| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th3.c | 649 double t6114, t6123, t6127, t6129, t6148, t6179, t6185, t6212; in func_pol() local
2335 …t6129 = 0.160e3 / 0.27e2 * t6123 + 0.80e2 / 0.3e1 * t2147 * t4092 + 0.16e2 / 0.3e1 * t6127 + t4665; in func_pol()
2336 … 0.5e1 * t340 * t2658 + t117 * t6129 + 0.11e2 / 0.2e1 * t282 * t2658 + t131 * t6129 + 0.6e1 * t302… in func_pol()
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| H A D | gga_c_zpbeint.c | 2117 double t6092, t6095, t6097, t6110, t6123, t6125, t6126, t6129; in func_pol() local
6114 t6129 = 0.19263893255070628431e1 * t6126 * t1779 * t1658; in func_pol()
6115 …36 + t6038 - t6072 + t6076 - t6078 - t6081 - t6083 + t6087 + t6090 - t6092 - t6095 + t6125 + t6129; in func_pol()
6286 …36 + t6038 - t6072 + t6076 - t6078 - t6081 - t6083 + t6087 + t6090 - t6092 - t6095 + t6125 + t6129; in func_pol()
6520 …t7611 = -t6072 + t6076 - t7601 - t7602 - t7603 - t6087 + t6090 - t7604 - t6095 + t6129 + t7606 + t… in func_pol()
6641 …+ 0.36e2 * t2480 * t2539 * t734 - 0.9e1 * t2364 * t2424 + t6090 - t6095 + t6129 - t6140 + t6144 - … in func_pol()
6787 … 0.12e2 * t2415 * t2565 + 0.4e1 * t2559 * t2569 + 0.24e2 * t8345 * t910 + t6129 - t6140 + t6144 - … in func_pol()
6936 …t9496 = t6076 - t8607 - t8608 + t6087 - t8620 + t6090 - t8621 - t6095 + t8623 - t8625 + t6129 + t8… in func_pol()
7099 …2 * t10448 * t1459 * t2942 + t10440 + t10441 + t10442 + t10447 - t10452 + t6129 - t6140 + t6144 - … in func_pol()
7144 …t10716 = -t10431 + t6090 - t10432 - t6095 - t10433 + t6129 + t10440 + t10441 + t10442 + t10447 - t… in func_pol()
[all …]
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| H A D | gga_c_op_pbe.c | 903 double t6113, t6123, t6127, t6129, t6131, t6133, t6135, t6137; in func_pol() local
3320 t6129 = t6127 * t1705 * t5908; in func_pol()
3323 … - 0.59440451743181588832e-3 * t5852 * t199 + 0.71328542091817906596e-2 * t6129 + 0.35664271045908… in func_pol()
3557 …* t6720 - 0.11888090348636317766e-2 * t6123 + 0.47552361394545271064e-2 * t6129 + 0.23776180697272… in func_pol()
3733 …* t8281 - 0.71328542091817906596e-2 * t8283 + 0.23776180697272635532e-2 * t6129 + 0.11888090348636… in func_pol()
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| H A D | gga_x_beefvdw.c | 1788 double t6074, t6086, t6103, t6111, t6120, t6129, t6180, t6191; in func_pol() local
3623 t6129 = t2645 * t2961; in func_pol()
3625 …0 - t2649 * t2667 * t2021 / 0.6e1 - t397 * t1134 * t546 * t2030 / 0.2e1 - t6129 / 0.2e1 - t397 * t… in func_pol()
3656 …v4rho3sigma[11] = -0.3e1 / 0.2e1 * t6129 - 0.3e1 / 0.2e1 * t397 * t1134 * t1283 * t828 - 0.3e1 / 0… in func_pol()
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| H A D | gga_x_q2d.c | 1212 double t6119, t6125, t6128, t6129, t6142, t6146, t6148, t6150; in func_pol() local
3493 …t6129 = t2175 + t5972 - t2167 - t2110 - t5974 - t2253 - t2171 + t2180 + t2183 - t2196 - t2204 + t2… in func_pol()
3495 v4rho2sigma2[6] = t6128 + t6129; in func_pol()
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| H A D | gga_c_op_b88.c | 892 double t6096, t6106, t6109, t6111, t6115, t6119, t6129, t6133; in func_pol() local
3189 t6129 = t101 * t1808 * t130; in func_pol()
