| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mn12.c | 199 double t6884, t6906, t6910, t6926, t6934, t6937, t6946, t6949; in func_unpol() local
1705 t6949 = t270 * tau[0]; in func_unpol()
1707 …* t6949 - 0.13120e5 / 0.9e1 * t871 * t6949 - 0.6560e4 / 0.27e2 * t838 * t6949 - 0.26240e5 / 0.27e2… in func_unpol()
1708 …00e5 / 0.27e2 * t879 * t6949 - 0.6560e4 / 0.9e1 * t851 * t6949 - 0.6560e4 / 0.9e1 * t857 * t6949 -… in func_unpol()
1710 …t6949 - 0.13120e5 / 0.9e1 * t987 * t6949 - 0.6560e4 / 0.27e2 * t960 * t6949 - 0.26240e5 / 0.27e2 *… in func_unpol()
1716 …t6949 - 0.6560e4 / 0.9e1 * t1037 * t6949 - 0.6560e4 / 0.9e1 * t1043 * t6949 - 0.6560e4 / 0.3e1 * t… in func_unpol()
1721 …t6949 - 0.6560e4 / 0.27e2 * t775 * t6949 - 0.26240e5 / 0.27e2 * t786 * t6949 - 0.6560e4 / 0.9e1 * … in func_unpol()
1724 …t6949 - 0.13120e5 / 0.9e1 * t1301 * t6949 - 0.6560e4 / 0.27e2 * t1274 * t6949 - 0.26240e5 / 0.27e2… in func_unpol()
3818 double t6935, t6936, t6938, t6940, t6942, t6945, t6947, t6949; in func_pol() local
6350 …t6949 = -t6408 - t6913 - t6916 / 0.2e1 - t6922 / 0.2e1 - t6926 / 0.2e1 + t6930 - t6933 / 0.2e1 - t… in func_pol()
[all …]
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| H A D | mgga_c_vsxc.c | 3440 double t6942, t6943, t6944, t6945, t6946, t6947, t6948, t6949; in func_pol() local
7786 t6949 = t2320 * t1424; in func_pol()
7787 t6950 = t1469 * t6949; in func_pol()
7788 t6952 = t1412 * t6949; in func_pol()
7790 t6959 = t1436 * t6949; in func_pol()
12010 … * t772 * t21962 + 0.16e2 * t2327 * t6956 + 0.18e2 * t3685 * t6949 + 0.36e2 * t3691 * t6949 + 0.36… in func_pol()
12115 …t22834 = 0.6e1 * t4593 * t6949 + 0.6e1 * t11362 * t2424 + 0.12e2 * t7012 * t4590 + 0.12e2 * t4624 … in func_pol()
12685 … + 0.256e3 * t3688 * t27892 + 0.640e3 * t3696 * t27892 + 0.24e2 * t7012 * t6949 - 0.128e3 * t7012 … in func_pol()
12701 …t27976 = -0.60e2 * t7351 * t27935 - 0.6e1 * t7305 * t27935 + 0.12e2 * t7474 * t6949 - 0.24e2 * t73… in func_pol()
12900 …4 - 0.48e2 * t3688 * t29114 - 0.120e3 * t3696 * t29114 + 0.12e2 * t7981 * t6949 + 0.24e2 * t7012 *… in func_pol()
[all …]
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| H A D | mgga_x_m08.c | 2871 double t6949, t6952, t6968, t6973, t6976, t6981, t6986, t6989; in func_pol() local
5378 t6949 = t147 * t81; in func_pol()
5379 …/ 0.27e2 * t428 * t6935 + 0.3575000e7 / 0.27e2 * t145 * t6899 + 0.550000e6 / 0.9e1 * t6949 * t6920; in func_pol()
5836 …t10151 = 0.157300e6 * t433 * t9811 - 0.110000e6 / 0.3e1 * t6949 * t9807 - 0.605000e6 / 0.3e1 * t31… in func_pol()
6235 …00e5 * t3158 * t11815 - 0.169400e6 / 0.3e1 * t1182 * t11788 + 0.22000e5 * t6949 * t11803 + 0.12100… in func_pol()
6831 …3190 - 0.23520e5 * t413 * t13234 - 0.8400e4 * t136 * t13240 - 0.13200e5 * t6949 * t13240 - 0.72600… in func_pol()
7520 …85 + 0.38880e5 * t1238 * t14074 + 0.28800e5 * t3256 * t14074 + 0.7920e4 * t6949 * t14074 + 0.1680e… in func_pol()
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| H A D | mgga_x_mggac.c | 385 double t6936, t6937, t6938, t6941, t6942, t6943, t6948, t6949; in func_unpol() local
4251 t6949 = t4237 * t6948; in func_unpol()
4262 …37 * t6938 / 0.8e1 + t628 * t6943 / 0.4e1 + t733 * t6943 / 0.8e1 - t738 * t6949 / 0.8e1 + t610 * t… in func_unpol()
