| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_sfat_pbe.c | 1725 double t2847, t2848, t2851, t2856, t2857, t2875, t2880, t2885; in func_ferr() local
2717 t2851 = t960 * t441; in func_ferr()
5020 t2851 = t4 * t453; in func_pol()
5026 t2858 = t2851 * t319 * t2856; in func_pol()
5678 t4452 = t2851 * t319 * t4450; in func_pol()
6042 t5313 = t2851 * t319 * t5311; in func_pol()
6225 t5754 = 0.68549626753485969646e-7 * t2851 * t319 * t5751; in func_pol()
6576 t7621 = t2851 * t900 * t2856; in func_pol()
7029 t10440 = t2851 * t900 * t4450; in func_pol()
7352 t12681 = t2851 * t900 * t5311; in func_pol()
[all …]
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| H A D | gga_x_wc.c | 754 double t2822, t2844, t2851, t2891, t2893, t2896, t2898, t2904; in func_pol() local
1890 t2851 = t699 * sigma[0]; in func_pol()
1897 …t2851 * t33 - 0.25323980763139613588e-1 * t290 * t704 * t1190 + 0.36647711998689847306e-3 * t290 *… in func_pol()
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| H A D | gga_c_op_g96.c | 740 double t2839, t2840, t2843, t2844, t2845, t2848, t2851, t2852; in func_pol() local
2365 t2851 = t280 * t850; in func_pol()
2366 t2852 = t2851 * t114; in func_pol()
2534 t3229 = t2851 * t149; in func_pol()
2781 t3778 = t2851 * t181; in func_pol()
4039 …e-2 * t10605 - 0.72917382806163828060e-3 * t10607 - 0.50000000000000000000e0 * t338 * t2851 * t300; in func_pol()
4288 …- 0.50000000000000000000e0 * t338 * t10525 * t149 - 0.50000000000000000000e0 * t338 * t2851 * t350; in func_pol()
4427 …5962853200000000000e1 * t1067 * t3232 - 0.50000000000000000000e0 * t338 * t2851 * t426 + 0.5833390… in func_pol()
4669 …000000000000e0 * t338 * t10525 * t181 - 0.50000000000000000000e0 * t338 * t2851 * t518 - 0.1577018… in func_pol()
4864 …583476561232765612e-2 * t1919 * t3757 - 0.50000000000000000000e0 * t338 * t2851 * t587 - 0.5000000… in func_pol()
[all …]
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| H A D | gga_k_dk.c | 913 double t2831, t2845, t2848, t2851, t2856, t2860, t2863, t2865; in func_pol() local
2523 t2851 = t383 * t397 * t479; in func_pol()
2527 … t393 / 0.2e1 - 0.2e1 / 0.27e2 * t2845 - t2848 / 0.9e1 - 0.2e1 / 0.27e2 * t2851 - 0.2e1 / 0.3e1 * … in func_pol()
2574 …* t2828 + t2831 - 0.2e1 / 0.9e1 * t2845 - t2848 / 0.3e1 - 0.2e1 / 0.9e1 * t2851 - 0.2e1 / 0.3e1 * … in func_pol()
2598 …* t3238 - 0.4e1 / 0.9e1 * t2845 - 0.2e1 / 0.3e1 * t2848 - 0.4e1 / 0.9e1 * t2851 - 0.4e1 / 0.3e1 * … in func_pol()
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| H A D | gga_c_tca.c | 886 double t2848, t2849, t2851, t2853, t2856, t2857, t2859, t2862; in func_pol() local
2277 t2851 = t310 * t47 * t170; in func_pol()
2278 t2853 = t275 * t317 * t2851; in func_pol()
2281 t2859 = t787 * t308 * t2851; in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1080 double t2848, t2851, t2854, t2870, t2890, t2892, t2899, t2907; in func_pol() local