3194 …8533374539200000000e2 * t638 * t6115 + 0.12556049612288400000e4 * t1861 * t6129 + 0.41853498707628… in func_pol()
3210 …79809865554182400000e2 * t638 * t6136 + 0.14266687269600000000e2 * t638 * t6129 + 0.71333436348000… in func_pol()
3211 …83706997415256000000e3 * t630 * t6224 + 0.29928699582818400000e3 * t630 * t6129 + 0.11971479833127… in func_pol()
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| H A D | gga_xc_b97.c | 1921 double t6093, t6096, t6114, t6115, t6122, t6125, t6128, t6129; in func_pol() local
5267 t6129 = t6128 * t341; in func_pol()
5290 …7870697974e2 * t5612 - 0.20000000000000000000e1 * t5614 + 0.2e1 * t5616 + t6129 - 0.10000000000000… in func_pol()
7789 …t16565 = 0.4e1 * t5616 + 0.2e1 * t6129 - 0.20000000000000000000e1 * t6130 - 0.20000000000000000000… in func_pol()
8048 …5612 - 0.60000000000000000000e1 * t5614 + t6896 + 0.6e1 * t5616 + 0.3e1 * t6129 - 0.30000000000000… in func_pol()
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| H A D | gga_c_pw91.c | 2129 double t6122, t6127, t6128, t6129, t6131, t6135, t6136, t6137; in func_pol() local
5846 t6129 = t6128 * t154; in func_pol()
5851 …6690870060394415081e2 * t97 * t4750 * t1842 - 0.38340341808208067710e-1 * t6129 - 0.16690870060394… in func_pol()
5881 t6185 = 0.51120455744277423614e-1 * t6129; in func_pol()
5902 … * t6218 + 0.10224091148855484723e0 * t6192 - 0.51120455744277423612e-1 * t6129 + 0.10224091148855… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 3459 double t6101, t6103, t6109, t6117, t6121, t6128, t6129, t6132; in func_pol() local
6328 t6129 = t6128 * t230; in func_pol()
6329 …* t719 + 0.35328867003455604812e0 * t2350 * t2469 * t719 + 0.13131351713559652880e0 * t6129 * t737; in func_pol()
6411 …t6636 = 0.20314088317058446697e0 * t6129 * t741 - 0.77318820731006598879e-1 * t6080 * t741 + 0.846… in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 2107 double t6129, t6130, t6132, t6134, t6135, t6136, t6138, t6139; in func_pol() local
5837 t6129 = 0.60e2 * t2329 * t838; in func_pol()
5850 …t6148 = 0.12e2 * t6122 - 0.12e2 * t6124 + 0.24e2 * t6126 + t6129 - 0.96e2 * t6130 + 0.60e2 * t6132… in func_pol()
6061 …0000e1 * t5683 * t3100 - 0.16e2 * t6117 - 0.4e1 * t6122 - 0.4e1 * t6124 + t6129 + 0.40e2 * t6132 -… in func_pol()
6913 ….20000000000000000000e1 * t7887 * t3021 - 0.8e1 * t6117 - 0.8e1 * t6126 + t6129 + 0.32e2 * t6130 +… in func_pol()
7673 …t10655 = t5923 - t5926 + 0.32530742648344572643e-1 * t6507 + t6129 + t6135 + t6138 - t6141 - t6147… in func_pol()
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| H A D | gga_c_gaploc.c | 3286 double t6079, t6081, t6088, t6109, t6114, t6120, t6125, t6129; in func_ferr() local
5442 …t6129 = -0.68165201695859110534e0 * t434 * t1056 * t1057 * t1941 + 0.11122374651686799408e1 * t249… in func_ferr()
5580 …+ t4507 + t6340 + t4969 + t6559 + t5874 + t6217 + t6389 + t6722 + t5829 + t6129 + t6180 + t5666) -… in func_ferr()
6377 double t6117, t6120, t6121, t6126, t6129, t6130, t6133, t6134; in func_pol() local
11027 t6129 = t718 * t1865; in func_pol()
11028 t6130 = t6129 * t724; in func_pol()
15729 …1 + 0.85801175884441024008e1 * t6130 * t5789 + 0.85801175884441024008e1 * t6129 * t729 * t5793 - 0… in func_pol()
