/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_c_scanl.c | 475 double t14233, t14236, t14241, t14245, t14253, t14263, t14275, t14283; in func_unpol() local 4314 t14275 = t872 * t4677; in func_unpol() 11695 double t14268, t14271, t14274, t14275, t14276, t14277, t14280, t14281; in func_pol() local 20121 t14275 = t3231 * t14274; in func_pol() 27045 …t14275 * t40223 + 0.840e1 * t14281 * t40218 - 0.70000000000000000000e1 * t40229 * t2887 * t10846 -… in func_pol() 27190 …t14275 * t41707 + 0.840e1 * t14281 * t41710 + 0.18900e2 * t14286 * t41713 - 0.31500000000000000000… in func_pol() 30068 t54697 = t14275 * t54696; in func_pol() 30165 …0e1 * t54220 * t55195 - 0.38888888888888888890e1 * t14275 * t55198 - 0.19444444444444444445e1 * t1… in func_pol() 30415 t56709 = t14275 * t56704; in func_pol() 30521 …t14275 * t57426 + 0.29166666666666666666e1 * t55230 * t55998 + 0.21875000000000000000e1 * t55234 *… in func_pol() [all …]
|
H A D | hyb_mgga_x_js18.c | 4577 double t14248, t14261, t14275, t14299, t14305, t14308, t14335, t14340; in func_ferr() local 7552 t14275 = t37 * t3793; in func_ferr() 8995 double t14275, t14278, t14279, t14282, t14284, t14285, t14286, t14287; in func_pol() local 14683 t14275 = t1573 * t2472; in func_pol() 14694 … t2518 / 0.4e1 + t8112 * t1575 / 0.2e1 + t2515 * t4791 - 0.3e1 / 0.2e1 * t14275 * t2518 + t14279 +… in func_pol() 15171 …10544 * t1575 / 0.2e1 + t3252 * t5193 + t15241 * t1166 - 0.3e1 / 0.2e1 * t14275 * t3977 + 0.20e2 *… in func_pol() 16819 …t22886 = -0.9e1 / 0.2e1 * t14275 * t6267 + 0.6e1 * t8140 * t22862 - 0.9e1 / 0.2e1 * t2517 * t22865… in func_pol() 20192 ….2e1 * t14275 * t9678 - 0.9e1 / 0.4e1 * t42583 * t9682 + t14269 * t9678 / 0.4e1 - 0.3e1 * t42579 *… in func_pol() 21686 …- 0.5e1 / 0.4e1 * t57553 - 0.3e1 * t42579 * t5190 - 0.3e1 * t14275 * t15193 - 0.3e1 * t14275 * t15… in func_pol() 21694 …3257 / 0.4e1 - 0.3e1 * t44766 * t4788 + t44774 * t4788 / 0.2e1 - 0.3e1 * t14275 * t15214 + t14269 … in func_pol() [all …]
|
H A D | mgga_k_pc07.c | 395 double t14263, t14272, t14275, t14300, t14307, t14337, t14343, t14349; in func_unpol() local 3520 …t14275 = -0.388008e2 * t148 * t14209 - 0.2910060e3 * t581 * t9855 - 0.1164024e3 * t568 * t13795 - … in func_unpol() 3559 …t14643 = my_piecewise3(t69, 0, t13986 + t14032 + t14076 + t14124 + t14244 + t14275 + t14307 + t143… in func_unpol() 4317 double t14226, t14234, t14240, t14257, t14264, t14271, t14275, t14298; in func_ferr() local 7426 t14275 = t3911 * t818 * t230; in func_ferr() 7430 … t841 + 0.2817066219642e1 * t2051 * t14271 - 0.8451198658926e1 * t2051 * t14275 + 0.3136462668e2 *… in func_ferr() 7757 …t17467 = -0.8451198658926e1 * t3490 * t14275 + 0.3136462668e2 * t1049 * t3647 * t2946 + 0.94093880… in func_ferr()
|
H A D | mgga_x_msb.c | 3253 double t14102, t14107, t14144, t14180, t14192, t14227, t14275, t14305; in func_pol() local 7564 …t14275 = 0.2e1 * t497 * t370 * t4000 - 0.9e1 * t459 * t1195 * t1136 - 0.9e1 * t459 * t1203 * t1136… in func_pol() 7566 v4sigma3tau[0] = -0.3e1 / 0.8e1 * t304 * t305 * (t14144 + t14180 + t14227 + t14275); in func_pol()
|
