 12566 …t26408 = 0.12931503229818350075e3 * t16911 * t8292 + 0.25000000000000000000e0 * t16198 * t2617 + 0… in func_pol()
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H A D | mgga_x_mbeef.c | 534 double t16884, t16887, t16895, t16899, t16904, t16907, t16909, t16911; in func_unpol() local 5734 t16911 = t1785 * t16748; in func_unpol() 5736 …t16932 = -0.24194335056584362140e-1 * t16911 - 0.92906674074074074076e-1 * t16913 + 0.1644279792e-… in func_unpol() 14795 double t16868, t16870, t16888, t16911, t16912, t16913, t16915, t16919; in func_ferr() local 19809 t16911 = t290 * t16012; in func_ferr() 19810 t16912 = t16911 * t89; in func_ferr() 25080 t46053 = t16911 * t276; in func_ferr() 25101 t46095 = t16911 * t294; in func_ferr() 25159 …t46212 = -0.875e3 / 0.1296e4 * t15108 + 0.78125e5 / 0.13122e5 * t16911 * t42816 - 0.2078125e7 / 0.… in func_ferr() 26994 t57654 = t16911 * t710; in func_ferr() [all …]
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H A D | mgga_x_br89_explicit.c | 14647 double t16884, t16885, t16888, t16893, t16905, t16906, t16911, t16915; in func_pol() local 24823 t16911 = t15191 * t431; in func_pol() 24827 …42 * t3607 - 0.2e1 * t2952 * t701 + 0.62811071439918130814e-2 * t10809 * t16911 + 0.27939238907047… in func_pol() 33572 …t68820 = 0.62811071439918130814e-2 * t41327 * t16911 + 0.62811071439918130814e-2 * t41330 * t16911… in func_pol() 35636 …287983626163e-1 * t69049 * t15139 + 0.12562214287983626163e-1 * t59318 * t16911 - 0.25124428575967… in func_pol() 36031 …408e-2 * t13569 * t68994 * t87043 + 0.62811071439918130814e-2 * t65322 * t16911 + 0.62811071439918… in func_pol() 36157 …96223e-2 * t10809 * t85792 * t431 + 0.18843321431975439245e-1 * t69049 * t16911 - 0.31771692472551… in func_pol()
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H A D | mgga_x_scanl.c | 11458 double t16904, t16911, t16920, t16928, t16932, t16933, t16939, t16948; in func_pol() local 18571 t16911 = t2044 * t4682; in func_pol() 18573 …0285826747577588e1 * t4838 * t4762 * t4839 - 0.3688002519040e1 * t4727 * t16911 + 0.33758233860356… in func_pol() 19197 …- 0.63756387095837744823e0 * t6222 * t20379 - 0.922000629760e0 * t2043 * t16911 - 0.16468529812403… in func_pol() 19630 …02015477522235392e1 * t9700 * t7336 * t1582 - 0.922000629760e0 * t2455 * t16911 + 0.71446935200858… in func_pol()
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H A D | mgga_x_br89.c | 14446 double t16889, t16894, t16897, t16899, t16903, t16907, t16911, t16914; in func_ferr() local 20292 t16911 = t3308 * t1909; in func_ferr() 20924 …t21154 = -0.4e1 / 0.3e1 * t793 * t16911 + 0.2e1 * t2731 * t16752 - 0.4e1 * t2855 * t16755 - 0.2e1 … in func_ferr() 29301 double t16909, t16910, t16911, t16912, t16913, t16914, t16915, t16916; in func_pol() local 46320 t16911 = 0.4e1 * t16280; in func_pol() 46337 …t16943 = t16909 + t16229 + t16910 - t16911 - t16283 - t16912 + t2083 - t16915 + t16917 + t427 * t1… in func_pol() 46559 …t17346 = t16909 + t16229 + t16910 - t16911 - t16283 - t16912 - t487 * t16262 - 0.3e1 * t8904 * t16… in func_pol() 65348 …t97636 = 0.8e1 * t61121 * t97301 + 0.2e1 * t39936 * t97618 - t16911 - t16283 - t16912 + t1589 * t9… in func_pol() 66331 …t101713 = -t97603 + t10395 + t16910 - t16911 - t16283 - t16912 - t17332 + t17336 + t17345 + 0.20e2… in func_pol() 74561 …t141890 = t141889 + t136459 + t136461 - t16911 - t16283 - t16912 + t2083 - t18081 + t18082 + t1808… in func_pol() [all …]
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H A D | mgga_c_scan.c | 4241 double t16808, t16902, t16903, t16911, t16914, t16970, t16995, t17002; in func_pol() local 12412 …t16911 = 0.10666666666666666667e1 * t4178 * t1683 + 0.10666666666666666667e1 * t1434 * t4530 + 0.1… in func_pol() 12419 …t17031 = my_piecewise3(t174, (t16648 + t16808 + t16911 + t16970) * t180 + t5397 * t439 * t180 + 0.… in func_pol()
