/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | hyb_gga_xc_wb97.c | 2209 double t8075, t8076, t8079, t8080, t8083, t8084, t8091, t8093; in func_pol() local 6656 t8075 = t1554 * t144; in func_pol() 6657 t8076 = t8075 * t2790; in func_pol() 8898 …t14006 = 0.4e1 / 0.9e1 * t1553 * t13867 * t1556 - 0.8e1 / 0.9e1 * t1553 * t8075 * t4486 - 0.10e2 /… in func_pol() 10086 …t2780 / 0.27e2 + t1553 * t13867 * t2882 / 0.9e1 + 0.8e1 / 0.9e1 * t7316 * t8075 * t6468 + 0.4e1 / … in func_pol() 10092 …t19914 = -0.2e1 / 0.9e1 * t1553 * t8075 * t6472 + t1553 * t19885 * t4620 / 0.27e2 - 0.4e1 / 0.27e2… in func_pol() 10101 …19934 * t17504 + t1553 * t19938 * t1556 / 0.9e1 + 0.2e1 / 0.3e1 * t1553 * t8075 * t6463 - 0.2e1 / … in func_pol() 11207 …t8075 * t8508 + 0.2e1 / 0.81e2 * t1553 * t8079 * t8503 - 0.4e1 / 0.27e2 * t1553 * t8079 * t8482 + … in func_pol() 11694 …0.9e1 + 0.2e1 / 0.3e1 * t1553 * t19877 * t28489 - 0.2e1 / 0.9e1 * t1553 * t8075 * t10435 - 0.2e1 /… in func_pol()
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H A D | gga_c_op_g96.c | 892 double t8075, t8076, t8077, t8082, t8087, t8090, t8095, t8098; in func_pol() local 3650 t8075 = t1440 * t8074; in func_pol() 3660 …t8113 = -0.86545854260437956205e-1 * t1992 * t8051 - 0.19186959663886306810e-3 * t8075 * t8077 + 0… in func_pol() 3746 …- 0.16486596798592417077e-3 * t8082 * t8904 - 0.57560878991658920431e-3 * t8075 * t8904 + 0.519275… in func_pol()
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H A D | gga_c_ft97.c | 6243 double t8070, t8071, t8072, t8075, t8076, t8077, t8080, t8081; in func_pol() local 14388 t8075 = t371 * t1711; in func_pol() 17753 …27450473218896000e-1 * t372 * t374 * t15783 - 0.23254900946437792000e-1 * t8075 * t15788 + 0.4e1 *… in func_pol() 30916 …53953169881963531e-5 * t372 * t534 * t58018 + 0.46509801892875584000e-2 * t8075 * t1631 * t58022 +… in func_pol() 30989 …t8075 * t15787 * t11295 + 0.38731446812548799881e-3 * t8075 * t4474 * t122 * t11184 + 0.2325490094… in func_pol() 34934 …0567862675200e0 * t8075 * t374 * t4467 * t4474 - 0.11619434043764639964e-2 * t1624 * t1594 * t8567… in func_pol() 35817 t92169 = t8075 * t92162; in func_pol() 35887 t92531 = t8075 * t22699; in func_pol() 37562 t101128 = t8075 * t92396; in func_pol() 43085 t136976 = t8075 * t41 * t136974; in func_pol() [all …]
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H A D | gga_xc_b97.c | 2028 double t8069, t8070, t8071, t8072, t8073, t8074, t8075, t8079; in func_pol() local 6152 t8075 = 0.3e1 / 0.16e2 * t8074; in func_pol() 6186 …t8176 = t8071 + t8073 - t8075 - t8120 - t8122 - t8124 - t8126 - t8128 - t8130 - t8132 - t8173 - t8… in func_pol() 8484 …t22314 = -t21429 - t21431 - t21432 + t8058 - t8061 + t8064 + t8067 + t8071 + t8073 - t8075 - t8120… in func_pol()