H A D | mgga_x_vt84.c | 7010 double t14275, t14278, t14281, t14284, t14288, t14303, t14316, t14323; in func_pol() local 12029 t14275 = t8 * t806 * t1735; in func_pol() 12031 …59 / 0.9e1 - t522 * t1337 * t736 * t2694 / 0.2e1 - 0.2e1 / 0.3e1 * t14272 - 0.2e1 / 0.3e1 * t14275; in func_pol() 12046 … t799 * t1863 * t1058 / 0.3e1 - 0.2e1 / 0.9e1 * t14272 - 0.4e1 / 0.9e1 * t14275 - t4149 * t4998 * … in func_pol() 12060 …e1 * t14323 - t14326 - t14303 - 0.4e1 / 0.3e1 * t14327 - 0.2e1 / 0.9e1 * t14275 + t13478 - t13463 … in func_pol()
|
H A D | mgga_xc_b98.c | 6277 double t14275, t14276, t14277, t14278, t14279, t14281, t14291, t14292; in func_pol() local 15335 t14275 = 0.11658750000000000000e-1 * t249 * t14273; in func_pol() 15344 v3tau3[0] = t10 * (-t14255 - t14269 - t14272 + t14275 - t14281 + t14292); in func_pol() 21390 v4rhotau3[0] = -t14255 - t14269 - t14272 + t14275 - t14281 + t14292 + t10 * (t48188 + t48265); in func_pol() 21413 v4rhotau3[4] = t10 * t48408 - t14255 - t14269 - t14272 + t14275 - t14281 + t14292; in func_pol()
|
H A D | mgga_c_tpss.c | 4061 double t14268, t14269, t14273, t14275, t14276, t14280, t14284, t14285; in func_pol() local 13129 t14275 = t8639 * t265; in func_pol() 13130 t14276 = t12885 * t14275; in func_pol() 20469 …t42009 = -0.3e1 * t1679 * t10775 * t14275 + 0.12e2 * t2662 * t10762 * t10698 + 0.6e1 * t262 * t703… in func_pol() 21779 … * t14243 + 0.2e1 * t14261 * t12885 * t40044 + 0.2e1 * t14261 * t48114 * t14275 - 0.2e1 * t12884 *… in func_pol() 22781 …9 - 0.4e1 * t50807 * t14243 - 0.4e1 * t12884 * t51184 * t14275 + 0.2e1 * t14261 * t51063 * t14275 … in func_pol() 25509 … / 0.192e3 - 0.4e1 * t18261 * t18281 * t14242 + 0.2e1 * t18261 * t3858 * t14275 - 0.12e2 * t18269 … in func_pol() 25530 …t74595 = -0.4e1 * t69081 * t69254 * t14275 + 0.12e2 * t69253 * t69254 * t14256 - 0.8e1 * t69081 * … in func_pol()
|
H A D | mgga_c_m06l.c | 6349 double t14268, t14270, t14271, t14272, t14273, t14274, t14275, t14276; in func_pol() local 15212 t14275 = t438 * t4470; in func_pol() 15213 t14276 = 0.15545350000000000000e-1 * t14275; in func_pol() 21046 …000000000000e-1 * t14271 - 0.31090700000000000000e-1 * t14273 - 0.31090700000000000000e-1 * t14275; in func_pol()
|
H A D | mgga_x_br89_explicit.c | 14527 double t14272, t14273, t14274, t14275, t14276, t14277, t14278, t14280; in func_pol() local 23722 t14275 = t1114 * t1114; in func_pol() 23723 t14276 = 0.1e1 / t14275; in func_pol() 31808 t55500 = t14275 * rho[1]; in func_pol() 34940 t79488 = 0.1e1 / t100 / t14275 / t309; in func_pol() 35380 t82955 = 0.1e1 / t100 / t14275; in func_pol()
|
H A D | mgga_c_kcis.c | 5257 double t14270, t14272, t14273, t14275, t14276, t14278, t14279, t14281; in func_pol() local 14177 t14275 = t9221 * t13759; in func_pol() 14178 t14276 = t26 * t14275; in func_pol() 22352 t39111 = t535 * t14275; in func_pol()
|
H A D | mgga_x_mbrxh_bg.c | 6149 double t14267, t14271, t14275, t14285, t14288, t14291, t14296, t14306; in func_ferr() local 10018 t14275 = t913 * t2079; in func_ferr() 10022 …3 * t13679 * t14267 - 0.72e2 * t4629 * t13679 * t14271 - 0.6e1 * t2037 * t14275 + 0.28e2 * t2037 *… in func_ferr() 10530 ….4e1 * t2804 * t2080 - 0.22e2 / 0.9e1 * t2809 * t13797 - 0.2e1 * t2809 * t14275 - 0.2e1 / 0.3e1 * … in func_ferr()
|
