/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 256 t2968,t2970,t2972,t2977,t2979,t2983,t2985,t2987,t2988,t2990,t2996,t2998,& local 1644 t2987 = t2880 * t17 1645 t2988 = t2987 * R 2018 t3747 = t2987 * t93 2337 t4388 = t2987 * t261 2615 t4988 = .CONVERT."0.352237649920E12" * t2527 * t648 + .CONVERT."0.162571223040E12" * t2987 &
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H A D | mpfr_yukawa.f90 | 2406 t2987 = t423 * t526 2407 t2989 = t525 * t2987 * t529 2775 t3790 = t525 * t2987 * t984 3321 t5033 = t525 * t2987 * t999 4009 t6533 = t525 * t2987 * t1282 4163 t6891 = t525 * t2987 * t1312 5388 t9511 = t525 * t2987 * t1751 6176 t11186 = t525 * t2987 * t1783 6781 t12487 = t525 * t2987 * t2338 7542 t13995 = t525 * t2987 * t2318 [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 256 t2968,t2970,t2972,t2977,t2979,t2983,t2985,t2987,t2988,t2990,t2996,t2998,& local 1644 t2987 = t2880 * t17 1645 t2988 = t2987 * R 2018 t3747 = t2987 * t93 2337 t4388 = t2987 * t261 2615 t4988 = .CONVERT."0.352237649920E12" * t2527 * t648 + .CONVERT."0.162571223040E12" * t2987 &
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H A D | mpfr_yukawa.f90 | 2406 t2987 = t423 * t526 2407 t2989 = t525 * t2987 * t529 2775 t3790 = t525 * t2987 * t984 3321 t5033 = t525 * t2987 * t999 4009 t6533 = t525 * t2987 * t1282 4163 t6891 = t525 * t2987 * t1312 5388 t9511 = t525 * t2987 * t1751 6176 t11186 = t525 * t2987 * t1783 6781 t12487 = t525 * t2987 * t2338 7542 t13995 = t525 * t2987 * t2318 [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_p86.c | 967 double t2987, t2989, t2990, t2992, t2993, t2995, t2996, t2997; in func_pol() local 2410 t2987 = t2986 * t512; in func_pol() 2417 …+ t2974 - t2975 / 0.2e1 - t2980 - 0.3e1 / 0.2e1 * t2981 - t2985 + 0.7e1 * t2987 - t2990 + t2993 - … in func_pol() 2457 … t2968 + t3065 + t3066 - t2975 - t3067 - 0.3e1 * t2981 - t3069 + 0.14e2 * t2987 - t3071 + t3072 - … in func_pol() 2525 t3181 = 0.14e2 / 0.3e1 * t2987; in func_pol() 2556 … 0.3e1 * t2968 + t3065 + t3066 - t3067 - t2981 - t3069 + 0.28e2 / 0.3e1 * t2987 - t3071 + t3072 - … in func_pol() 2588 …* t2955 - t2961 + t2964 + t2971 + t2974 - t2980 - t2985 + 0.7e1 / 0.3e1 * t2987 - t2990 + t2993 - … in func_pol()
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H A D | gga_xc_th2.c | 499 double t2981, t2984, t2986, t2987, t2990, t2993, t2996; in func_pol() local 1592 t2987 = t39 * t2986; in func_pol() 1597 …v3sigma3[9] = -0.33998812500000000000e-1 * t2987 * t388 + 0.27557437500000000000e-1 * t2990 * t388… in func_pol() 2273 …8164984375000000000e-1 * t33 * t2986 * t388 - 0.45331750000000000000e-1 * t2987 * t1003 + 0.413361… in func_pol() 2303 … * t795 * t2986 * t58 + 0.45331750000000000000e-1 * t2987 * t1115 - 0.45331750000000000000e-1 * t2… in func_pol()
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H A D | gga_x_2d_b86.c | 543 double t2977, t2981, t2987, t2989, t2995, t2999, t3004, t3006; in func_pol() local 2072 t2987 = t1642 * t352; in func_pol() 2079 …4402081619040e-2 * t1090 * t39 * t78 * t207 + 0.35628572201040809520e-2 * t2987 - 0.71257144402081… in func_pol() 2135 …* t3233 - 0.11876190733680269840e-2 * t2981 + 0.23752381467360539680e-2 * t2987 - 0.23752381467360… in func_pol() 2184 …* t3231 + 0.47504762934721079359e-2 * t3233 + 0.11876190733680269840e-2 * t2987 + t3012 - t2995 - … in func_pol()