2286 t2851 = t7 * t427 * t1330; in func_pol()
2290 …0.27e2 + t2839 / 0.27e2 - t2842 / 0.6e1 - t2845 / 0.2e1 - t2848 / 0.2e1 - t2851 / 0.6e1 - t2854 / … in func_pol()
2327 …- 0.2e1 / 0.3e1 * t2842 - 0.2e1 * t2845 - 0.2e1 * t2848 - 0.2e1 / 0.3e1 * t2851 - 0.2e1 / 0.3e1 * … in func_pol()
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| H A D | gga_c_zvpbeloc.c | 2120 double t2833, t2836, t2839, t2840, t2841, t2846, t2848, t2851; in func_pol() local
4453 t2851 = t329 * t1190; in func_pol()
4454 …- t1191 * t2738 - 0.2e1 * t1191 * t2741 - 0.2e1 * t1191 * t2748 - 0.2e1 * t2851 * t1192 - 0.2e1 * … in func_pol()
6981 … * t9531 * t676 - 0.6e1 * t1088 * t2012 - 0.3e1 * t2851 * t2738 - 0.6e1 * t2851 * t2741 - 0.6e1 * … in func_pol()
6985 … + t2050 * t460 - 0.3e1 * t3774 * t2525 + 0.6e1 * t3750 * t2531 - 0.3e1 * t2851 * t2731 + 0.12e2 *… in func_pol()
7129 …* t2735 * t1186 + 0.8e1 * t2751 * t3736 + 0.8e1 * t2751 * t3777 - 0.4e1 * t2851 * t3742 - 0.2e1 * … in func_pol()
7133 … t10287 * t3153 - 0.2e1 * t10305 * t382 - 0.4e1 * t2735 * t1196 - 0.2e1 * t2851 * t3739 + 0.12e2 *… in func_pol()
7142 … t1088 * t2863 + 0.12e2 * t2751 * t3732 + 0.4e1 * t2751 * t3771 - 0.4e1 * t2851 * t3725 + 0.8e1 * … in func_pol()
7282 … * t9589 * t445 - 0.2e1 * t1088 * t2846 - 0.4e1 * t3774 * t2748 - 0.2e1 * t2851 * t3723 + 0.2e1 * … in func_pol()
8337 …64365e-1 * t16049 - t16053 + 0.32898681336964528730e-1 * t16057 - 0.2e1 * t2851 * t4998 - 0.2e1 * … in func_pol()
[all …]
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| H A D | gga_c_q2d.c | 3081 t2851 = t162 * t728; in func_ferr()
7507 t2853 = t171 * t172 * t2851; in func_pol()
10735 t8808 = t63 * t2851; in func_pol()
10739 t8813 = t308 * t2851; in func_pol()
10889 t9089 = t171 * t482 * t2851; in func_pol()
12607 t11707 = t786 * t2851; in func_pol()
16518 t28049 = t1324 * t2851; in func_pol()
16864 t28928 = t2851 * t283; in func_pol()
17445 t31049 = t2851 * t631; in func_pol()
17457 t31110 = t2851 * t649; in func_pol()
[all …]
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| H A D | gga_x_chachiyo.c | 1365 double t2851, t2852, t2854, t2855, t2856, t2857, t2858, t2859; in func_pol() local
3743 t2851 = t917 * t2850; in func_pol()
3744 t2852 = t2851 / 0.162e3; in func_pol()
5370 …2855 / 0.12e2 - t2847 / 0.27e2 - t2863 / 0.36e2 - t9278 - t9280 - t9282 - t2851 / 0.81e2 - t2859 /… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_pkzb.c | 5930 t2861 = t50 * t2851; in func_pol()
5946 t2891 = t492 * t2851; in func_pol()
5952 t2909 = t240 * t2851; in func_pol()
8318 t7723 = t183 * t2851; in func_pol()
8322 t7732 = t51 * t2851; in func_pol()
8371 t7828 = t510 * t2851; in func_pol()
8405 t7924 = t2851 * t496; in func_pol()
9001 t9600 = t2200 * t2851; in func_pol()
