| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th2.c | 499 double t2981, t2984, t2986, t2987, t2990, t2993, t2996; in func_pol() local
1591 t2986 = 0.1e1 / t52 / t2984; in func_pol()
1592 t2987 = t39 * t2986; in func_pol()
1593 t2990 = t63 * t2986; in func_pol()
1594 t2993 = t67 * t2986; in func_pol()
1595 t2996 = t78 * t2986; in func_pol()
2273 …t2986 * t388 - 0.45331750000000000000e-1 * t2987 * t1003 + 0.41336156250000000000e-1 * t19 * t2986… in func_pol()
2303 …t2986 * t58 + 0.45331750000000000000e-1 * t2987 * t1115 - 0.45331750000000000000e-1 * t2987 * t114… 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
2372 t2986 = 0.41265423489928160423e-2 * t2785; in func_pol()
2375 …t3000 = t2984 + t2985 - t2986 + t2987 + t2909 - t2988 + 0.40577272137482127086e0 * t2802 - 0.58636… in func_pol()
2445 …t3148 = t2984 + t2985 - t2986 + t3144 - 0.29318287288448777611e-1 * t3024 - 0.84535983619754431428… in func_pol()
2486 …t3238 = t2984 + t2985 - t2986 + 0.40577272137482127086e0 * t3021 - 0.58636574576897555222e-1 * t30… in func_pol()
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| H A D | gga_c_wl.c | 497 double t2982, t2983, t2984, t2985, t2986, t2988, t2989, t2991; in func_pol() local
1958 t2986 = t731 * t2985; in func_pol()
1967 …2974 - t2976 + t2978 + t2980 + t2982 - t2984 - 0.22500000000000000000e0 * t2986 + 0.90000000000000… in func_pol()
2047 …t3314 = t3278 - t2356 - 0.67500000000000000000e0 * t2986 + 0.27000000000000000000e1 * t2989 + t328… in func_pol()
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| H A D | gga_x_hjs_b88_v2.c | 3317 double t2984, t2985, t2986, t2989, t2990, t2993, t2996, t3001; in func_ferr() local
4570 t2986 = t2984 * t2985; in func_ferr()
4589 …t2986 + 0.5e1 / 0.27e2 * t2401 * t2986 - 0.20e2 / 0.9e1 * t2410 * t2986 - 0.5e1 / 0.3e1 * t2413 * … in func_ferr()
4590 …t2986 - 0.35e2 / 0.36e2 * t1221 * t3033 + 0.35e2 / 0.36e2 * t1221 * t3036 - 0.4e1 / 0.9e1 * t2377 … in func_ferr()
4591 …e2 + t2421 * t2981 / 0.9e1 - 0.2e1 / 0.27e2 * t2421 * t2986 + t2366 * t2981 / 0.3e1 - t2366 * t298… in func_ferr()
4604 …t2163 * t2986 + 0.7e1 / 0.27e2 * t2259 * t2986 - 0.56e2 / 0.9e1 * t2167 * t2986 - 0.28e2 / 0.9e1 *… in func_ferr()
4605 …t2986 + t2200 * t2981 / 0.3e1 - t2200 * t2986 / 0.3e1 + t2219 * t2976 / 0.18e2 - t2219 * t2981 / 0… in func_ferr()
4606 …t2986 - 0.4e1 / 0.27e2 * t2175 * t2976 + 0.35e2 / 0.9e1 * t2160 * t2986 + 0.10e2 / 0.9e1 * t2243 *… in func_ferr()
4612 …t2986 - 0.5e1 / 0.6e1 * t1251 * t3036 - 0.35e2 / 0.6e1 * t1256 * t3036 - 0.35e2 / 0.36e2 * t1299 *… in func_ferr()
4695 …t2986 - 0.21677523290591153690e-1 * t1480 * t3033 + 0.21677523290591153690e-1 * t1480 * t3036 + 0.… in func_ferr()
[all …]
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| H A D | gga_k_thakkar.c | 808 double t2929, t2931, t2932, t2936, t2956, t2959, t2986, t2992; in func_pol() local
1930 t2986 = t478 * t478; in func_pol()
1931 … t37 + 0.29333333333333333334e-1 * t101 * t1306 + 0.220e-1 * t24 * t272 * t2986 - 0.53777777777777… in func_pol()
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| H A D | gga_c_p86.c | 966 double t2974, t2975, t2979, t2980, t2981, t2984, t2985, t2986; in func_pol() local
