/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_c_tpssloc.c | 10747 t3880 = t386 * t3879; in func_pol() 10989 t4516 = t91 * t3879; in func_pol() 14316 t12140 = t947 * t3879; in func_pol() 15126 t14403 = t482 * t3879; in func_pol() 15675 t16176 = t3734 * t3879; in func_pol() 15676 t16187 = t1018 * t3879; in func_pol() 15691 t16264 = t1254 * t3879; in func_pol() 17845 t21591 = t77 * t3879; in func_pol() 26416 t59295 = t3879 * t3879; in func_pol() 29912 t78655 = t464 * t3879; in func_pol() [all …]
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H A D | mgga_x_scanl.c | 2122 t3879 = t253 * t3878; in func_unpol() 2123 t3880 = t3879 * t103; in func_unpol() 7475 t3879 = -t3796; in func_ferr() 7476 t3880 = t239 * t3879; in func_ferr() 9063 t11994 = t3879 * t94; in func_ferr() 9065 t12003 = t631 * t3879; in func_ferr() 9120 t12396 = t618 * t3879; in func_ferr() 14163 t3880 = t3879 * t3823; in func_pol() 14876 t5374 = t3879 * t684; in func_pol() 15409 t6615 = t3879 * t860; in func_pol() [all …]
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H A D | mgga_x_br89_explicit.c | 13855 double t3862, t3863, t3866, t3867, t3870, t3875, t3876, t3879; in func_pol() local 18080 t3879 = t808 * t212; in func_pol() 18082 …4 - 0.13089185438836673192e2 * t3875 * t3876 + 0.13089185438836673192e2 * t3879 * t840 - 0.5710892… in func_pol() 19518 …t6596 = my_piecewise3(t35, t6354 + 0.43630618129455577308e1 * t3879 * t1741 + 0.727176968824259621… in func_pol() 26418 …6385e2 * t3879 * t5100 + 0.26178370877673346385e2 * t838 * t22919 + 0.13089185438836673192e2 * t38… in func_pol() 27093 …t3879 * t6346 + 0.6e1 * t1738 * t870 - 0.20764147541967438420e2 * t3825 * t26480 - 0.2181530906472… in func_pol() 27674 …t3879 * t7459 - 0.57108925150751330992e2 * t3882 * t7518 - 0.65445927194183365962e1 * t3853 * t745… in func_pol() 28837 …455577308e1 * t3879 * t9679 + 0.24e2 * t36653 * t9624 * t869 + 0.43630618129455577308e1 * t3879 * … in func_pol() 30161 …t3879 * t11620 + 0.14543539376485192436e1 * t1714 * t26292 + 0.43630618129455577308e1 * t6359 * t4… in func_pol() 30670 …7394e1 * t6294 * t7601 + 0.43630618129455577308e1 * t3879 * t12426 + 0.43630618129455577308e1 * t3… in func_pol() [all …]
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H A D | mgga_x_mvsb.c | 2471 double t3868, t3873, t3879, t3891, t3892, t3895, t3900, t3901; in func_pol() local 4908 …t3879 = params->k0 * (-0.20e2 / 0.3e1 * t1102 + 0.20e2 / 0.3e1 * t3868 * tau[1] - 0.2e1 * t2163 * … in func_pol() 4925 …t3957 = t3879 * t112 - t1391 * t281 / 0.4e1 - t1111 * t407 / 0.2e1 + 0.5e1 / 0.8e1 * t390 * t1118 … in func_pol() 6570 …t10817 = -t97 * t255 * (t10726 + t10762) / 0.4e1 - t3879 * t281 / 0.2e1 - t1391 * t769 / 0.4e1 + p… in func_pol() 7028 … / 0.16e2 - 0.3e1 / 0.2e1 * t3639 * t2744 - t97 * t255 * t11901 / 0.4e1 - t3879 * t340 / 0.4e1 - t… in func_pol() 7183 …* t4325 + 0.30e2 * t3868) * t112 - t4330 * t281 / 0.4e1 - 0.3e1 / 0.4e1 * t3879 * t407 + 0.15e2 / … in func_pol()
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H A D | mgga_xc_b98.c | 9404 t3879 = t92 * t3878; in func_pol() 9407 t3883 = t3879 * t3882; in func_pol() 10243 t5452 = t3879 * t5451; in func_pol() 10540 t6187 = t3879 * t6186; in func_pol() 11020 t7290 = t3879 * t7289; in func_pol() 15554 t14990 = t185 * t3879 * t14988; in func_pol() 15556 t14995 = t185 * t3879 * t14993; in func_pol() 16012 t17320 = t185 * t3879 * t17318; in func_pol() 16452 t19962 = t185 * t3879 * t19960; in func_pol() 16466 t19990 = t185 * t3879 * t19988; in func_pol() [all …]