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H A D | gga_x_rge2.c | 587 double t2987, t3008, t3011, t3030, t3040, t3046, t3053, t3056; in func_pol() local 1735 t2987 = t974 * t1123; in func_pol() 1739 …1 * t2917 + 0.12928320000000000000e1 * t2919 + 0.86188800000000000000e0 * t2987 + 0.21547200000000… in func_pol() 1767 …v4rho2sigma2[12] = t2946 + 0.17237760000000000000e1 * t2987 + 0.21547200000000000000e0 * t377 * t2… in func_pol()
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H A D | gga_c_tca.c | 896 double t2981, t2982, t2983, t2984, t2985, t2986, t2987, t2988; in func_pol() local 2373 t2987 = 0.12542379519600661852e-2 * t2789; in func_pol() 2375 …t3000 = t2984 + t2985 - t2986 + t2987 + t2909 - t2988 + 0.40577272137482127086e0 * t2802 - 0.58636… in func_pol() 2445 …- 0.84535983619754431428e-1 * t3032 + 0.14095330427138835390e-2 * t3036 + t2987 + t2909 - t2988 + … in func_pol() 2486 … + 0.40577272137482127086e0 * t3021 - 0.58636574576897555222e-1 * t3024 + t2987 + t2909 - t2988 - … in func_pol()
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H A D | gga_x_lv_rpw86.c | 1082 double t2973, t2974, t2984, t2987, t2992, t3005, t3014, t3015; in func_pol() local 2307 t2987 = t1288 * t569; in func_pol() 2312 …1415679671885008e-13 * t243 * t2984 + 0.46794810257847712717e-19 * t577 * t2987 + 0.64697075667541… in func_pol() 2419 …2 * t3594) - 0.18835702199692392195e-14 * t307 * t2984 - 0.87740269233464461344e-20 * t712 * t2987; in func_pol() 2522 …t4103 = 0.10967533654183057668e-20 * t794 * t2987 - 0.16555613912474372028e-19 * t23 * t573 / t72 … in func_pol()
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H A D | gga_k_mpbe.c | 778 double t2939, t2945, t2987, t2992, t2993, t2995, t3004, t3016; in func_pol() local 1858 …t2987 = -0.19e2 / 0.162e3 * t138 * t1201 * params->a + 0.167e3 / 0.1296e4 * t1205 * t1371 - 0.25e2… in func_pol() 1860 …/ 0.3e1 + t546 * t2928 * t121 + t546 * t1363 * t330 / 0.2e1 + 0.3e1 / 0.10e2 * t248 * t249 * t2987; in func_pol()
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H A D | gga_xc_th3.c | 579 double t2973, t2975, t2977, t2979, t2985, t2987, t2989, t2991; in func_pol() local 1735 t2987 = t1260 * t170; in func_pol() 1754 ….16e2 / 0.3e1 * t2979 + 0.41888e5 / 0.81e2 * t2985 - 0.78848e5 / 0.81e2 * t2987 + 0.2816e4 / 0.9e1… in func_pol() 1755 …0.8e1 / 0.3e1 * t2979 + 0.20944e5 / 0.81e2 * t2985 - 0.39424e5 / 0.81e2 * t2987 + 0.1408e4 / 0.9e1… in func_pol()
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H A D | gga_x_airy.c | 1162 double t2982, t2983, t2987, t2989, t2992, t2993, t2997, t3000; in func_pol() local 2406 t2987 = 0.1e1 / t55 / t2975 / rho[1]; in func_pol() 2407 t2989 = t2987 * t19 * t22; in func_pol() 2425 t3053 = t1868 * t2987 * t23; in func_pol()
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H A D | gga_x_am05.c | 1734 double t2968, t2973, t2977, t2979, t2982, t2985, t2987, t2990; in func_pol() local 3183 t2987 = t213 * t1368 * t239; in func_pol() 3192 …t3035 = -0.2e1 / 0.243e3 * t2985 * t2987 - 0.2563e4 / 0.1458e4 * t491 * t492 * t2990 * t498 - 0.26… in func_pol() 3490 …88 / 0.2916e4 - t2488 * t3018 / 0.96e2 + t2496 * t3021 / 0.96e2 + t4830 * t2987 / 0.432e3 + t33 * … in func_pol() 3621 …ma[0] * t239 / 0.9e1 - t204 * t841 * t36 * t5506 * t886 / 0.9e1 - t5795 * t2987 / 0.1728e4 + t5799… in func_pol() 3715 …2 + t33 * t854 * t6245 * t239 / 0.12e2 - t2488 * t5761 / 0.96e2 + t6253 * t2987 / 0.9216e4 - t6257… in func_pol()