8538 …1 * t1948 / 0.2e1 - 0.88e2 / 0.3e1 * t28705 * t4991 - t2800 * t6949 / 0.6e1 - t2837 * t6949 / 0.2e… in func_unpol()
24006 double t6943, t6944, t6945, t6946, t6947, t6948, t6949, t6950; in func_pol() local
32781 t6949 = t847 * t6948; in func_pol()
32782 t6950 = t6949 * t1587; in func_pol()
34587 t9243 = t6949 * t2180; in func_pol()
37631 t13312 = t6949 * t2979; in func_pol()
53136 ….4384e4 / 0.9e1 * t62949 * t62382 - t33521 * t2979 / 0.6e1 - t6949 * t13291 / 0.3e1 - t6949 * t132… in func_pol()
[all …]
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| H A D | mgga_x_mvs.c | 2111 double t6922, t6938, t6939, t6941, t6943, t6944, t6946, t6949; in func_pol() local
5207 t6949 = t81 * t2551; in func_pol()
5211 …41 / 0.27648e5 - t6944 / 0.864e3 - t6946 / 0.2e1 - t6868 / 0.3e1 - t856 * t6949 * t202 / 0.2e1 - t… in func_pol()
5233 …46 - t6868 / 0.2e1 - t856 * t6848 * t585 / 0.2e1 - 0.3e1 / 0.2e1 * t856 * t6949 * t219 - 0.3e1 / 0… in func_pol()
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| H A D | mgga_x_rscan.c | 375 double t6946, t6949, t6950, t6953, t6956, t6957, t6960, t6963; in func_unpol() local
3646 t6949 = t5538 * t171; in func_unpol()
3841 t7314 = t6949 * t1397; in func_unpol()
7384 double t6935, t6939, t6940, t6943, t6944, t6945, t6946, t6949; in func_ferr() local
10570 t6949 = t1480 * t6928; in func_ferr()
10571 t6950 = 0.191571209872680e3 * t6949; in func_ferr()
10680 t7194 = 0.383142419745360e3 * t6949; in func_ferr()
10777 t7411 = 0.574713629618040e3 * t6949; in func_ferr()
19476 t6949 = t2431 * t770; in func_pol()
19477 t6950 = t6949 * t847; in func_pol()
[all …]
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| H A D | mgga_x_rtpss.c | 3157 double t6918, t6921, t6941, t6945, t6949, t6950, t6960, t6966; in func_pol() local
6233 t6949 = t1162 * t829; in func_pol()
6234 t6950 = t6949 * t831; in func_pol()
7092 …* t519 / 0.4e1 + t8751 * t1149 / 0.12e2 - 0.2e1 / 0.3e1 * t4426 * t1174 - t6949 * t91 * t1541 / 0.… in func_pol()
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| H A D | mgga_x_vt84.c | 3522 double t6940, t6949, t6950, t6955, t6961, t6967, t6969, t6972; in func_ferr() local
5580 …t6949 = 0.27e2 / 0.40e2 * t432 * t266 * t1647 - 0.28935185185185185185e-2 * t6923 * t2450 + 0.1302… in func_ferr()
5581 t6950 = t6919 + t6949; in func_ferr()
6830 double t6918, t6936, t6937, t6938, t6942, t6949, t6954, t6955; in func_pol() local
10221 t6949 = t783 * t1725; in func_pol()
10231 …649327782546384408e0 * t1960 * t6793 + 0.30180600000000000000e-2 * t492 * t6949 + 0.10e2 / 0.81e2 … in func_pol()
12802 …0000000000000000e-3 * t2409 * t5175 + 0.60361200000000000000e-2 * t1683 * t6949 + 0.30180600000000… in func_pol()
13790 …t25580 = 0.60361200000000000000e-2 * t2409 * t6949 + 0.30180600000000000000e-2 * t492 * t25124 * t… in func_pol()
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| H A D | mgga_x_tpss.c | 3686 double t6928, t6931, t6934, t6938, t6949, t6959, t6980, t6983; in func_pol() local
6848 t6949 = t8 * t6228 * t2739; in func_pol()
6849 …2 - t8 * t357 * t238 * t6938 / 0.2e1 + t8 * t244 * t133 * t6938 / 0.2e1 + t6949 / 0.27e2 + t6367 -… in func_pol()