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H A D | gga_c_gapc.c | 8742 double t8057, t8062, t8063, t8064, t8068, t8071, t8072, t8075; in func_pol() local 13849 t8075 = t894 * t1713; in func_pol() 13855 …t8075 * t2776 - 0.19476826532927848420e-5 * t7781 * t2776 + 0.34629797575545714491e-5 * t7778 * t2… in func_pol() 17769 …344e-3 * t7997 * t923 - 0.12025098463461454384e-5 * t8075 * t8349 + 0.12025098463461454384e-5 * t8… in func_pol() 17965 …6e-7 * t7677 * t23390 - 0.37777960991504415808e-5 * t8075 * t8182 + 0.37777960991504415808e-5 * t8… in func_pol()
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H A D | gga_c_q2d.c | 4175 double t8075, t8076, t8077, t8078, t8079, t8080, t8081, t8082; in func_pol() local 10310 t8075 = 0.7e1 / 0.288e3 * t8074; in func_pol() 10313 …8064 - 0.5e1 / 0.3145728e7 * t8066 - 0.5e1 / 0.6291456e7 * t8070 - t8072 / 0.192e3 - t8075 - t8077; in func_pol() 11145 ….768e3 + t9503 - t8735 / 0.192e3 - t8737 / 0.384e3 + t9506 + t9507 + t8062 + t8064 - t8075 - t8077; in func_pol()
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H A D | gga_x_wpbeh.c | 13288 double t8038, t8041, t8048, t8049, t8056, t8070, t8074, t8075; in func_pol() local 19455 t8075 = t8070 + t8074; in func_pol() 19459 …056 * t915 + 0.4e1 / 0.3e1 * t996 * t7409 + 0.4e1 / 0.27e2 * t296 * t12 * t8075 * t303 + 0.8e1 / 0… in func_pol() 25080 t26043 = t8075 * t265; in func_pol() 25083 t26050 = t8075 * t302; in func_pol() 25147 t26203 = t296 * t614 * t8075 * t303; in func_pol() 35852 t84042 = t8075 * t995; in func_pol() 36020 t85195 = t296 * t2632 * t8075 * t303; in func_pol()
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H A D | gga_x_hjs_b88_v2.c | 6783 double t8070, t8072, t8075, t8077, t8078, t8079, t8082, t8086; in func_pol() local 11193 …t8075 = -0.5e1 / 0.3e1 * t7775 - 0.5e1 / 0.6e1 * t7778 - 0.20e2 / 0.9e1 * t7781 - 0.80e2 / 0.9e1 *… in func_pol() 11214 t8123 = t7976 + t8008 + t8021 + t8034 + t8048 + t8061 + t8075 + t8120; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_k_pc07.c | 8213 double t8047, t8050, t8053, t8058, t8066, t8069, t8074, t8075; in func_pol() local 12163 t8075 = t2559 * t8074; in func_pol() 12167 t8084 = t8075 * t159; in func_pol() 16608 … * t879 * t30737 * t860 - 0.1568231334e2 * t341 * t30741 - 0.1408533109821e1 * t879 * t8075 * t880; in func_pol() 16614 t30761 = t8075 * t3332; in func_pol() 16635 …0886 * t1138 + 0.87123963e0 * t341 * t30890 - 0.8451198658926e1 * t2695 * t8075 * t2696 + 0.845119… in func_pol() 16658 t31115 = t8075 * t860; in func_pol() 17647 …t36661 = 0.6272925336e2 * t870 * t8075 * t1703 + 0.522743778e1 * t870 * t1359 * t875 * t7734 + 0.2… in func_pol() 17661 …758 + 0.15181169857650738e1 * t1130 * t30761 - 0.1408533109821e1 * t879 * t8075 * t1536 - 0.97002e… in func_pol() 17664 … t1694 * t1897 + 0.291006e2 * t6225 * t7648 - 0.8451198658926e1 * t2695 * t8075 * t6699 + 0.845119… in func_pol() [all …]