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H A D | mgga_x_pbe_gx.c | 2623 double t3869, t3871, t3875, t3877, t3879, t3881, t3884, t3887; in func_pol() local 5160 …t3879 = t3850 * t55 + 0.5e1 / 0.36e2 * t3852 + 0.25e2 / 0.5184e4 * t3854 - 0.5e1 / 0.9e1 * t3131 *… in func_pol() 5161 t3881 = t193 * t3879 * t68; in func_pol() 6789 t10671 = t15 * t3879; in func_pol() 6797 t10775 = t16 * t3879; in func_pol()
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H A D | mgga_c_revtpss.c | 1975 t3879 = t1286 * t1419; in func_unpol() 11306 t3879 = t959 * t864; in func_pol() 11308 t3881 = t3879 * t3880; in func_pol() 13818 t9355 = t3879 * t9354; in func_pol() 15130 t12899 = t3879 * t12898; in func_pol() 15133 t12904 = t3879 * t12903; in func_pol() 15212 t13078 = t215 * t1382 * t3879; in func_pol() 15265 t13188 = t3879 * t13187; in func_pol() 16245 t16092 = t3879 * t4178 * t909; in func_pol() 16845 t18143 = t3879 * t18142; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_wl.c | 531 double t3865, t3867, t3872, t3873, t3875, t3878, t3879, t3880; in func_pol() local 2268 t3879 = 0.16669444444444444444e-2 * t3878; in func_pol() 2281 …t3908 = -0.90015000000000000000e-2 * t3873 + 0.36006000000000000000e-1 * t3875 + t3879 - t3881 - t… in func_pol() 2319 … + 0.22503750000000000000e-2 * t3691 - 0.54000000000000000000e0 * t3697 + t3879 - 0.67511250000000… in func_pol() 2358 …46 - 0.90015000000000000000e-2 * t3755 + 0.36006000000000000000e-1 * t3757 + t3879 + t3904 - t3905; in func_pol()
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H A D | gga_c_scan_e0.c | 1600 double t3867, t3869, t3870, t3872, t3876, t3879, t3880, t3881; in func_pol() local 4060 t3879 = 0.14246666666666666666e0 * t421 * t1226 * t514; in func_pol() 4089 … - 0.55209406483950617283e-2 * t4 * t3711 * t65 + t3858 + t3863 - t3867 - t3879 + 0.91082604192152… in func_pol() 4091 …t4112 = t3872 + t3876 + t3879 + t3881 + t3885 - t3889 - t3891 + t3894 + t3898 - t3903 + t3907 - t3… in func_pol() 4230 …t4487 = t3879 + t3881 + t3885 - t3889 - t3891 + t3894 + t3898 - t3903 + t3907 - t3909 - t3911 - t3… in func_pol() 4479 …t5305 = t3879 - t5294 - t5296 - t5297 + t3885 - t3889 - t5298 + t5300 + t3893 - t3898 - t3903 + t3… in func_pol() 4959 …14 - t3858 + t6415 - t6416 + t7392 - t3863 - t7393 + t7394 + t7396 + t3867 + t3869 + t3876 + t3879; in func_pol() 5009 …3e1 * t572 * t2374 * t598 + 0.12e2 * t5110 * t2758 + t3867 + t3869 + t3876 + t3879 + t7394 + t7396; in func_pol() 5167 …t8306 = t3869 + t3876 + t3879 - t7881 - t5296 - t7882 + t3885 - t3889 - t7883 - t3898 - t3903 + t3… in func_pol() 5263 …t8973 = t3867 + t3869 + t3876 + t3879 - t8971 + t3885 - t3889 + t3898 - t3903 + t3907 - t3909 - t8… in func_pol() [all …]
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H A D | gga_x_lg93.c | 1057 double t3854, t3856, t3859, t3860, t3868, t3879, t3885, t3890; in func_pol() local 3061 t3879 = t7 * t1210 * t237; in func_pol() 3065 …55555555555e-9 * t997 * t485 * t544 * t166 + 0.83246666666666666666e-10 * t3879 * t1355 * t271 * t… in func_pol() 3314 …88888888889e-9 * t3609 * t525 * t1895 * t8 - 0.10405833333333333333e-10 * t3879 * t525 * t5263 * t… in func_pol() 3325 …e-2 * t1379 * t1380 * t5635 * t213 - t5324 + 0.27748888888888888888e-10 * t3879 * t732 * t8 * t243… in func_pol() 3487 …888888888888888e-10 * t1398 * t733 * t1923 - 0.10405833333333333333e-10 * t3879 * t733 * t1904 - 0… in func_pol()