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H A D | mgga_x_mbrxc_bg.c | 24855 double t16906, t16907, t16909, t16911, t16913, t16914, t16916, t16917; in func_pol() local 40501 t16911 = t1063 * t1110 * t2181; in func_pol() 40502 t16913 = 0.48e2 * t9458 * t16911; in func_pol() 40530 t16957 = t9410 * t16911; in func_pol() 58723 …2 * t9345 * t265 * t91572 - 0.16e2 * t44436 * t16907 - 0.48e2 * t44436 * t16911 + 0.5e1 / 0.2e1 * … in func_pol() 58727 ….3e1 * t44508 * t91768 + 0.5120e4 * t44508 * t91719 - 0.120e3 * t44637 * t16911 - 0.512e3 / 0.3e1 … in func_pol() 62235 … 0.3e1 * t11476 * t15808 - 0.96e2 * t55567 * t16907 - 0.288e3 * t55567 * t16911 + 0.3e1 * t11457 *… in func_pol() 62954 t112616 = t67579 * t16911; in func_pol() 63011 t112948 = t67459 * t16911; in func_pol() 64050 ….9e1 * t76129 * t117339 + t112842 + 0.3e1 * t112844 + 0.720e3 * t76059 * t16911 - 0.64e2 / 0.3e1 *… in func_pol() [all …]
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H A D | mgga_c_revscan.c | 4679 double t16849, t16866, t16878, t16891, t16901, t16911, t16922, t16934; in func_pol() local 14124 …t16911 = 0.6e1 * t5405 + 0.4e1 * t5010 + 0.2e1 * t3464 + 0.6e1 * t4566 + t12029 + 0.14649157844805… in func_pol() 14756 v4rho4[2] = t16866 + t16878 + t16891 + t16901 + t16911 + t16922 + t16934 + t19767; in func_pol()
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H A D | mgga_x_rscan.c | 15057 double t16906, t16908, t16909, t16911, t16913, t16915, t16917, t16919; in func_pol() local 23597 t16911 = t4942 * t464; in func_pol() 23605 …0.20e2 * t16821 - 0.3e1 * t16829 + t16908 - 0.720e3 * t16909 + 0.240e3 * t16911 - 0.360e3 * t16913… in func_pol() 23705 ….2001e1 * t16829 + 0.667e0 * t16908 - 0.480240e3 * t16909 + 0.160080e3 * t16911 - 0.240120e3 * t16… in func_pol()
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H A D | mgga_x_mbrxh_bg.c | 12648 double t16911, t16914, t16917, t16921, t16925, t16929, t16933, t16937; in func_pol() local 23912 t16911 = t3807 * t7256; in func_pol() 23913 …82 + 0.8e1 / 0.81e2 * t16905 * t12211 - 0.2e1 / 0.3e1 * t16908 + 0.112e3 / 0.3e1 * t16910 * t16911; in func_pol() 31932 …t53935 = 0.6e1 * t8049 * t11548 * t7052 + 0.112e3 / 0.9e1 * t40059 * t16911 - t53925 + t48946 - 0.… in func_pol()
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H A D | hyb_mgga_x_js18.c | 4607 double t16899, t16902, t16911, t16920, t16945, t16951, t16965, t16968; in func_ferr() local 7804 …t16911 = -0.36e2 * t16877 * t1213 + 0.162e3 * t16880 * t1228 - 0.36e2 * t3167 * t1785 + 0.513e3 / … in func_ferr() 7805 …m_beta * (t15745 + t15841 + t15865 + t15900 + t16795 + t16825 + t16876 + t16911) - 0.27e2 / 0.50e2… in func_ferr()
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H A D | mgga_c_scanl.c | 11796 double t16890, t16898, t16899, t16902, t16907, t16908, t16911, t16920; in func_pol() local 21064 t16911 = t3574 * t3578; in func_pol() 21065 …7234676004290560e0 * t1564 * t16908 - 0.63756387095837744824e0 * t1564 * t16911 - 0.32937059624806… in func_pol() 35739 …99971174729836e0 * t38597 * t16934 + 0.80224916908241017663e0 * t10587 * t16911 - 0.32937059624806… in func_pol()
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H A D | mgga_c_revtpss.c | 5421 double t16902, t16904, t16905, t16906, t16907, t16908, t16910, t16911; in func_pol() local 16483 t16911 = t128 * t16910; in func_pol() 16486 …t16914 = -t7390 + t7392 - t7402 - t7405 - t7413 + t7188 - t7191 - t7196 + t7226 + t16911 - t16912 … in func_pol() 16535 …- t7390 + t7392 - t7402 - t7405 - t7413 + t7188 - t7191 - t7196 + t7226 + t16911 - t16912 - t16913; in func_pol()
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H A D | mgga_c_rscan.c | 15598 double t16893, t16896, t16899, t16902, t16905, t16908, t16911, t16915; in func_pol() local 31561 …t16911 = -0.110569363527528e3 * t1855 * t16881 + 0.32494933333333333334e3 * t16884 - 0.37137066666… in func_pol() 31939 …0e4 * t17107 + 0.533524973059680e3 * t17109 + t17152 + t17164 + t17564 + t16911 - t17345 + 0.12068… in func_pol()
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