10262 t12250 = t534 * t2851; in func_pol()
14904 t27542 = t2851 * t465; in func_pol()
[all …]
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| H A D | mgga_x_edmgga.c | 123 double t2782, t2789, t2790, t2791, t2795, t2798, t2827, t2851; in func_unpol() local
1050 …t2851 = -0.18e2 * t1228 * t2827 * t277 + t19 * t2695 * t67 - 0.3e1 * t832 * t123 - 0.6e1 * t139 * … in func_unpol()
1052 …05 - t712 * t149 - 0.3e1 * t237 * t339 - t139 * t785 + 0.24e2 * t48 * t2504 * t148 * t722 + t2851); in func_unpol()
3430 double t2838, t2839, t2842, t2851, t2861, t2875, t2876, t2879; in func_pol() local
5039 t2851 = t110 * t971; in func_pol()
6934 …45157315668e-1 * t772 * t8710 * t292 - 0.70819478890314631336e-1 * t772 * t2851 * t763 - 0.1246162… in func_pol()
6938 …7094339946e1 * t2318 * t778 * t10390 + 0.10622921833547194700e0 * t2314 * t2851 * t3281 - 0.762172… in func_pol()
7103 …45157315668e-1 * t772 * t8710 * t336 - 0.70819478890314631336e-1 * t772 * t2851 * t873 - 0.7081947… in func_pol()
7110 …7094339946e1 * t2318 * t778 * t11500 + 0.10622921833547194700e0 * t2314 * t2851 * t3898 - 0.762172… in func_pol()
7502 …t2851 * t1069 - 0.35409739445157315668e-1 * t772 * t13379 * t230 + 0.16615495624729559964e1 * t777… in func_pol()
[all …]
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| H A D | mgga_c_cs.c | 758 double t2846, t2847, t2848, t2849, t2851, t2852, t2856, t2857; in func_pol() local
2418 t2851 = 0.87268489244444444441e-2 * t2811; in func_pol()
2424 …845 + t2846 + t2847 + t2848 + t2849 + 0.43278400000000000000e-1 * t2808 + t2851 + t2852 - 0.162294… in func_pol()
2463 …t2922 = t2849 + 0.28852266666666666666e-1 * t2808 + t2851 + t2852 - 0.54098000000000000000e-2 * t2… in func_pol()
2481 …t2956 = t2846 + t2847 + t2848 + t2849 + t2892 + t2851 + t2852 - t2894 - t2895 - t2856 - t2857 - t2… in func_pol()
2493 …43278400000000000000e-1 * t2889 - t2845 + t2846 + t2847 + t2848 + t2849 + t2851 + t2852 - t2856 - … in func_pol()
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| H A D | mgga_c_scanl.c | 1955 t2851 = t689 * t275; in func_unpol()
3179 t7300 = t2851 * t250; in func_unpol()
7430 t2851 = t708 * t1103; in func_ferr()
15244 t2852 = t2851 * t139; in func_pol()
15251 t2871 = t917 * t2851; in func_pol()
15258 t2883 = t636 * t2851; in func_pol()
18144 t9037 = t2851 * t631; in func_pol()
18146 t9041 = t2851 * t643; in func_pol()
18390 t9649 = t2851 * t830; in func_pol()
18394 t9661 = t2851 * t838; in func_pol()
[all …]
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| H A D | mgga_x_m08.c | 1450 double t2839, t2844, t2851, t2858, t2863, t2878, t2884, t2905; in func_ferr() local
2246 t2851 = t98 * t2806; in func_ferr()
2247 …0 - 0.504e3 * t1539 * t2826 - 0.720e3 * t1551 * t2831 - 0.990e3 * t1562 * t2851 - 0.36e2 * t169 * … in func_ferr()