15823 t18501 = t6129 * t746; in func_pol()
15830 t18568 = t6129 * t98 * t739; in func_pol()
16572 …03453343411469884e2 * t1943 * t1353 * t23300 + 0.21450293971110256002e1 * t6129 * t897 * t5793 + 0… in func_pol()
[all …]
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| H A D | gga_c_zvpbeint.c | 2557 double t6117, t6118, t6122, t6125, t6126, t6127, t6129, t6130; in func_pol() local
6897 t6129 = t1996 * t1 * t259; in func_pol()
6898 t6130 = 0.73245789224026180216e-3 * t6129; in func_pol()
7463 t8033 = 0.18311447306006545054e-3 * t6129; in func_pol()
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 390 t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & local
2646 t6129 = 0.8333333335e-1_dp*t429*t437*t5174
2656 - t6123 + t6126 - t6129 + t6132 - t6136 - 0.1666666667e0_dp*t6138 &
2779 + t6119 - t6123 + t6126 - t6129
3169 t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & local
5422 t6129 = 0.8333333335e-1_dp*t429*t437*t5174
5432 - t6123 + t6126 - t6129 + t6132 - t6136 - 0.1666666667e0_dp*t6138 &
5555 + t6119 - t6123 + t6126 - t6129
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| /dports/science/cp2k-data/cp2k-7.1.0/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 390 t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & local
2646 t6129 = 0.8333333335e-1_dp*t429*t437*t5174
2656 - t6123 + t6126 - t6129 + t6132 - t6136 - 0.1666666667e0_dp*t6138 &
2779 + t6119 - t6123 + t6126 - t6129
3169 t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & local
5422 t6129 = 0.8333333335e-1_dp*t429*t437*t5174
5432 - t6123 + t6126 - t6129 + t6132 - t6136 - 0.1666666667e0_dp*t6138 &
5555 + t6119 - t6123 + t6126 - t6129
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_m05.c | 3277 double t6124, t6126, t6127, t6129, t6130, t6132, t6133, t6135; in func_pol() local
7398 t6129 = t1823 * t730; in func_pol()
7399 t6130 = t6129 * t743; in func_pol()
7594 t6439 = t6129 * t735; in func_pol()
8912 t8733 = t6129 * t934; in func_pol()
8922 t8753 = t6129 * t928; in func_pol()
12358 …t25716 = -0.51817833333333333334e-1 * t6129 * t2687 - 0.51817833333333333334e-1 * t6063 * t2687 - … in func_pol()
12635 …6106 * t2844 + 0.82908533333333333334e0 * t6109 * t2844 - 0.33163413333333333334e1 * t6129 * t2853; in func_pol()
12639 … - 0.77726750000000000000e-2 * t1891 * t8676 + 0.82908533333333333334e0 * t6129 * t2844 - 0.331634… in func_pol()
13218 …000e-1 * t6129 * t3085 + 0.99490240000000000000e0 * t6109 * t3096 + 0.13265365333333333333e2 * t17… in func_pol()
[all …]
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| H A D | mgga_x_task.c | 3297 double t6129, t6130, t6134, t6146, t6152, t6165, t6166, t6168; in func_pol() local
6286 t6129 = 0.5e1 / 0.9e1 * t2082; in func_pol()
6288 …* t2060 + t2063 - 0.3e1 / 0.2e1 * t2066 - 0.2e1 * t2069 - 0.2e1 * t2078 - t6129 - t6130 - 0.2e1 * … in func_pol()
6331 …t6341 = -t2061 + 0.3e1 / 0.4e1 * t2063 - 0.3e1 / 0.4e1 * t2066 - t6129 - t6130 + t10 * (t6211 + t6… in func_pol()
6340 …t6368 = t2063 / 0.2e1 - t2066 / 0.4e1 - t6129 - t6130 + 0.2e1 * t2274 - t2279 - t2283 - t2287 / 0.… in func_pol()
6373 …t6614 = t2064 - t6129 - t6130 - t2568 - t2574 - t2579 - t2583 - t2587 + t2597 + t2607 + 0.3e1 * t2… in func_pol()