2409 t2986 = t503 * t173; in func_pol()
2410 t2987 = t2986 * t512; in func_pol()
2519 t3168 = t2986 * t536; in func_pol()
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| H A D | gga_c_zvpbeloc.c | 2126 double t2970, t2972, t2974, t2979, t2981, t2982, t2985, t2986; in func_pol() local
4501 t2986 = t118 * t2985; in func_pol()
4508 …+ 0.33333333333333333332e-2 * t1954 - t1959 - 0.19999999999999999999e-1 * t2986 * t2988 + 0.777777… in func_pol()
4665 …+ t1914 - 0.11666666666666666666e-1 * t3425 - 0.19999999999999999999e-1 * t2986 * t3429 + 0.999999… in func_pol()
6552 … * t7728 + 0.11111111111111111111e-2 * t7734 - 0.11999999999999999999e0 * t2986 * t134 * t126 * t6… in func_pol()
6790 …* t8679 - 0.69999999999999999996e-1 * t8681 - 0.59999999999999999997e-1 * t2986 * t134 * t2954 * t… in func_pol()
6803 …* t1907 - 0.74999999999999999997e-2 * t8732 - 0.59999999999999999997e-1 * t2986 * t8734 * t8735 - … in func_pol()
6945 … * t123 * t30 * t8544 / 0.48e2 + 0.7e1 / 0.48e2 * t9318 - 0.3e1 / 0.4e1 * t2986 * t134 * t8735 + t… in func_pol()
7375 …e1 / 0.384e3 * t11924 - t11927 * t370 / 0.768e3 + t9039 - 0.3e1 / 0.4e1 * t2986 * t134 * t11930 + … in func_pol()
7404 …995e-1 * t8672 * t134 * t126 * t3890 * t297 - 0.59999999999999999997e-1 * t2986 * t134 * t3427 * t… in func_pol()
[all …]
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| H A D | gga_x_ft97.c | 1079 double t2921, t2923, t2926, t2933, t2941, t2960, t2982, t2986; in func_pol() local
2344 t2986 = t445 * t445; in func_pol()
2348 …t3034 = -t7 * t369 * t515 * t450 - t7 * t283 * t47 * t2986 / 0.2e1 - 0.5e1 / 0.27e2 * t7 * t2095 *… in func_pol()
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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
3004 t2986 = t452 * t938 * t497; in func_pol()
3005 t2987 = t2986 / 0.9e1; in func_pol()
3083 …359 * t199 / 0.3e1 - t452 * t198 * t557 * t462 / 0.6e1 + 0.4e1 / 0.27e2 * t2986 - 0.2e1 / 0.9e1 * … in func_pol()
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| H A D | gga_x_chachiyo.c | 1379 double t2983, t2984, t2986, t2987, t2988, t2989, t2990, t2992; in func_pol() local
3872 t2986 = t589 * t2888 * t590; in func_pol()
3873 t2987 = t587 * t2986; in func_pol()
5336 t9728 = t1534 * t2986; in func_pol()
5414 …9703 / 0.108e3 + t9705 / 0.81e2 - 0.4e1 / 0.27e2 * t9774 * t584 + t1752 * t2986 / 0.81e2 + t562 * … in func_pol()
5582 …3155 / 0.432e3 - t8211 * t865 / 0.72e2 - t2357 * t3000 / 0.24e2 + t2588 * t2986 / 0.54e2 + t491 * … in func_pol()
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| H A D | gga_c_gapc.c | 1859 t2986 = t2985 * t94; in func_unpol()
1860 t2987 = t35 * t2986; in func_unpol()
5959 t2986 = t2963 * t262; in func_ferr()
11681 t2986 = t383 * t2985; in func_pol()
11687 t2992 = t2986 * t2991; in func_pol()
14262 t8896 = t2986 * t8895; in func_pol()
14266 t8901 = t2986 * t8900; in func_pol()
14361 t9044 = t2986 * t9043; in func_pol()
19106 t27287 = t2986 * t8893 * t638 * t9042; in func_pol()
19180 t27467 = t2986 * t26521 * t2990; in func_pol()
[all …]
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| H A D | gga_x_sogga11.c | 1476 double t2964, t2980, t2985, t2986, t2999, t3004, t3007, t3010; in func_pol() local