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H A D | mgga_x_msb.c | 3197 double t8061, t8063, t8065, t8066, t8070, t8074, t8075, t8076; in func_pol() local 6252 t8075 = t8074 * tau[1]; in func_pol() 6253 t8076 = t1914 * t8075; in func_pol() 6260 …0.36400e5 / 0.3e1 * t115 * t1980 * t1935 * t698 - 0.54e2 * t1914 * t8133 - 0.180e3 * t1933 * t8075; in func_pol() 6263 …000 * t8075 + 0.10500e5 * t5982 * t8079 - 0.540e3 * t2000 * t8133 - 0.6300e4 * t5982 * t8103 + 0.7… in func_pol()
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H A D | hyb_mgga_xc_wb97mv.c | 281 double t8075, t8092, t8096, t8103, t8106, t8109, t8119, t8122; in func_unpol() local 2457 t8075 = t7993 * t10; in func_unpol() 2458 …t8075 - 0.54758400000000000000e2 * t6504 * t1141 + 0.31759872000000000000e2 * t2910 * t1146 - 0.59… in func_unpol() 4375 double t8056, t8058, t8059, t8066, t8069, t8072, t8075, t8078; in func_pol() local 9958 t8075 = t2890 * t1921; in func_pol() 9970 …278000000000000000e0 * t2925 * t8072 - 0.98733600000000000000e0 * t1981 * t8075 - 0.70210560000000… in func_pol() 9984 …t8161 = 0.10574400000000000000e0 * t1961 * t8075 + 0.28198400000000000000e0 * t8114 * t2894 + 0.22… in func_pol() 16443 …23200000000000000e0 * t28670 * t2891 + 0.31723200000000000000e0 * t8108 * t8075 + 0.82278000000000… in func_pol() 19154 …120000000000000e-2 * t1874 * t48271 + 0.10574400000000000000e0 * t13946 * t8075 + 0.10574400000000… in func_pol() 19160 …t48332 = 0.82278000000000000000e0 * t14335 * t8072 - 0.98733600000000000000e0 * t13917 * t8075 - 0… in func_pol() [all …]
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H A D | mgga_x_sa_tpss.c | 7746 double t8075, t8076, t8077, t8079, t8081, t8092, t8097, t8099; in func_pol() local 11476 t8075 = t2857 * t86; in func_pol() 11477 t8076 = t8075 * t1836; in func_pol() 11482 t8097 = t4362 * t8075 * t1822; in func_pol() 14388 t21756 = t8075 * t4030; in func_pol() 14394 …3 + 0.10e2 / 0.81e2 * t12767 * t21773 * t1311 - 0.5e1 / 0.36e2 * t15296 * t8075 * t5201 + 0.5e1 / … in func_pol() 14443 … 0.4e1 / 0.81e2 * t4377 * t8116 * t430 * t440 + 0.5e1 / 0.648e3 * t4362 * t8075 * t4036 + 0.25e2 /… in func_pol() 15213 …t26766 = -t15870 * t8099 * t7010 / 0.6e1 - 0.5e1 / 0.36e2 * t15296 * t8075 * t7019 + 0.5e1 / 0.145… in func_pol()
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H A D | mgga_x_br89.c | 4623 t8076 = t69 * t8075; in func_unpol() 4672 t8219 = t34 * t8075; in func_unpol() 4678 t8241 = t37 * t8075; in func_unpol() 10812 t42506 = t8075 * t90; in func_unpol() 10814 t42511 = t8075 * t275; in func_unpol() 10889 t43527 = t36 * t8075; in func_unpol() 13149 t54104 = t8075 * t172; in func_unpol() 13235 t55137 = t8075 * t853; in func_unpol() 13614 t57705 = t8075 * t195; in func_unpol() 13616 t57710 = t8075 * t1053; in func_unpol() [all …]
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H A D | mgga_x_2d_prhg07.c | 4608 double t8070, t8072, t8073, t8075, t8077, t8079, t8081, t8083; in func_pol() local 8789 t8075 = t117 * t1975; in func_pol() 8798 …t8100 = -0.9e1 / 0.8e1 * t8073 + 0.3e1 / 0.4e1 * t8075 - 0.3e1 / 0.8e1 * t8077 - 0.9e1 / 0.16e2 * … in func_pol() 8841 … t8068 + 0.9e1 / 0.2e1 * t8070 - 0.27e2 / 0.8e1 * t8073 + 0.9e1 / 0.4e1 * t8075 - 0.9e1 / 0.8e1 * … in func_pol()