6871 …t6928 - 0.2e1 / 0.3e1 * t6931 + 0.4e1 / 0.27e2 * t6934 + 0.4e1 / 0.27e2 * t6949 - 0.5e1 / 0.9e1 * … in func_pol()
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| H A D | mgga_k_pc07.c | 265 double t6926, t6927, t6930, t6932, t6933, t6934, t6936, t6949; in func_unpol() local
2449 t6949 = t143 * t6344; in func_unpol()
2450 …1 * t6368 - 0.696991704e1 * t1416 * t6863 + 0.5389e0 * t6438 + 0.5389e0 * t6949 * t82 + 0.58082642… in func_unpol()
2471 …e2 * t1132 * t680 * t1133 - 0.97002e1 * t365 * t1303 * t684 + 0.16167e1 * t6949 * t87 + 0.776016e2… in func_unpol()
4185 double t6927, t6940, t6945, t6946, t6949, t6962, t6984, t6993; in func_ferr() local
6332 t6949 = t687 * t336; in func_ferr()
6335 …t6949 * t967 + 0.348495852e1 * t334 * t6748 * t461 + 0.174247926e1 * t334 * t1917 * t1033 + 0.1940… in func_ferr()
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| H A D | hyb_mgga_xc_wb97mv.c | 260 double t6924, t6927, t6931, t6934, t6937, t6946, t6949, t6965; in func_unpol() local
2277 t6949 = t979 * t9; in func_unpol()
2286 …t6987 = -0.20302848000000000000e-1 * t6949 * t3049 - 0.20302848000000000000e-1 * t2420 * t6924 + 0… in func_unpol()
2473 …000000e-2 * t6632 * t8163 - 0.94784256e-4 * t440 * t8150 + 0.2537856e-2 * t6949 * t3479 + 0.253785… in func_unpol()
4313 double t6947, t6949, t6950, t6957, t6962, t6967, t6971, t6975; in func_pol() local
9454 t6949 = 0.120e3 * t6947 * t342; in func_pol()
9457 …t6962 = t6934 + 0.36e2 * t6935 + t6938 - t6941 + t6944 - t6949 + 0.60e2 * t6950 + 0.30000000000000… in func_pol()
10607 … t5549 * t2602 + t6931 + t6934 - 0.24e2 * t6935 - t6938 + t9766 + t9767 - t6949 + 0.40e2 * t6950 -… in func_pol()
10969 …t10718 = t9766 - t9767 - t6949 + 0.20e2 * t6950 + 0.21687162600603479684e-1 * t9777 + 0.1554535000… in func_pol()
11840 …t13265 = t6934 - t6938 - t6941 - t6944 - t6949 + 0.32530743900905219526e-1 * t9777 - 0.17544670867… in func_pol()
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| H A D | mgga_x_revtm.c | 4854 double t6941, t6942, t6947, t6948, t6949, t6950, t6955, t6964; in func_pol() local
7902 t6949 = 0.37732934814814814815e0 * t6948; in func_pol()
7912 …1364 * t6936 + t6941 - 0.648e3 * t3891 * t6942 - 0.24e2 * t4962 * t2052 + t6949 - 0.33959641333333… in func_pol()
10018 …e-1 * t5761 * t5762 * t4863 + 0.75465869629629629630e0 * t15273 * t2078 + t6949 + t19455 * t457 / … in func_pol()
10779 …* t6798 * t564 + 0.3e1 * t2057 * t1886 + 0.3e1 / 0.10e2 * t19455 * t598 + t6949 + 0.3e1 / 0.10e2 *… in func_pol()
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| H A D | mgga_x_m11_l.c | 191 double t6949, t6958, t6980, t6981, t6985, t6986, t6988, t6997; in func_unpol() local
1635 t6949 = t6948 * t148; in func_unpol()
1636 …6942 * t6432 + 0.280000e6 / 0.3e1 * t6945 * t6432 + 0.2200000e7 / 0.9e1 * t6949 * t6432 - 0.16000e… in func_unpol()
1845 …* t6828 * t8304 - 0.4000e4 / 0.9e1 * t6808 * t8304 - 0.440000e6 / 0.3e1 * t6949 * t8304 - 0.242000… in func_unpol()
1935 …6000e5 * t6834 * t9881 + 0.572000e6 / 0.3e1 * t6748 * t9881 + 0.88000e5 * t6949 * t9881 + 0.484000… in func_unpol()
2002 …t11502 = -0.290400e6 * t6911 * t11038 - 0.52800e5 * t6949 * t11038 + 0.10800e5 * t1430 * t4990 + 0… in func_unpol()