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H A D | gga_x_hjs_b88_v2.c | 9473 t2987 = 0.2e1 * t2971; in func_pol() 9474 t2988 = t20 * t2987; in func_pol() 9621 t3404 = -t2987; in func_pol() 11561 t9078 = t2987 * t365; in func_pol() 11609 t9220 = t2987 * t484; in func_pol() 12016 t10444 = t806 * t2987; in func_pol() 12029 t10471 = t2987 * t819; in func_pol() 16452 t28213 = t167 * t2987; in func_pol() 17007 t31287 = t8 * t2987; in func_pol() 17910 t36281 = t2987 * t2987; in func_pol() [all …]
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H A D | gga_x_wpbeh.c | 8398 t2987 = t2986 * t277; in func_ferr() 17640 t2987 = t1105 * t265; in func_pol() 17641 t2988 = t2987 * t1003; in func_pol() 17679 t3067 = t2987 * t1050; in func_pol() 18216 t4431 = t2987 * t1623; in func_pol() 18407 t5002 = t2987 * t1642; in func_pol() 19397 t7925 = t2987 * t2303; in func_pol() 20805 t12104 = t2987 * t2968; in func_pol() 21391 t13835 = t2987 * t2651; in func_pol() 21403 t13862 = t2987 * t2659; in func_pol() [all …]
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H A D | gga_x_q2d.c | 1159 double t2974, t2978, t2982, t2984, t2986, t2987, t2992, t3013; in func_pol() local 3005 t2987 = t2986 / 0.9e1; in func_pol() 3011 …t3029 = t2987 - t452 * t510 * t902 / 0.2e1 + 0.7e1 / 0.6e1 * t2992 - t452 * t198 * t217 * t970 / 0… in func_pol() 3128 …/ 0.3e1 - t3436 / 0.6e1 - t3442 / 0.3e1 - t3449 / 0.6e1 + t3457 / 0.9e1 + t2987 + t3014 - t3781 / … in func_pol()
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H A D | gga_x_beefvdw.c | 1730 double t2982, t2983, t2985, t2987, t2989, t2991, t2993, t2995; in func_pol() local 3063 t2987 = t57 * t2982; in func_pol() 3074 …7 * t2983 + 0.56296854957717736142e7 * t2985 - 0.37062695419646445368e7 * t2987 - 0.31690718837237… in func_pol() 3676 …22 - 0.16307585984644435962e9 * t2985 * t222 - 0.14577730665129094116e9 * t2987 * t222 + 0.1084387… in func_pol() 3782 … t2985 * t411 - 0.24461378976966653943e9 * t1372 * t1066 - 0.21866595997693641174e9 * t2987 * t411; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_m06l.c | 2833 double t2968, t2969, t2972, t2975, t2983, t2984, t2987, t2988; in func_pol() local 4336 t2987 = t80 * t188; in func_pol() 4345 …52 * t1172 * t176 + 0.14000e5 / 0.9e1 * t199 * t2984 + 0.8750e4 / 0.9e1 * t2987 * t2989 + 0.12250e… in func_pol() 4733 …t4156 = -0.1750e4 / 0.3e1 * t2987 * t4056 - 0.2450e4 * t1296 * t4123 - 0.9800e4 / 0.3e1 * t496 * t… in func_pol() 5096 …304 * t4987 + 0.90e2 * t1317 * t4945 + 0.100e3 * t184 * t4957 + 0.350e3 * t2987 * t4975 + 0.840e3 … in func_pol() 5459 …t5447 = -0.336e3 * t199 * t5382 - 0.504e3 * t204 * t5358 - 0.210e3 * t2987 * t5410 - 0.504e3 * t30… in func_pol() 6075 …e1 * t2987 * t8918 + 0.31850e5 * t1296 * t8926 + 0.127400e6 / 0.3e1 * t496 * t8932 - 0.35000e5 / 0… in func_pol() 6465 … t3181 * t10550 - 0.9800e4 / 0.3e1 * t2987 * t10480 + 0.7000e4 / 0.3e1 * t7100 * t10550 + 0.49000e… in func_pol() 7021 … * t4932 + 0.4950e4 * t214 * t4940 + 0.6600e4 * t219 * t4960 + 0.1050e4 * t2987 * t4974 + 0.180e3 … in func_pol() 7037 …8400e4 * t11488 * t7193 - 0.1400e4 * t11498 * t7100 - 0.9800e4 * t11509 * t2987 - 0.2800e4 * t1150… in func_pol() [all …]