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H A D | gga_xc_th2.c | 530 double t3879, t3881, t3884, t3887, t3891, t3894, t3898, t3900; in func_pol() local 1834 t3879 = t308 * t1607; in func_pol() 1835 …e2 / 0.9e1 * t3871 + 0.80e2 / 0.27e2 * t3875 - 0.1280e4 / 0.81e2 * t3877 - 0.128e3 / 0.3e1 * t3879; in func_pol() 1854 … 0.160e3 / 0.27e2 * t3875 - 0.2560e4 / 0.81e2 * t3877 - 0.256e3 / 0.3e1 * t3879 - 0.160e3 / 0.81e2… in func_pol()
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H A D | gga_c_lm.c | 907 double t3874, t3875, t3877, t3878, t3879, t3880, t3881, t3882; in func_pol() local 2679 t3879 = 0.54123140405754656260e-1 * t3878; in func_pol() 2698 …863 + t3866 - t3869 + t3872 - t3874 - 0.60888532956473988292e-1 * t3875 + t3879 - t3881 + t3884 - … in func_pol() 2771 …975 + t4004 + t4005 - t4006 + 0.17575885964286193785e-1 * t3983 - t3853 + t3879 - t3924 + t3884 + … in func_pol()
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H A D | gga_x_sogga11.c | 1497 double t3875, t3876, t3879, t3883, t3895, t3925, t3962, t3967; in func_pol() local 2973 t3879 = t2595 * t2822; in func_pol() 2976 …t3925 = -0.16e2 / 0.243e3 * t3876 * t3754 - 0.8e1 / 0.243e3 * t3879 * t3794 + 0.13090e5 / 0.243e3 … in func_pol() 3216 … + 0.43e2 / 0.108e3 * t1692 * t5067 + 0.215e3 / 0.216e3 * t1696 * t5067 - t3879 * t5024 / 0.216e3 … in func_pol()
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H A D | gga_x_bpccac.c | 1481 double t3879, t3887, t3890, t3913, t3916, t3921, t3940, t3946; in func_pol() local 2974 t3879 = t124 * t95 * t109; in func_pol() 2977 …t3913 = t97 * t3876 - 0.3640e4 / 0.81e2 * t246 * t3879 + 0.3640e4 / 0.81e2 * t263 * t3852 * t95 + … in func_pol() 3364 …e1 * t2658 * t124 * t632 * t109 + 0.3e1 / 0.8e1 * t2652 * t2583 + t2579 * t3879 / 0.16e2 - 0.15e2 … in func_pol()
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H A D | gga_x_ncap.c | 2296 double t3854, t3857, t3865, t3868, t3873, t3877, t3879, t3885; in func_pol() local 4022 t3879 = t7 * t1182 * t182; in func_pol() 4033 … t3857) - t3865 / 0.2e1 + t3868 / 0.2e1 + t3873 + t3877 - 0.5e1 / 0.9e1 * t3879 - 0.2e1 * t7 * t98… in func_pol() 4081 …t4107 = t3868 / 0.4e1 + t3873 + t3877 - 0.5e1 / 0.12e2 * t3879 - t3895 / 0.6e1 - t3911 / 0.2e1 - t… in func_pol() 4115 …e2 + t7 * t564 * t269 + t3868 / 0.12e2 + t3873 + t3877 - 0.5e1 / 0.18e2 * t3879 + 0.2e1 / 0.9e1 * … in func_pol() 4158 …0.6e1 - t4576 / 0.6e1 + t4579 / 0.27e2 + t3873 + t3877 - 0.5e1 / 0.36e2 * t3879 - t4583 / 0.8e1 - … in func_pol()
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H A D | gga_x_lag.c | 846 double t3836, t3841, t3846, t3852, t3868, t3879, t3885, t3886; in func_pol() local 2857 …t3879 = 0.13365782048935802193e-4 * t3232 + 0.40097346146807406580e-4 * t3235 - 0.4455260682978600… in func_pol() 2868 …e-8 * t1268 - t2398 - t2399 + t9 * (t3718 + t3773 + t3790 + t3828 + t3868 + t3879 + t3931 + t3979); in func_pol()
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H A D | gga_c_op_g96.c | 793 double t3855, t3858, t3859, t3860, t3873, t3878, t3879, t3886; in func_pol() local 2837 t3879 = t784 * t3878; in func_pol() 2851 …804064147879969136e-3 * t706 * t3879 - 0.88229053179967232018e-4 * t721 * t3879 - 0.52643463662066… in func_pol()
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H A D | gga_c_op_b88.c | 833 double t3879, t3886, t3887, t3890, t3893, t3896, t3915, t3916; in func_pol() local 2679 t3879 = t18 * t3855; in func_pol() 2689 …39629686860000000000e0 * t239 * t3879 + 0.49881165971364000000e1 * t235 * t3879 + 0.13951166235876… in func_pol()