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| H A D | mgga_c_scan.c | 3863 double t6949, t6950, t6953, t6954, t6957, t6960, t6961, t6968; in func_pol() local
8958 t6949 = t532 * t423; in func_pol()
8959 t6950 = t421 * t6949; in func_pol()
14768 t23372 = t6949 * t435; in func_pol()
14770 t23378 = t6949 * t405; in func_pol()
17686 …1480 - 0.43895747599451303157e1 * t8178 * t8850 + 0.13168724279835390947e2 * t8182 * t8599 * t6949; in func_pol()
17688 …2192 * t1821 * t596 * t6945 + 0.26337448559670781894e1 * t32214 * t1775 * t6949 + 0.26337448559670… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_lyp.c | 656 double t6930, t6933, t6937, t6942, t6944, t6949, t6952, t6955; in func_pol() local
2807 t6949 = 0.2e1 / 0.3e1 * t906 * t386 * t2862 * params->d; in func_pol()
2845 …+ 0.2e1 / 0.9e1 * t6933 + 0.2e1 / 0.9e1 * t6937 + t6942 + t6944 / 0.9e1 + t6949 + 0.2e1 / 0.9e1 * … in func_pol()
2919 …/ 0.9e1 * t6933 + 0.4e1 / 0.9e1 * t6937 + t6942 + 0.2e1 / 0.9e1 * t6944 + t6949 + 0.4e1 / 0.9e1 * … in func_pol()
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| H A D | gga_x_chachiyo.c | 1490 double t6937, t6942, t6944, t6945, t6949, t6952, t6958, t6959; in func_pol() local
4798 t6949 = t2152 / 0.4e1; in func_pol()
4802 …* t481 * t242 * t1169 / 0.12e2 + t6910 + t6945) - 0.3e1 / 0.2e1 * t2148 + t6949 - t2142 / 0.2e1 - … in func_pol()
4933 …t7549 = t6949 - t2545 - t7338 + t8 * (t7386 + t7440 + t7497 + t7538) + t7542 + t7543 - t7544 + t75… in func_pol()
5056 …v4rho3sigma[8] = -t2424 + t6949 - t2462 + t2454 - t2458 + t2450 - t2146 - t2320 / 0.2e1 - t2311 - … in func_pol()
5108 …- 0.3e1 / 0.2e1 * t2522 - t2525 / 0.2e1 - t2314 - 0.9e1 / 0.8e1 * t2543 + t6949 - 0.3e1 / 0.4e1 * … in func_pol()
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| H A D | gga_xc_th1.c | 647 double t6920, t6928, t6949, t6952, t6955, t6958, t6963, t6966; in func_pol() local
2387 …t6949 = -0.32e2 / 0.3e1 * t102 * t6906 + 0.4e1 / 0.3e1 * t102 * t6909 - 0.28e2 / 0.9e1 * t3040 * t… in func_pol()
2402 v4rho3sigma[11] = t6890 + t6920 + t6949 + t6981 + t7011 + t7039 + t7077 + t7110; in func_pol()
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| H A D | gga_x_gg99.c | 1871 double t6920, t6923, t6935, t6946, t6949, t6952, t6956, t6977; in func_ferr() local
3257 t6949 = t6923 * t589; in func_ferr()
3259 …3 * t379 * t2135 * t1627 + 0.5184e4 * t1646 * t6946 + 0.20736e5 * t3177 * t6949 - 0.60e2 * t379 * … in func_ferr()
3262 …977 + 0.8964e4 * t3190 * t2462 * t150 * t3161 * t143 - 0.1584e4 * t1638 * t6949 - 0.396e3 * t1634 … in func_ferr()
3794 double t6941, t6942, t6945, t6948, t6949, t6950, t6954, t6955; in func_pol() local
7643 t6949 = 0.1e1 / t6948; in func_pol()
7644 t6950 = t608 * t6949; in func_pol()
7668 …19e3 / 0.16e2 * t7049 * t1976 * t7031 + 0.945e3 / 0.16e2 * t7049 * t639 * t6949 * t6914 + 0.405e3 … in func_pol()
8392 …0.819e3 / 0.16e2 * t7049 * t1976 * t11564 + 0.945e3 / 0.16e2 * t7049 * t639 * t6949 * t411 * t1909; in func_pol()
9420 …0.16e2 * t1972 * t639 * t4911 * t1163 + 0.945e3 / 0.16e2 * t7049 * t639 * t6949 * t6026 * t198 + 0… in func_pol()
[all …]
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| H A D | gga_x_sfat_pbe.c | 3478 double t6948, t6949, t6952, t6955, t6958, t6959, t6961, t6967; in func_pol() local