2251 …t2834 - 0.144e3 * t619 * t2839 - 0.300e3 * t562 * t2844 - 0.720e3 * t78 * t2851 - 0.990e3 * t84 * … in func_ferr()
2252 …6 - 0.336e3 * t1530 * t2821 - 0.2430e4 * t219 * t2851 - 0.3300e4 * t226 * t2863 - 0.2700e4 * t536 … in func_ferr()
2253 …2831 - 0.54e2 * t690 * t2834 - 0.144e3 * t697 * t2839 - 0.2700e4 * t676 * t2851 - 0.3630e4 * t683 … in func_ferr()
2254 …34 - 0.60e2 * t1774 * t2839 - 0.120e3 * t1783 * t2844 - 0.990e3 * t1808 * t2851 - 0.108e3 * t260 *… in func_ferr()
2255 … * t129 * t2851 - 0.990e3 * t132 * t2863 - 0.1320e4 * t135 * t2878 - 0.1716e4 * t138 * t2884 - 0.3… in func_ferr()
2766 double t2825, t2830, t2833, t2836, t2843, t2848, t2851, t2859; in func_pol() local
4062 …t2851 = 0.8000e4 * t344 * t2816 + 0.10000e5 / 0.3e1 * t88 * t2820 + 0.7000e4 / 0.3e1 * t2823 * t28… in func_pol()
[all …]
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| H A D | mgga_x_mbrxh_bg.c | 172 double t2831, t2849, t2850, t2851, t2854, t2858, t2859, t2866; in func_unpol() local
1872 t2851 = t351 * t2850; in func_unpol()
1882 …t2886 = -0.4e1 * t2851 * t372 + t2851 * t356 - t460 * t2859 / 0.3e1 - 0.2e1 / 0.3e1 * t779 * t760 … in func_unpol()
4915 … t18788 + 0.6e1 * t2851 * t2737 + 0.2e1 * t2879 * t7381 + t455 * t18089 + t465 * t11933 / 0.2e1 - … in func_unpol()
5576 t23592 = t2851 * t3817; in func_unpol()
5591 t23721 = t2851 * t3994; in func_unpol()
5593 t23732 = t2851 * t3999; in func_unpol()
11727 double t2851, t2852, t2859, t2861, t2867, t2870, t2871, t2882; in func_pol() local
16057 t2851 = t824 * t177; in func_pol()
16058 t2852 = t175 * t2851; in func_pol()
[all …]
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| H A D | mgga_x_mvsb.c | 2422 double t2846, t2847, t2848, t2850, t2851, t2852, t2854, t2855; in func_pol() local
4335 t2851 = t998 * t1082; in func_pol()
4336 t2852 = t2851 * t211; in func_pol()
4735 t3610 = t2851 * t325 / 0.4608e4; in func_pol()
5997 t8277 = t2851 * t568; in func_pol()
5999 t8291 = t2851 * t575; in func_pol()
6318 t9724 = t2851 * t886; in func_pol()
6322 t9735 = t2851 * t882; in func_pol()
6746 t11332 = t2851 * t1210 / 0.196608e6; in func_pol()
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| H A D | mgga_x_vt84.c | 3422 double t2844, t2845, t2848, t2851, t2853, t2855, t2858, t2859; in func_ferr() local
4746 t2851 = t360 * t300; in func_ferr()
4760 …t2894 = t2851 * t210 + 0.10e2 / 0.81e2 * t229 * t2855 - 0.14502159208922774169e-1 * t1126 * t2859 … in func_ferr()
5763 …2967 * t8527 * t195 - 0.18630000000000000000e-3 * t1080 * t2182 - 0.2e1 * t2851 * t1587 - 0.372600… in func_ferr()
5791 …208 * t366 + t2851 * t524 - 0.2e1 * t2975 * t872 - t1080 * t518 * t366 - t2851 * t540 + 0.2e1 * t8… in func_ferr()
6026 …2583 + 0.23343139531776782830e-3 * t3035 * t7061 + t3669 * t210 - 0.2e1 * t2851 * t728 - 0.7452000… in func_ferr()