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H A D | gga_c_gaploc.c | 231 double t3864, t3872, t3873, t3874, t3875, t3878, t3879, t3880; in func_unpol() local 2015 t3879 = t3878 * t313; in func_unpol() 2016 t3880 = t3872 * t3879; in func_unpol() 5016 t3879 = t1081 * t1305; in func_ferr() 10218 t3879 = t1124 * t305; in func_pol() 10219 t3880 = t3879 * t306; in func_pol() 10223 t3886 = t3879 * t1126; in func_pol() 10271 t4019 = t3879 * t4018; in func_pol() 10344 t4216 = t4015 * t3879; in func_pol() 10348 t4224 = t3884 * t3879; in func_pol() [all …]
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H A D | gga_x_ityh.c | 140 double t3871, t3872, t3873, t3874, t3878, t3879, t3907, t3917; in func_unpol() local 1092 t3879 = t3870 * t3878; in func_unpol() 1093 …- t1703 * t161 + 0.3e1 * t3872 * t3874 * t1233 - 0.12e2 * t3879 * t3874 * t1242 - 0.6e1 * t3879 * … in func_unpol() 1202 … t3149 * t1287 * t1655 - 0.15e2 / 0.4e1 * t1286 * t1287 * t1669 - 0.9e1 * t3879 * t4980 * t573 + 0… in func_unpol()
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H A D | gga_c_acgga.c | 2729 double t3861, t3865, t3867, t3868, t3870, t3874, t3876, t3879; in func_pol() local 5939 t3879 = t428 * t601; in func_pol() 5940 t3881 = t330 * t368 * t3879; in func_pol() 9127 … - t3423 * t3424 * t1131 * t944 / 0.8e1 + 0.3e1 / 0.8e1 * t3433 * t3424 * t3879 * t317 - 0.3e1 / 0… in func_pol() 9450 … t779 * t4678 * t797 - 0.34299214494455789578e-1 * t3514 * t779 * t3897 * t3879 - 0.10289764348336… in func_pol() 9558 …175 * t15762 * t3500 + 0.17149607247227894789e-1 * t2460 * t2262 * t440 * t3879 + 0.17149607247227… in func_pol() 9661 …31754508e-2 * t13295 + 0.10289764348336736873e0 * t11735 * t770 * t3515 * t3879 + 0.80031500487063… in func_pol() 10858 t23278 = t6506 * t779 * t1666 * t3879; in func_pol() 10999 t23593 = t6506 * t770 * t5732 * t3879; in func_pol()
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 268 t3879,t3894,t3910,t3925,t3941,t3956,t3972,t3975,t3977,t3979,t3981,t3983,& local 2082 t3879 = .CONVERT."-0.500217483782016000E18" * t634 - .CONVERT."0.500217483782016000E18" * & 2361 + t4026 + t4257 + t4157 + t4392 + t4077 + t4042 + t3879 + t3972 &
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/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 268 t3879,t3894,t3910,t3925,t3941,t3956,t3972,t3975,t3977,t3979,t3981,t3983,& local 2082 t3879 = .CONVERT."-0.500217483782016000E18" * t634 - .CONVERT."0.500217483782016000E18" * & 2361 + t4026 + t4257 + t4157 + t4392 + t4077 + t4042 + t3879 + t3972 &
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_xc_bn05.c | 943 double t3854, t3857, t3865, t3869, t3873, t3875, t3878, t3879; in func_pol() local 2756 t3879 = t1382 * t3878; in func_pol() 2757 ….2e1 * t495 * t1357 + t3873 * t84 - 0.10e2 / 0.81e2 * t661 * t3875 + 0.2e1 / 0.27e2 * t661 * t3879; in func_pol() 3902 t8646 = t2123 * t3879; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_tb09.c | 2198 double t3876, t3879, t3886, t3888, t3891, t3892, t3895, t3898; in func_ferr() local 3443 t3879 = t876 * t1370; in func_ferr() 3449 …e1 * t504 * t3871 - 0.4e1 * t881 * t1384 - 0.4e1 * t500 * t3876 + 0.6e1 * t3879 * t401 + 0.2e1 * t… in func_ferr() 3457 …* t414 + t3842 * t2879 / 0.18e2 + t2852 + t2874 + t2876 - t2882 - 0.3e1 * t3879 * t420 - t877 * t2… in func_ferr() 3844 …0 / 0.9e1 - t5623 - t161 * t5625 - 0.2e1 / 0.3e1 * t504 * t5628 + 0.6e1 * t3879 * t752 + t504 * t5… in func_ferr() 3852 …4 / 0.2e1 + 0.2e1 * t881 * t4868 - 0.4e1 / 0.3e1 * t881 * t4875 - 0.3e1 * t3879 * t766 - t877 * t6… in func_ferr()
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