2794 …t2986 = -t7 * t116 * t70 * t2919 / 0.2e1 - 0.2e1 * t7 * t116 * t1313 * t121 - 0.3e1 * t7 * t116 * … in func_pol()
2795 …t2999 = t9 * (t2914 + t2986) + 0.4e1 / 0.9e1 * t1034 - 0.2e1 / 0.3e1 * t1038 - 0.2e1 * t1042 + 0.4… in func_pol()
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| H A D | gga_c_gaploc.c | 9686 t2986 = t263 * t2912; in func_pol()
9983 t3441 = 0.10725146985555128001e1 * t2986 * t3439; in func_pol()
13441 t11166 = 0.10725146985555128001e1 * t2986 * t10261; in func_pol()
13470 t11207 = 0.71500979903700853340e0 * t2986 * t11205; in func_pol()
14564 t13339 = 0.10725146985555128001e1 * t2986 * t13337; in func_pol()
19348 t35854 = 0.23833659967900284447e0 * t2986 * t16688 * t891; in func_pol()
19424 t36030 = 0.14300195980740170668e1 * t2986 * t31503; in func_pol()
19425 t36032 = 0.10725146985555128001e1 * t2986 * t32243; in func_pol()
21438 t44667 = 0.71500979903700853340e0 * t2986 * t4907 * t3224; in func_pol()
21574 t45005 = 0.10725146985555128001e1 * t2986 * t1364 * t9877; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mbrxh_bg.c | 16146 t2986 = t2951 * t778; in func_pol()
16147 t2987 = t2986 * t799; in func_pol()
16170 t3031 = t2986 * t816; in func_pol()
16279 t3191 = t2986 * t711; in func_pol()
16301 t3213 = t2986 * t89; in func_pol()
17225 t4376 = t2986 * t4337; in func_pol()
17451 t4655 = t2986 * t4654; in func_pol()
18894 t6498 = t2986 * t6497; in func_pol()
19172 t6816 = t2986 * t6815; in func_pol()
20051 t7807 = t2986 * t7796; in func_pol()
[all …]
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| H A D | mgga_c_revscan.c | 2133 double t2961, t2971, t2975, t2978, t2981, t2986, t2987, t2991; in func_ferr() local
3410 t2986 = t571 * t107; in func_ferr()
3499 t3901 = t2986 * t111; in func_ferr()
3936 double t2977, t2980, t2981, t2984, t2985, t2986, t2990, t2991; in func_pol() local
7695 t2986 = t795 * t778; in func_pol()
11842 …(t204, t2984 * t528 * t210 + t10813 * t210 + t10817 * t210 + t10819 * t210 + t2986 * t529, t10860); in func_pol()
11917 …ewise3(t204, t11020 * t210 + t11022 * t210 + t11024 * t210 + t11026 * t210 + t2986 * t679, t11056); in func_pol()
21052 … 0.2e1 * t10817 * t529 + t795 * t8507 * t210 + 0.2e1 * t10819 * t529 + t2986 * t886 + t2986 * t888; in func_pol()
21261 ….2e1 * t11024 * t679 + t795 * t9218 * t210 + 0.2e1 * t11026 * t679 + t2986 * t2040 + t2986 * t2042; in func_pol()
24191 t49588 = t2986 * t2780; in func_pol()
[all …]
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| H A D | mgga_x_revtm.c | 144 double t2983, t2986, t2989, t2990, t2991, t2992, t2995, t3000; in func_unpol() local
1276 t2986 = t901 * t226; in func_unpol()
1280 …3 * t1955 * t915 + 0.108e3 * t1971 * t915 + 0.108e3 * t545 * t2983 - 0.24e2 * t553 * t2986 - t2991; in func_unpol()
1296 t3051 = t3044 + 0.4e1 * t3045 + t799 + 0.18e2 * t3047 + 0.36e2 * t2986 + t3050 + t803; in func_unpol()
1328 …t3163 = 0.648e3 * t1227 * t2995 + 0.24e2 * t133 * t2986 + 0.12e2 * t133 * t3047 - 0.108e3 * t1374 … in func_unpol()
1949 …439615e-4 * t129 * t3168 - 0.6e1 * t133 * t5585 * t299 - 0.24e2 * t1360 * t2986 - 0.12e2 * t539 * … in func_unpol()