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H A D | mgga_x_mn12.c | 3850 double t8065, t8067, t8068, t8072, t8075, t8098, t8101, t8111; in func_pol() local 6609 t8075 = t1079 * t1445; in func_pol() 6647 …- t1040 * t2133 * t8068 / 0.6e1 - t1040 * t2995 * t8072 - t1040 * t2995 * t8075 / 0.2e1 - 0.3e1 / … in func_pol() 8686 t19870 = t8 * t373 * t8075; in func_pol()
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H A D | mgga_c_m06l.c | 334 double t8026, t8029, t8045, t8055, t8075, t8094, t8118, t8119; in func_unpol() local 2925 …t8075 = 0.1440e4 * t5662 * t8014 + 0.96e2 * t5681 * t8014 - 0.96e2 * t3614 * t7220 - 0.96e2 * t361… in func_unpol() 2929 …t8136 = -0.31090700000000000000e-1 * t36 * (t8029 + t8055 + t8075 + t8094) * t98 - 0.7772675000000… in func_unpol() 5928 double t8067, t8068, t8069, t8070, t8071, t8073, t8075, t8076; in func_pol() local 11772 t8075 = 0.32163958997385070134e2 * t2583; in func_pol() 11773 …454266666666666666e0 * t2570 - t8073 + 0.41454266666666666666e0 * t2578 + t8075 - t2024 - t2026 - … in func_pol() 12476 …454266666666666667e0 * t2570 - t8073 + 0.41454266666666666667e0 * t2578 + t8075 + t8079 + t8080 - … in func_pol()
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H A D | mgga_x_edmgga.c | 178 double t7980, t7983, t7985, t8046, t8059, t8075, t8117, t8121; in func_unpol() local 1563 …t8075 = 0.11432585570925925678e2 * t2586 * t2180 * t506 + 0.15934382750320792050e0 * t855 * t365 *… in func_unpol() 1565 …6e1 * t48 * t361 * t1975 - t139 * t2203 + 0.2e1 * t48 * t6199 * t148 - t48 * t99 * (t8075 + t8117); in func_unpol()
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H A D | mgga_x_mbrxh_bg.c | 6019 double t8049, t8053, t8056, t8057, t8061, t8064, t8067, t8075; in func_ferr() local 8965 t8075 = t2285 * t172; in func_ferr() 8966 t8076 = t1096 * t8075; in func_ferr() 8975 t8103 = t1103 * t8075; in func_ferr() 8987 t8147 = t1137 * t8075; in func_ferr() 12229 double t8068, t8069, t8070, t8071, t8072, t8073, t8074, t8075; in func_pol() local 20299 t8075 = t8074 * t172; in func_pol() 20312 …t8088 = t6933 - t6944 + t6953 - t6956 + t6958 + t8068 - t8070 - t8072 + t8075 + t8077 + t8080 - t8… in func_pol() 29225 …t39778 = t34205 - t34206 + t34207 - t34208 + t34209 + t39769 - t39770 - t39771 + 0.2e1 * t8075 + t… in func_pol() 29599 …t42260 = -t6944 + t6953 - t6956 + t6958 - t8502 + t39769 - t39770 - t39771 + t8075 + t39773 + t397… in func_pol()