H A D | mgga_x_br89.c | 29058 double t14275, t14278, t14281, t14284, t14285, t14288, t14297, t14300; in func_pol() local 44290 t14275 = t1100 * t14274; in func_pol() 44299 …t14306 = -0.3e1 * t8904 * t14268 - 0.2e1 * t8861 * t13432 + 0.6e1 * t12448 * t14275 - 0.12e2 * t12… in func_pol() 44300 …t14322 = 0.2e1 * t12451 * t14275 + t487 * t13424 / 0.2e1 - t8876 * t2628 - t1898 * t13427 + 0.2e1 … in func_pol() 61534 …1 * t1898 * t4314 * t81657 - 0.6e1 * t47298 * t14268 + 0.12e2 * t67056 * t14275 + 0.12e2 * t12448 … in func_pol() 61553 … * t81657 + t54184 + 0.44e2 / 0.3e1 * t47257 * t81874 + 0.4e1 * t67071 * t14275 + 0.72e2 * t67294 … in func_pol() 71623 … 0.4e1 / 0.3e1 * t117318 * t28273 * t14274 + 0.12e2 * t12448 * t130606 - 0.72e2 * t117471 * t14275; in func_pol() 71627 … t47254 * t1113 * t130619 - 0.6e1 * t89145 * t14303 - 0.12e2 * t117514 * t14275 + 0.4e1 * t8935 * … in func_pol()
|
H A D | mgga_x_mbeef.c | 465 double t14265, t14267, t14271, t14275, t14277, t14278, t14280, t14282; in func_unpol() local 5169 t14275 = t6825 * t14139; in func_unpol() 5170 …4271 + 0.2000000e7 / 0.729e3 * t4302 - 0.100000e6 / 0.729e3 * t4315 + 0.200000e6 / 0.81e2 * t14275; in func_unpol() 5199 …/ 0.81e2 * t14355 - 0.612500e6 / 0.27e2 * t14357 - 0.700000e6 / 0.81e2 * t14275 + 0.700000e6 / 0.8… in func_unpol() 5231 …0.243e3 * t14525 - 0.12512500e8 / 0.81e2 * t14527 + 0.175000e6 / 0.9e1 * t14275 - 0.175000e6 / 0.9… in func_unpol() 5267 … t14525 - 0.11370349268055555556e0 * t14527 + 0.45887435277500000001e1 * t14275 - 0.45887435277500… in func_unpol()
|
H A D | mgga_x_mbeefvdw.c | 9057 double t14223, t14225, t14227, t14229, t14231, t14237, t14261, t14275; in func_ferr() local 13449 …t14275 = 0.25e2 / 0.9e1 * t14115 + 0.25e2 / 0.9e1 * t14118 + 0.25e2 / 0.18e2 * t14120 - 0.20000e5 … in func_ferr() 13561 t14486 = t14261 + t14275 + t14306 + t14338 + t14377 + t14411 + t14443 + t14483; in func_ferr()
|
H A D | mgga_c_tpssloc.c | 4673 double t14265, t14266, t14275, t14277, t14280, t14283, t14286, t14287; in func_pol() local 15088 t14275 = t4404 * t909; in func_pol() 15091 …623 * t3588 / 0.1152e4 - t11623 * t3579 / 0.1152e4 + 0.19e2 / 0.1296e4 * t14275 + 0.19e2 / 0.864e3… in func_pol() 15644 … t14246 / 0.54e2 + t14249 / 0.288e3 + 0.5e1 / 0.2304e4 * t913 * t16060 + 0.19e2 / 0.432e3 * t14275; in func_pol()
|
H A D | mgga_x_mggac.c | 24688 double t14273, t14274, t14275, t14276, t14277, t14278, t14279, t14280; in func_pol() local 38401 t14275 = t14274 / 0.12e2; in func_pol() 38435 …t14309 = -t14269 + t14273 - t14275 + t14277 + t14282 + t14284 + t14286 + t14291 - t14293 - t14295 … in func_pol() 53872 …t67076 = -t14275 + t14277 + t14282 + t14284 + t14286 + t14291 - t14293 - t14295 + t14297 + t14299 … in func_pol()
|
H A D | mgga_x_mbrxc_bg.c | 24653 double t14271, t14273, t14275, t14277, t14279, t14282, t14283, t14284; in func_pol() local 38767 …t14275 = -t12383 + t12387 - t14243 - t14245 + t14247 + t14249 - t14251 + t14255 + t14258 + t14262 … in func_pol() 38768 t14277 = t14180 + t14206 + t14241 + t14275; in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_tb09.c | 4477 double t14250, t14253, t14264, t14274, t14275, t14277, t14287, t14289; in func_pol() local 8889 t14275 = t14274 * t2715; in func_pol() 8890 t14277 = t2207 * t14275 * t2718; in func_pol() 8893 …119 - 0.12e2 * t3707 * t2085 + 