2136 … t690 * t2913 - 0.27e2 / 0.100e3 * t457 * t3127 * t288 - 0.72e2 * t1968 * t2986 + 0.324e3 * t1971 … in func_unpol()
2192 …271 - 0.216e3 * t1374 * t3274 - 0.108e3 * t1700 * t2973 + 0.48e2 * t690 * t2986 + 0.24e2 * t690 * … in func_unpol()
2433 double t2974, t2975, t2981, t2986, t2995, t2998, t3012, t3013; in func_ferr() local
3550 t2986 = t331 * t836; in func_ferr()
[all …]
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| H A D | mgga_x_tpss.c | 150 double t2986, t2989, t3000, t3003, t3006, t3013, t3019, t3025; in func_unpol() local
1275 t2986 = t584 * t460; in func_unpol()
1292 …t2980 - 0.73e2 / 0.86400e5 * t1102 * t1191 * t205 + 0.73e2 / 0.129600e6 * t2986 * t462 - 0.73e2 / … in func_unpol()
1427 t4341 = t2986 * t25; in func_unpol()
1500 ….129600e6 * t3611 * t594 - 0.73e2 / 0.86400e5 * t3107 * t1685 + 0.73e2 / 0.129600e6 * t2986 * t782; in func_unpol()
1570 …3 * t594 - 0.219e3 / 0.800e3 * t1521 * t949 * t594 + 0.1971e4 / 0.100e3 * t2986 * t914 + 0.1971e4 … in func_unpol()
3551 double t2964, t2965, t2969, t2975, t2976, t2981, t2986, t2989; in func_pol() local
5294 t2986 = t1223 * t330; in func_pol()
5296 …t842 + 0.73e2 / 0.194400e6 * t2170 * t1216 + 0.73e2 / 0.194400e6 * t841 * t2986 + 0.73e2 / 0.38880… in func_pol()
7567 …t11166 = 0.73e2 / 0.194400e6 * t8981 * t1216 + 0.73e2 / 0.194400e6 * t3469 * t2986 + 0.73e2 / 0.38… in func_pol()
[all …]
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| H A D | mgga_x_rlda.c | 1002 double t2986, t3015, t3019, t3023, t3029, t3032, t3037, t3038; in func_pol() local
2816 t2986 = t959 * t1190; in func_pol()
2818 …6 - t963 * t234 * t463 * t282 / 0.6e1 + t973 * t383 * t463 * t9 / 0.2e1 - t2986 / 0.2e1 - t145 * t… in func_pol()
2832 …v4rho2lapl2[8] = -t2948 - 0.4e1 / 0.3e1 * t2976 - t2986 - t145 * t279 * t463 * t316 / 0.6e1 - t145… in func_pol()
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| H A D | mgga_x_edmgga.c | 126 double t2975, t2986, t2998, t3004, t3023, t3027, t3041, t3068; in func_unpol() local
1071 …t2986 = 0.28930285349106288954e-2 * t2952 - 0.19457459907876453380e-2 * t2956 + 0.3603233316273417… in func_unpol()
1072 …250 + 0.16615495624729559964e1 * t106 * t57 * t2986 * t118 + 0.70819478890314631335e-1 * t50 * t10… in func_unpol()
1076 …t3041 = -0.18e2 * t1228 * t3023 * t277 + t19 * t2986 * t67 + 0.24e2 * t48 * t3027 * t722 - 0.3e1 *… in func_unpol()
3434 double t2944, t2947, t2963, t2977, t2978, t2981, t2985, t2986; in func_pol() local
5078 t2986 = t174 * t156; in func_pol()
5079 …4238e2 * t490 * t722 * t2981 + 0.10488523547622316684e3 * t1618 * t2985 * t2986 - 0.76217237139506… in func_pol()
5360 …4238e2 * t490 * t839 * t3628 + 0.10488523547622316684e3 * t1618 * t3632 * t2986 - 0.76217237139506… in func_pol()
5502 …4238e2 * t490 * t941 * t4030 + 0.10488523547622316684e3 * t1618 * t4034 * t2986 - 0.76217237139506… in func_pol()
7417 t13148 = t2727 * t2986; in func_pol()
[all …]
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| H A D | mgga_x_gvt4.c | 1367 double t2953, t2956, t2957, t2970, t2982, t2985, t2986, t2999; in func_pol() local
3146 t2986 = t399 * t1237; in func_pol()
3150 …0.9e1 * t2931 - t2934 + 0.16e2 / 0.27e2 * t2982 + t2985 + 0.4e1 / 0.9e1 * t2986 - 0.8e1 / 0.27e2 *… in func_pol()