6478 t6949 = t175 * t6948; in func_pol()
6485 …9414280e-3 * t5825 - 0.10510962269225784127e-1 * t5830 - 0.5e1 / 0.27e2 * t6949 - 0.25e2 / 0.6e1 *… in func_pol()
6541 …t7326 = -0.35036540897419280424e-2 * t5830 - 0.10e2 / 0.27e2 * t6949 - 0.41e2 / 0.9e1 * t6955 + 0.… in func_pol()
6587 …t7717 = -t7305 / 0.2e1 - 0.5e1 / 0.9e1 * t6949 + t6955 / 0.3e1 + t6959 - 0.5e1 / 0.9e1 * t6976 - t… in func_pol()
6619 …t7966 = -0.20e2 / 0.27e2 * t6949 - 0.20e2 / 0.27e2 * t6976 + 0.51996161330051579940e-5 * t2851 * t… in func_pol()
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| H A D | gga_x_ityh.c | 2673 double t6908, t6918, t6925, t6945, t6949, t6962, t6973, t6975; in func_pol() local
5101 t6949 = t971 * t968; in func_pol()
5106 …t7051 = -t1616 * t2583 * t6949 / 0.4e1 + t1616 * t107 * t356 * t2585 / 0.3e1 - t1616 * t317 * t124… in func_pol()
5107 …t6975 * t122 / 0.8e1 + t65 * t123 * t356 * t2542 * t122 / 0.9e1 + 0.6e1 * t6949 + t65 * t2626 * t3… in func_pol()
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| H A D | gga_c_sg4.c | 2913 double t6929, t6930, t6932, t6933, t6935, t6942, t6943, t6949; in func_pol() local
8100 t6949 = t538 * t1 * t182; in func_pol()
8101 t6950 = t5346 * t6949; in func_pol()
13244 t26103 = t1576 * t18186 * t6949; in func_pol()
14365 t28887 = t1576 * t20510 * t6949; in func_pol()
15624 t32773 = t1576 * t26234 * t6949; in func_pol()
15938 t33369 = t1576 * t27147 * t6949; in func_pol()
16046 t33532 = t19380 * t26886 * t6949; in func_pol()
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| H A D | gga_xc_b97.c | 1965 double t6942, t6943, t6944, t6945, t6946, t6947, t6948, t6949; in func_pol() local
5622 t6949 = 0.46635000000000000000e-1 * t6948; in func_pol()
5627 t6954 = -t6819 - t6823 - t6825 - t6827 - t6892 + t6896 - t6945 - t6947 - t6949 - t6951 - t6953; in func_pol()
8049 …t18865 = -t6945 - t6947 - t6949 - t6951 - t6953 - t6956 + t6958 + 0.96494049533612093922e2 * t6140… in func_pol()
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| H A D | gga_c_regtpss.c | 2607 double t6939, t6940, t6942, t6943, t6947, t6948, t6949, t6950; in func_pol() local
6532 t6949 = 0.10389515463408878255e3 * t6948; in func_pol()
6541 …t6975 = t6227 + t6231 + t6268 + t6271 + t6943 + t6947 - t6949 - t6951 - t6966 + t6969 - t6971 - t6… in func_pol()
6785 … * t1212 * t153 * t2036 * t258 - 0.6e1 * t90 * t96 * t7855 * t7858 + t6947 - t6949 - t6951 - t6966; in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 2148 double t6945, t6947, t6948, t6949, t6950, t6952, t6954, t6955; in func_pol() local
6171 t6949 = t680 * t953; in func_pol()
6172 t6950 = t13 * t6949; in func_pol()
10267 t20767 = t422 * t6949; in func_pol()
10763 t23611 = t907 * t6949; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_ml1.c | 531 double t6903, t6911, t6915, t6923, t6932, t6944, t6947, t6949; in func_pol() local
3021 …t6949 = 0.15246001711560793137e1 * t6233 + 0.30492003423121586274e1 * t6235 + 0.152460017115607931… in func_pol()
3195 …8 - 0.75052107786847379904e0 * t4234 - 0.25017369262282459968e0 * t4236 + t6949 - 0.22586669202312… in func_pol()
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