6440 …- 0.4e1 * t2308 - 0.2e1 / 0.3e1 * t2311 + 0.4e1 / 0.3e1 * t2166 + t2214 - t6129 - t6130 + 0.4e1 / … in func_pol()
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| H A D | mgga_c_scan.c | 3817 double t6126, t6127, t6129, t6130, t6135, t6136, t6138, t6140; in func_pol() local
8550 t6129 = t171 * t4573; in func_pol()
8551 t6130 = t1794 * t6129; in func_pol()
8565 t6155 = t1807 * t6129; in func_pol()
8989 …500000000000000000e1 * t6667 * t7010 + 0.11666666666666666667e1 * t2024 * t6129 + 0.19444444444444… in func_pol()
9064 …500000000000000000e1 * t6834 * t7010 + 0.11666666666666666667e1 * t2080 * t6129 - 0.19444444444444… in func_pol()
9069 …500000000000000000e0 * t2093 * t7020 + 0.87500000000000000000e0 * t2093 * t6129 - 0.13125000000000… in func_pol()
13403 t19604 = t5573 * t6129; in func_pol()
13472 t19735 = t5594 * t6129; in func_pol()
14847 … t6681 * t6129 + 0.87500000000000000000e0 * t2041 * t19601 - 0.19444444444444444444e1 * t6677 * t6… in func_pol()
[all …]
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| H A D | hyb_mgga_x_pjs18.c | 3695 double t6123, t6129, t6132, t6140, t6146, t6155, t6158, t6175; in func_pol() local
6544 t6129 = t68 * t2177; in func_pol()
6545 …113 * t6086 + t6123 * t71 + 0.72e2 * t1289 * t2054 + 0.72e2 * t399 * t5850 + 0.72e2 * t6129 * t317; in func_pol()
6855 …219 / 0.8e1 + 0.720e3 * t7219 * t69 + 0.432e3 * t4835 * t2059 + 0.216e3 * t6129 * t561 + 0.216e3 *… in func_pol()
7346 … t9524 - 0.9e1 / 0.4e1 * t4108 * t9514 + t1283 * t9521 / 0.2e1 + 0.72e2 * t6129 * t802 + 0.144e3 *… in func_pol()
9269 …39 * t2054 + 0.288e3 * t4845 * t1609 + 0.144e3 * t15971 * t561 + 0.72e2 * t6129 * t1138 + 0.288e3 … in func_pol()
9521 …t19386 = 0.72e2 * t1289 * t7135 + 0.432e3 * t15979 * t2059 + 0.216e3 * t6129 * t1609 + 0.432e3 * t… in func_pol()
9697 …151 * t2059 + 0.2e1 * t1729 * t7222 + 0.288e3 * t1746 * t7135 + 0.432e3 * t6129 * t2054 + 0.864e3 … in func_pol()
10390 …06 * t2059 + 0.144e3 * t22191 * t2059 + 0.72e2 * t26311 * t317 + 0.72e2 * t6129 * t2516 + 0.144e3 … in func_pol()
10662 …60 * t7135 + 0.216e3 * t26311 * t561 + 0.72e2 * t399 * t28391 + 0.216e3 * t6129 * t2937 + 0.432e3 … in func_pol()
[all …]
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| H A D | mgga_x_m11_l.c | 2256 double t6104, t6120, t6123, t6126, t6129, t6132, t6135, t6138; in func_ferr() local
3471 t6129 = t1080 * t931; in func_ferr()
3475 …23 + 0.1496000e7 / 0.81e2 * t1170 * t6126 + 0.3291200e7 / 0.81e2 * t473 * t6129 + 0.598400e6 / 0.2… in func_ferr()
3495 … 0.9e1 * t1163 * t6164 + 0.2720000e7 / 0.81e2 * t468 * t6126 + 0.1496000e7 / 0.81e2 * t187 * t6129; in func_ferr()
3548 …26 + 0.1496000e7 / 0.81e2 * t142 * t6129 + 0.1496000e7 / 0.81e2 * t1084 * t6126 + 0.3291200e7 / 0.… in func_ferr()
3578 …26 + 0.1496000e7 / 0.81e2 * t228 * t6129 + 0.1496000e7 / 0.81e2 * t1333 * t6126 + 0.3291200e7 / 0.… in func_ferr()
3585 …164 + 0.2720000e7 / 0.81e2 * t602 * t6126 + 0.1496000e7 / 0.81e2 * t264 * t6129 + 0.27200e5 / 0.9e… in func_ferr()
3596 …08 + 0.1496000e7 / 0.81e2 * t1475 * t6126 + 0.3291200e7 / 0.81e2 * t607 * t6129 + 0.598400e6 / 0.2… in func_ferr()