3165 …v4rho3sigma[8] = 0.32e2 / 0.27e2 * t2982 + t2985 - 0.32e2 / 0.9e1 * t2986 + 0.16e2 / 0.27e2 * t292… in func_pol()
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| H A D | mgga_x_mbeef.c | 16627 t2986 = t1260 * t2985; in func_ferr()
16628 t2987 = t1257 * t2986; in func_ferr()
16639 t3012 = t1275 * t2986; in func_ferr()
16647 t3031 = t1343 * t2986; in func_ferr()
16661 t3083 = t1292 * t2986; in func_ferr()
16667 t3096 = t1326 * t2986; in func_ferr()
16679 t3176 = t1576 * t2986; in func_ferr()
16683 t3183 = t1405 * t2986; in func_ferr()
32263 t2986 = t2985 * t94; in func_pol()
33290 t7287 = t2986 * t7282; in func_pol()
[all …]
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| H A D | mgga_c_vsxc.c | 3201 double t2982, t2983, t2985, t2986, t2988, t2989, t2990, t2992; in func_pol() local
5821 t2986 = t766 * t852; in func_pol()
5822 t2988 = 0.19431687500000000000e-2 * t247 * t2986; in func_pol()
9166 t9216 = t527 * t2986; in func_pol()
9168 t9218 = t529 * t2986; in func_pol()
9314 t9437 = t698 * t2986; in func_pol()
9316 t9439 = t700 * t2986; in func_pol()
12895 …t1040 * t2986 - 0.38863375000000000000e-2 * t1042 * t2986 - 0.38863375000000000000e-2 * t527 * t92… in func_pol()
12980 …t1787 * t2986 - 0.19431687500000000000e-2 * t698 * t9223 - 0.19431687500000000000e-2 * t1789 * t29… in func_pol()
13050 …1687500000000000e-2 * t2017 * t2986 - 0.38863375000000000000e-2 * t2020 * t2986 - 0.19431687500000… in func_pol()
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| H A D | mgga_x_mn12.c | 3698 double t2964, t2983, t2986, t2988, t2989, t2990, t2994, t2995; in func_pol() local
5267 …t2986 = t2487 * t348 + t2509 * t365 + 0.32e-4 * t709 * t2512 + 0.24e-1 * t717 * t2515 + 0.8e-2 * t… in func_pol()
5268 t2988 = t8 * t221 * t2986; in func_pol()
6328 t6907 = t8 * t686 * t2986; in func_pol()
6348 t6945 = t2986 * t681; in func_pol()
6408 t7041 = t2986 * t761; in func_pol()
8311 t15924 = t8 * t2059 * t2986; in func_pol()
8375 …0.9e1 * t15714 - t8 * t680 * t6881 * t681 - t16522 / 0.3e1 - t8 * t2041 * t2986 * t2042 / 0.6e1 - … in func_pol()
8437 …t17160 = t15868 / 0.4e1 + t14652 - t2245 * t17 * t2986 * t2247 / 0.2e1 - 0.3e1 / 0.2e1 * t8 * t373… in func_pol()
8467 …8 * t680 * t1033 * t6935 + t14746 + t14757 + 0.3e1 / 0.2e1 * t8 * t2258 * t2986 * t9 + t15924 / 0.… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pmgb06.c | 4012 t2986 = 0.6e1 * t376 - 0.6e1 * t2701; in func_pol()
4016 t2996 = -t2986; in func_pol()
4238 t3370 = t145 * t2986; in func_pol()
4267 t3412 = t434 * t2986; in func_pol()
4409 t3667 = t146 * t2986; in func_pol()
6562 t8251 = t3407 * t2986; in func_pol()
6612 t8373 = t3398 * t2986; in func_pol()
6725 t8615 = t445 * t2986 * t458; in func_pol()
7851 t11400 = t1772 * t2986; in func_pol()
7892 t11512 = t1876 * t2986; in func_pol()
[all …]
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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
1933 t2986 = t131 * t856; in func_pol()
1934 t2987 = t148 * t2986; in func_pol()
3239 t8134 = t42 * t391 * t2986; in func_pol()
3879 t11631 = t42 * t739 * t2986; in func_pol()
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