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H A D | mgga_c_scanl.c | 355 double t8060, t8063, t8065, t8075, t8076, t8079, t8082, t8085; in func_unpol() local 3333 t8075 = t750 * t138; in func_unpol() 3334 t8076 = t1010 * t8075; in func_unpol() 3487 t9057 = t1173 * t8075; in func_unpol() 11398 double t8055, t8056, t8057, t8058, t8060, t8062, t8072, t8075; in func_pol() local 17650 t8075 = t2543 * t573; in func_pol() 17669 … t1491 * t2543 - 0.15e2 / 0.8e1 * t5196 * t8072 + 0.3e1 / 0.2e1 * t1496 * t8075 + 0.3e1 / 0.4e1 * … in func_pol() 24738 … t1521 - 0.45e2 / 0.8e1 * t5196 * t2543 * t1497 + 0.9e1 / 0.2e1 * t5188 * t8075 + 0.9e1 / 0.4e1 * … in func_pol() 27757 …/ 0.2e1 * t1496 * t882 * t8127 + 0.3e1 * t30211 * t2520 + 0.3e1 * t8062 * t8075 - 0.15e2 / 0.4e1 *… in func_pol() 29657 …5e2 / 0.2e1 * t10413 * t10454 * t2520 - 0.15e2 / 0.2e1 * t10413 * t3125 * t8075 + 0.13e2 / 0.2916e… in func_pol() [all …]
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H A D | mgga_x_mggac.c | 24120 double t8072, t8073, t8074, t8075, t8076, t8077, t8078, t8080; in func_pol() local 33714 t8075 = t359 * t8074; in func_pol() 33715 t8076 = t349 * t8075; in func_pol() 36690 t12137 = t483 * t8075; in func_pol() 38995 t15151 = t607 * t8075; in func_pol() 47399 t37321 = t1020 * t8075; in func_pol() 47863 … 0.6e1 * t1760 * t37951 - t6124 * t1920 - t6134 * t1920 / 0.6e1 - t1188 * t8075 / 0.2e1 - 0.4e1 * … in func_pol() 51701 t56388 = t1704 * t8075; in func_pol() 54229 t68190 = t2225 * t8075; in func_pol() 58148 …8429 - 0.5e1 / 0.9e1 * t18285 * t28954 - t2792 * t37889 / 0.4e1 + t2807 * t8075 - t86958 - t86968 … in func_pol() [all …]
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H A D | mgga_x_mbrxc_bg.c | 16436 t8075 = t8074 * t463; in func_ferr() 33882 t8075 = t394 * t3352; in func_pol() 33883 t8076 = t589 * t8075; in func_pol() 34300 t8703 = t3195 * t8075; in func_pol() 36766 t11793 = t131 * t8075; in func_pol() 47063 t38967 = t3363 * t8075; in func_pol() 47563 t41608 = t21779 * t8075; in func_pol() 47564 t41611 = t4090 * t8075; in func_pol() 47574 t41656 = t22671 * t8075; in func_pol() 47605 t41851 = 0.4e1 / 0.81e2 * t21849 * t8075 * t4069; in func_pol() [all …]
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H A D | mgga_xc_b98.c | 5852 double t8075, t8076, t8077, t8078, t8079, t8080, t8081, t8082; in func_pol() local 11464 t8075 = t1333 * t769; in func_pol() 11465 t8076 = 0.38862500000000000000e-2 * t8075; in func_pol() 17352 …* t8071 + 0.58293750000000000000e-2 * t8073 + 0.11658750000000000000e-1 * t8075 + 0.11658750000000… in func_pol()
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H A D | mgga_x_scanl.c | 11178 double t8056, t8059, t8062, t8063, t8071, t8074, t8075, t8077; in func_pol() local 15920 t8075 = t8074 * t167; in func_pol() 15921 t8077 = t8 * t18 * t8075; in func_pol() 19834 t24026 = t8 * t323 * t8075; in func_pol()
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H A D | mgga_c_kcis.c | 284 double t7987, t7999, t8006, t8008, t8045, t8075, t8077, t8086; in func_unpol() local 2454 t8075 = t293 * t791; in func_unpol() 2455 t8077 = t8075 * t3618 * t792; in func_unpol() 2461 …10416666e-4 * t2344 * t7696 * t3620 + 0.25931837187500000000e-3 * t3623 * t8075 * t7896 * t303 - 0… in func_unpol()
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