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H A D | mgga_x_scanl.c | 5533 double t2987, t3022, t3026, t3029, t3030, t3032, t3033, t3036; in func_ferr() local 7210 t2987 = t430 * t615; in func_ferr() 8579 …0841e0 * t2987 * t6733 + 0.11378729917768353994e1 * t1052 * t6704 + 0.16879116930178234168e1 * t88… in func_ferr() 9119 …734e0 * t12347 * t2299 - 0.56263723100594113894e0 * t2987 * t7878 - 0.28131861550297056947e0 * t29… in func_ferr() 9295 …t2987 * t9013 - 0.19594476351194912734e0 * t1052 * t9016 - 0.10979019874935515226e0 * t1879 * t460… in func_ferr() 9773 …t2987 * t10605 - 0.56263723100594113894e0 * t2987 * t10613 - 0.12968797032847508210e0 * t2803 * t1… in func_ferr() 9931 …t4041 * t4042 * t11439 - 0.56263723100594113893e0 * t2987 * t12020 - 0.56263723100594113893e0 * t2… in func_ferr() 10152 …t2987 * t13514 - 0.16879116930178234168e1 * t2987 * t13709 - 0.38906391098542524630e0 * t2803 * t1… in func_ferr() 10576 …* t1871 * t4489 * t349 + 0.21799717097663792993e0 * t2987 * t19335 - 0.16879116930178234168e1 * t2… in func_ferr() 10646 …t2987 * t20561 - 0.2766001889280e1 * t25246 * t102 + 0.41444833874132575653e0 * t4457 * t4560 + 0.… in func_ferr() [all …]
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H A D | mgga_xc_b98.c | 207 double t2976, t2977, t2979, t2981, t2983, t2985, t2987, t2988; in func_unpol() local 1866 t2988 = t2987 * t91; in func_unpol() 2648 t7462 = t75 * t2987; in func_unpol() 8852 t2987 = t399 * t919; in func_pol() 8853 t2988 = t398 * t2987; in func_pol() 12540 t9722 = t1053 * t2987; in func_pol() 13696 t11488 = t2465 * t2987; in func_pol() 14144 t12196 = t2762 * t2987; in func_pol() 14291 t12469 = t2972 * t2987; in func_pol() 18311 t32986 = t398 * t2987 * t370; in func_pol() [all …]
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H A D | mgga_x_rtpss.c | 139 double t2987, t2995, t3010, t3016, t3019, t3020, t3032, t3035; in func_unpol() local 1163 t2987 = t526 * t526; in func_unpol() 1179 …* t2154 * t698 - 0.73e2 / 0.97200e5 * t531 * t1054 + 0.584e3 / 0.2025e4 * t2987 - 0.73e2 / 0.48600… in func_unpol() 3030 double t2983, t2986, t2987, t2992, t3000, t3005, t3008, t3009; in func_pol() local 4756 t2987 = t2986 * t831; in func_pol() 4760 …t3008 = -t2979 * t212 * t91 - 0.4e1 / 0.9e1 * t2983 * t408 - 0.2e1 / 0.27e2 * t2987 * t1034 + 0.22… in func_pol() 5079 …t3735 = -t3711 * t212 * t91 - 0.2e1 / 0.9e1 * t3715 * t408 + t3718 * t586 / 0.6e1 + t2987 * t1268 … in func_pol() 6338 …62e3 * t1059 * t7449 + 0.22e2 / 0.9e1 * t2983 * t1011 + 0.22e2 / 0.27e2 * t2987 * t2461 - 0.308e3 … in func_pol() 6663 … 0.9e1 - 0.8e1 / 0.9e1 * t3718 * t1293 + 0.4e1 / 0.27e2 * t7507 * t3000 - t2987 * t2901 / 0.2e1 + … in func_pol()
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H A D | hyb_mgga_xc_wb97mv.c | 3756 t2987 = t725 * t123; in func_ferr() 7656 t2987 = t222 * t633; in func_pol() 7657 t2988 = t1037 * t2987; in func_pol() 7661 t2994 = t2608 * t2987; in func_pol() 8830 t5558 = t5557 * t2987; in func_pol() 10344 t9139 = t2782 * t2987; in func_pol() 10654 t10003 = t9756 * t2987; in func_pol() 10892 t10561 = t3784 * t2987; in func_pol() 11132 t11235 = t3667 * t2987; in func_pol() 11339 t11829 = t10901 * t2987; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_c_vwn_3.c | 904 double t2926, t2928, t2943, t2973, t2981, t2984, t2987, t2997; in func_pol() local 2488 t2987 = t2873 * t2149; in func_pol() 2492 …07821699796e2 * t2145 * t169 * t2987 + 0.18417913650658881038e3 * t2169 * t2981 - 0.47132838980624… in func_pol()
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H A D | lda_c_ml1.c | 395 double t2983, t2984, t2986, t2987, t2988, t2991, t2994, t2997; in func_pol() local 1934 t2987 = t148 * t2986; in func_pol() 1935 t2988 = t42 * t2987; in func_pol() 3425 t9004 = t431 * t2987; in func_pol() 4105 t12417 = t789 * t2987; in func_pol()
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