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| H A D | mgga_x_revtm.c | 199 double t6120, t6123, t6129, t6132, t6140, t6150, t6152, t6156; in func_unpol() local
1748 t6129 = t1824 * t226; in func_unpol()
1754 …t6164 = -0.24e2 * t1647 * t2260 - 0.24e2 * t1647 * t2262 - 0.12e2 * t553 * t6129 - 0.24e2 * t553 *… in func_unpol()
1767 …6e2 * t6107 + 0.18e2 * t6110 + 0.36e2 * t6113 + 0.36e2 * t6116 + 0.18e2 * t6129 + 0.36e2 * t6132 +… in func_unpol()
1779 …* t6110 + 0.24e2 * t133 * t6113 + 0.24e2 * t133 * t6116 + 0.12e2 * t133 * t6129 + 0.24e2 * t133 * … in func_unpol()
1784 …t2292 * t6107 + 0.648e3 * t2292 * t6129 + 0.1296e4 * t2292 * t6132 - 0.648e3 * t2295 * t6107 - 0.3… in func_unpol()
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| H A D | mgga_xc_b98.c | 278 double t6129, t6131, t6134, t6137, t6139, t6140, t6143, t6146; in func_unpol() local
2459 t6129 = t5767 * t6128; in func_unpol()
2463 … t6122 + 0.69196423739711934161e-5 * t6125 + 0.51866647431307554276e-11 * t6129 + 0.60669678470910… in func_unpol()
2528 … t6122 - 0.27678569495884773662e-4 * t6125 - 0.20746658972523021709e-10 * t6129 - 0.24267871388364… in func_unpol()
5733 double t6123, t6124, t6126, t6128, t6129, t6131, t6133, t6135; in func_pol() local
10510 t6129 = t6128 * t448; in func_pol()
10526 …1 * t6124 - 0.20000000000000000000e1 * t6126 + 0.30000000000000000000e1 * t6129 + 0.20000000000000… in func_pol()
16357 …1 * t6124 - 0.40000000000000000000e1 * t6126 + 0.60000000000000000000e1 * t6129 + 0.40000000000000… in func_pol()
16776 …1 * t6124 - 0.60000000000000000000e1 * t6126 + 0.90000000000000000000e1 * t6129 + 0.60000000000000… in func_pol()
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| H A D | mgga_c_b88.c | 2845 double t6124, t6125, t6126, t6129, t6132, t6135, t6136, t6137; in func_pol() local
7333 t6129 = t1641 * t1521; in func_pol()
7338 …75431651916060145e0 * t6124 * t6126 - 0.58800000000000000000e-1 * t1634 * t6129 + 0.29400000000000… in func_pol()
9800 …00000000e-1 * t1646 * t1390 * t1521 + 0.19600000000000000000e-1 * t5372 * t6129 + 0.58800000000000… in func_pol()
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| H A D | mgga_c_bc95.c | 2436 double t6118, t6119, t6121, t6122, t6124, t6127, t6128, t6129; in func_pol() local
6731 t6129 = t1429 * t583; in func_pol()
6760 …t6180 = -0.21590763888888888888e-2 * t6129 - 0.16e2 / 0.3e1 * t6131 - 0.28787685185185185184e-2 * … in func_pol()
10157 t20010 = 0.43181527777777777776e-2 * t6129; 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 | 501 double t6125, t6126, t6128, t6129, t6131, t6132, t6134, t6135; in func_pol() local
2777 t6129 = t5078 * t6128; in func_pol()
2794 … * t6123 + 0.95365535972841056531e-1 * t6126 + 0.22070309753714644512e1 * t6129 + 0.55175774384286… in func_pol()
2978 …t6710 = 0.60984006846243172544e1 * t6129 + 0.15246001711560793137e1 * t6132 + t6701 + 0.2635111406… in func_pol()
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| H A D | lda_c_pmgb06.c | 1676 double t6120, t6121, t6123, t6124, t6125, t6126, t6128, t6129; in func_pol() local
5665 t6129 = t1305 * t6128; in func_pol()
5666 t6130 = t1886 * t6129; in func_pol()
9177 t15043 = t4663 * t6129; in func_pol()
|