6062 …t10887 = -0.2e1 * t1099 * t2810 - 0.2e1 * t1073 * t728 + 0.2e1 * t2851 * t706 + 0.20e2 / 0.81e2 * … in func_ferr()
6077 …070 + 0.4e1 * t2979 * t2868 + 0.4e1 * t2981 * t2868 + 0.4e1 * t2851 * t1583 - 0.2e1 * t2851 * t257… in func_ferr()
6351 …195 * t3104 - t219 * t3524 * t366 - 0.3e1 * t1080 * t977 * t366 - 0.3e1 * t2851 * t994 - 0.3e1 * t… in func_ferr()
6353 …0000e-2 * t219 * t368 * t3476 + 0.10e2 / 0.27e2 * t1009 * t2855 + 0.3e1 * t2851 * t979 + 0.10e2 / … in func_ferr()
[all …]
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| H A D | mgga_x_m06l.c | 2827 double t2851, t2853, t2855, t2857, t2859, t2862, t2863, t2865; in func_pol() local
4279 t2851 = t8 * t2235 * t1146; in func_pol()
4294 …t2886 = -t2848 / 0.6e1 - t2851 / 0.18e2 - t2855 / 0.6e1 - t2859 / 0.2e1 - t2865 / 0.2e1 + t2869 - … in func_pol()
4429 …t3313 = -0.3e1 / 0.8e1 * t2835 - t2838 - t2841 / 0.2e1 - t2844 / 0.6e1 - t2848 / 0.2e1 - t2851 / 0… in func_pol()
5653 …35 / 0.4e1 - 0.2e1 / 0.3e1 * t2838 - t2841 / 0.3e1 - t2844 / 0.9e1 - t2848 / 0.3e1 - t2851 / 0.9e1; in func_pol()
5702 …t6809 = -t3303 - 0.2e1 * t2838 - t2841 - t2844 / 0.3e1 - t2848 - t2851 / 0.3e1 - t2855 / 0.2e1 - 0… in func_pol()
5800 …- 0.2e1 * t2841 - 0.2e1 / 0.3e1 * t2844 - 0.2e1 * t2848 - 0.2e1 / 0.3e1 * t2851 + 0.4e1 / 0.3e1 * … in func_pol()
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| H A D | mgga_x_br89.c | 179 double t2835, t2846, t2847, t2850, t2851, t2854, t2857, t2858; in func_unpol() local
2818 t2851 = t77 * t2850; in func_unpol()
7699 ….30e2 * t3778 * t5579 * t16731 + t13748 * t5422 / 0.3e1 + t2851 * t9091 * t5421 / 0.3e1 + t2851 * … in func_unpol()
8963 ….3e1 * t2808 * t30174 + t2808 * t28966 / 0.6e1 + t2851 * t28971 / 0.6e1 - t4226 * t28986 / 0.3e1 +… in func_unpol()
9852 …- t29677 - t4313 * t33114 + t2851 * t33134 / 0.6e1 - t3119 * t33124 / 0.3e1 + 0.2e1 / 0.3e1 * t280… in func_unpol()
10149 …t2851 * t30938 / 0.3e1 + t2851 * t30933 / 0.3e1 + t2851 * t30928 / 0.3e1 + 0.2e1 / 0.3e1 * t2847 *… in func_unpol()
10826 … - t2796 * t2044 * t42697 / 0.3e1 + t2851 * t41194 / 0.3e1 - t14349 * t8193 / 0.3e1 + t2851 * t410… in func_unpol()
11018 …t2851 * t1282 * t1283 * t794 * t1197 / 0.2e1 + t2851 * t1282 * t1283 * t251 * t5490 / 0.2e1 + 0.2e… in func_unpol()
13710 … + t2847 * t1282 * t58913 + t2851 * t58215 / 0.2e1 - t2796 * t2044 * t58913 / 0.2e1 + 0.2e1 * t284… in func_unpol()
13996 double t2851, t2854, t2855, t2860, t2861, t2866, t2867, t2868; in func_ferr() local
[all …]
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| H A D | mgga_x_2d_prhg07.c | 4416 double t2832, t2833, t2834, t2837, t2840, t2841, t2851, t2864; in func_pol() local
6891 t2851 = t1598 * t2833; in func_pol()
6892 … t2697 / 0.2e1 - 0.3e1 / 0.16e2 * t2603 * t2288 + 0.3e1 / 0.8e1 * t2662 * t2851 - 0.3e1 / 0.8e1 * … in func_pol()