0.12e2 * t3710 * t2095 + 0.12e2 * t2766 * t14275 * t9128 + 0.8e1 * … in func_pol() 8894 …277 * t9108 - 0.4e1 * t14277 * t9111 + 0.12e2 * t2713 * t14275 * t9104 - 0.24e2 * t2822 * t14275 *… in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_xc_b97.c | 2193 double t14263, t14265, t14270, t14275, t14280, t14294, t14296, t14322; in func_pol() local 7531 t14275 = t6251 * t1099; in func_pol() 7533 …2e1 + t14270 / 0.12e2 + t4836 * t1988 * t14258 / 0.4e1 + t4836 * t1988 * t14275 / 0.8e1 - t14280 /… in func_pol() 7641 …1987 * t1988 * t6251 * t1114 / 0.24e2 - 0.7e1 / 0.72e2 * t4987 * t4988 * t14275 + t4836 * t1988 * … in func_pol()
|
H A D | gga_c_regtpss.c | 2810 double t14128, t14134, t14168, t14195, t14234, t14252, t14275, t14289; in func_pol() local 8168 …t14275 = 0.69394917116090352835e-2 * t11865 + 0.15805078039045227836e2 * t306 * t2876 * t4200 - 0.… in func_pol() 8169 …* t4195 + t14195 - 0.15611904863012452830e0 * t11606 + t14234 + t14252 + t14275) - t7830 - 0.26341… in func_pol()
|
H A D | gga_c_optc.c | 2923 double t14263, t14264, t14267, t14268, t14271, t14272, t14275, t14276; in func_pol() local 10282 t14275 = t3224 * t3997; in func_pol() 10283 t14276 = t3276 * t14275; in func_pol() 10355 t14490 = t3043 * t14275; in func_pol() 17020 t43505 = t8938 * t14275; in func_pol() 17160 t44646 = t2298 * t8803 * t14275; in func_pol()
|
H A D | gga_c_gapc.c | 4504 double t14161, t14184, t14203, t14223, t14228, t14263, t14275, t14292; in func_ferr() local 8050 t14275 = t12736 * t1243; in func_ferr() 8052 … * t671 * t989 * t1406 * sigma[0] + 0.15727161829247881262e-6 * t10104 * t14275 - 0.20641899900887… in func_ferr() 8086 …e-7 * t4773 * t5632 * t4557 + 0.10012222183723900368e-6 * t141 * t3980 * t14275 - 0.75903320312500… in func_ferr()
|
H A D | gga_c_ft97.c | 6585 double t14272, t14275, t14276, t14278, t14281, t14282, t14283, t14286; in func_pol() local 17125 t14275 = 0.2e1 / 0.27e2 * t1862 * t3990; in func_pol() 17133 … * t14267 / 0.3e1 - 0.4e1 / 0.81e2 * t14270 - 0.22e2 / 0.27e2 * t14272 + t14275 + 0.2e1 / 0.3e1 * … in func_pol() 18941 …14227 - 0.2e1 / 0.3e1 * t446 * t18685 - 0.8e1 / 0.81e2 * t14270 - 0.4e1 / 0.27e2 * t14272 + t14275; in func_pol()
|
H A D | gga_x_wpbeh.c | 13554 double t14262, t14263, t14266, t14269, t14272, t14275, t14287, t14293; in func_pol() local 21602 t14275 = 0.38131091851851851850e-1 * t14160; in func_pol() 21603 …t14287 = 0.76262183703703703701e-1 * t14157 + t14275 + 0.11439327555555555555e0 * t14165 - 0.28598… in func_pol() 23291 …154430922e0 * t19783 - 0.308861844e0 * t19785 - 0.154430922e0 * t19787 + t14275 + 0.38131091851851… in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_xc_ksdt.c | 2922 double t14254, t14257, t14258, t14263, t14268, t14275, t14281, t14282; in func_pol() local 10097 t14275 = t3906 * t7526; in func_pol() 10102 ….2e1 * t11222 * t1047 - 0.3e1 / 0.4e1 * t11219 * t1047 - 0.3e1 / 0.2e1 * t14275 * t534 - 0.3e1 / 0… in func_pol() 16992 ….2e1 * t38905 * t7999 - 0.3e1 * t1028 * t7526 * t11079 + 0.3e1 / 0.2e1 * t14275 * t1740 - t2907 * … in func_pol() 17190 t46566 = t14275 * t1892; in func_pol() 17508 …8e2 - t11089 * t14322 * t7762 / 0.6e1 + 0.3e1 * t3907 * t11111 + 0.6e1 * t14275 * t3156 + t14249 *… in func_pol()
|