7052 …t3190 = t2496 - t2500 + 0.3e1 / 0.8e1 * t3156 * t2851 - 0.3e1 / 0.8e1 * t2190 * t3159 + 0.3e1 / 0.… in func_pol()
9873 t11817 = t10962 * t2851; in func_pol()
9929 …1257 * t11954 - 0.3e1 / 0.8e1 * t10995 * t2288 + 0.3e1 / 0.4e1 * t11198 * t2851 + 0.3e1 / 0.4e1 * … in func_pol()
9934 …t2603 * t9203 - 0.3e1 / 0.16e2 * t2603 * t9211 + 0.5e1 / 0.8e1 * t11192 * t2851 - t2841 * t11262 /… in func_pol()
10233 t13497 = t13486 * t2851; in func_pol()
11235 …7079 * t2668 * t16225 + t16232 - 0.3e1 / 0.16e2 * t15509 * t2288 + t15675 * t2851 / 0.4e1 - t16238; in func_pol()
11643 …841 * t1159 * t11208 / 0.2e1 - 0.3e1 / 0.16e2 * t17018 * t2288 + t17175 * t2851 / 0.4e1 + t11947 *… in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 117 double t2819, t2826, t2829, t2836, t2843, t2846, t2850, t2851; in func_unpol() local
964 t2851 = t2850 * tau[0]; in func_unpol()
969 …t2851 + 0.1600e4 * t273 * t2851 + 0.960e3 * t750 * t2782 + 0.5040e4 * t287 * t2790 + 0.3000e4 * t2… in func_unpol()
979 …t2851 + 0.800e3 * t167 * t2861 + 0.3360e4 * t176 * t2750 + 0.4800e4 * t179 * t2754 + 0.6600e4 * t1… in func_unpol()
980 …6 + 0.3000e4 * t368 * t2861 + 0.1400e4 * t170 * t2790 + 0.800e3 * t2025 * t2851 + 0.3600e4 * t837 … in func_unpol()
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| H A D | mgga_xc_cc06.c | 1098 double t2851, t2854, t2858, t2867, t2871, t2881, t2885, t2888; in func_pol() local
2905 t2851 = t399 * t399; in func_pol()
2907 t2858 = 0.24954977986735470917e5 * t31 / t2851 * t2336 / t2854; in func_pol()
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
| H A D | mpfr_cutoff_gamma.f90 | 254 t2796,t2798,t2800,t2802,t2804,t2805,t2808,t2810,t2820,t2822,t2828,t2851,& local
1549 t2851 = .CONVERT."-0.6276992801587200E16" * t585 - .CONVERT."0.1170640233100800E16" * t588 &
1588 * t2805 + t2851 - .CONVERT."0.66788651049120000E17" * t469 - .CONVERT."0.131072E6" * &
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| /dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
| H A D | mpfr_cutoff_gamma.f90 | 254 t2796,t2798,t2800,t2802,t2804,t2805,t2808,t2810,t2820,t2822,t2828,t2851,& local
1549 t2851 = .CONVERT."-0.6276992801587200E16" * t585 - .CONVERT."0.1170640233100800E16" * t588 &
1588 * t2805 + t2851 - .CONVERT."0.66788651049120000E17" * t469 - .CONVERT."0.131072E6" * &
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_ksdt.c | 5492 t2851 = t1132 * t250; in func_pol()
5494 t2853 = t2851 * t2852; in func_pol()
5737 t3441 = t2851 * t734; in func_pol()
8239 t9110 = t2851 * t2196; in func_pol()
8409 t9613 = t2851 * t9612; in func_pol()
8422 t9651 = t2851 * t9650; in func_pol()
9117 t11455 = t2851 * t5503; in func_pol()
9126 t11468 = t2851 * t11467; in func_pol()
9372 t12212 = t2851 * t737; in func_pol()
12450 t22138 = t2851 * t931; in func_pol()
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