| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_lag.c | 756 double t1513, t1514, t1516, t1518, t1519, t1521, t1523, t1527; in func_pol() local
2063 …t1523 = -0.13165522536496597069e-4 * t1474 - 0.13165522536496597069e-4 * t1476 + 0.394965676094897… in func_pol()
2065 …v3rho2sigma[5] = t9 * t1523 - t1399 + t1401 - t458 + t463 - t480 + t486 - t489 + t493 + t496 + t49… in func_pol()
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| H A D | gga_x_hjs.c | 3053 t1523 = t184 * t785 * t1378; in func_ferr()
4480 double t1502, t1510, t1513, t1514, t1523, t1524, t1527; in func_pol() local
6597 t1523 = 0.3e1 / 0.2e1 * t1500 * t468 - t907 * t1510 / 0.2e1; in func_pol()
6598 t1524 = t429 * t1523; in func_pol()
7645 t4355 = t1149 * t1523; in func_pol()
7828 t4946 = t1478 * t1523; in func_pol()
10579 t13049 = t3335 * t1523; in func_pol()
11200 t15201 = t4338 * t1523; in func_pol()
11534 t16360 = t4860 * t1523; in func_pol()
11550 t16465 = t4863 * t1523; in func_pol()
[all …]
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| H A D | gga_c_pbe.c | 1438 double t1511, t1515, t1522, t1523, t1524, t1525, t1526, t1527; in func_pol() local
2767 t1523 = t1446 + t1522; in func_pol()
2768 t1524 = t54 * t1523; in func_pol()
4262 t4783 = t40 * t192 * t1523; in func_pol()
4483 t5681 = t40 * t330 * t1523; in func_pol()
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| H A D | gga_c_op_b88.c | 731 double t1493, t1503, t1507, t1511, t1515, t1518, t1519, t1523; in func_pol() local
1804 t1523 = t15 * t499; in func_pol()
1829 …t1604 = -0.28e2 / 0.243e3 * t14 * t1523 * t62 - 0.4e1 / 0.27e2 * t19 * t1527 * t186 - 0.2e1 / 0.9e… in func_pol()
3665 t9687 = t1523 * t262; in func_pol()
3703 …30009615000000000000e0 * t2438 * t788 + 0.10373694074074074074e0 * t207 * t1523 * t263 + 0.1000320… in func_pol()
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| H A D | gga_c_scan_e0.c | 1462 double t1512, t1513, t1514, t1515, t1516, t1519, t1520, t1523; in func_pol() local
2867 t1523 = t461 * t199; in func_pol()
2868 t1524 = t1523 * t200; in func_pol()
2877 t1561 = t1523 * t496; in func_pol()
2883 t1581 = t1523 * t1580; in func_pol()
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| H A D | gga_x_hjs_b88_v2.c | 3265 double t1508, t1511, t1516, t1521, t1523, t1524, t1527, t1530; in func_ferr() local
4161 t1524 = t1523 * t163; in func_ferr()
4658 t3525 = t1523 * t381; in func_ferr()
4937 t4845 = t1523 * t548; in func_ferr()
6499 double t1522, t1523, t1526, t1527, t1528, t1532, t1533, t1536; in func_pol() local
8887 t1523 = t1520 * t1522; in func_pol()
8947 …t1505 * t1507 - 0.14e2 / 0.27e2 * t393 * t1515 + 0.4e1 / 0.27e2 * t1519 * t1523 - 0.4e1 / 0.27e2 *… in func_pol()
10709 …t6783 * t6358 + 0.16e2 / 0.81e2 * t6783 * t6351 + 0.4e1 / 0.9e1 * t6790 * t1523 - 0.4e1 / 0.9e1 * … in func_pol()
12517 …t12235 * t401 - 0.4e1 / 0.9e1 * t12239 * t401 - 0.4e1 / 0.27e2 * t12243 * t1523 + 0.4e1 / 0.27e2 *… in func_pol()
12532 …12401 / 0.9e1 + 0.4e1 / 0.9e1 * t12411 * t401 + 0.4e1 / 0.27e2 * t12414 * t1523 - 0.4e1 / 0.27e2 *… in func_pol()
[all …]
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| H A D | gga_x_chachiyo.c | 76 double t1514, t1520, t1522, t1523, t1531, t1549, t1569, t1570; in func_unpol() local
507 t1523 = t12 * t1522; in func_unpol()
510 …t1523 - 0.3e1 / 0.16e2 * t47 * t8 * (-0.5e1 / 0.72e2 * t55 * t1522 * t27 * t59 - 0.5e1 / 0.324e3 *… in func_unpol()
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| H A D | gga_c_pw91.c | 106 double t1502, t1514, t1516, t1523, t1549, t1590, t1591, t1594; in func_unpol() local
762 t1523 = t338 * t338; in func_unpol()
763 …t1523 * t387 - 0.40027279549328247204e6 * t790 * t338 * t871 * t50 * t313 - 0.82965876564544302252… in func_unpol()
797 …t1523 * t346 - 0.62070017646847402100e4 * t1479 * t1469 * t792 - 0.24000000000000000000e2 * t757 *… in func_unpol()
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| H A D | gga_c_bmk.c | 100 double t1523, t1524, t1529, t1543, t1546, t1548, t1549, t1551; in func_unpol() local
706 t1523 = t6 * t1522; in func_unpol()
707 t1524 = t1523 * t10; in func_unpol()
721 …0.65641851851851851850e1 * t233 * t1572 + 0.31003950617283950618e1 * t4 * t1523 + 0.68258333333333… in func_unpol()
722 …567559743977359e3 * t871 * t813 * t480 - 0.11483710345679012345e-1 * t4 * t1523 * t103 + 0.1157928… in func_unpol()
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| H A D | gga_c_hcth_a.c | 1404 double t1516, t1517, t1523, t1524, t1525, t1526, t1528, t1529; in func_pol() local
2807 t1523 = 0.1e1 / t157 / t156; in func_pol()
2808 t1524 = t466 * t1523; in func_pol()
3789 t3703 = t1224 * t1523; in func_pol()
5646 t8674 = 0.48451138557721871070e-3 * t3638 * t1523 * t1525 * t430; in func_pol()
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| H A D | gga_c_op_g96.c | 675 double t1515, t1516, t1517, t1518, t1519, t1522, t1523, t1524; in func_pol() local
1803 t1523 = t1522 * t114; in func_pol()
1804 t1524 = t1516 * t1523; in func_pol()
3237 …7442552040e-2 * t433 * t1536 + 0.41319850256826169234e-2 * t155 * t5751 * t1523 - 0.10754879859042… in func_pol()
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| H A D | gga_c_op_pw91.c | 789 double t1518, t1521, t1522, t1523, t1524, t1527, t1529, t1534; in func_pol() local
1881 t1523 = -t1521 - t1522 + t1346; in func_pol()
1882 t1524 = t4 * t1523; in func_pol()
3123 t5064 = t3 * t1523 * t132; in func_pol()
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| H A D | gga_c_sg4.c | 1201 double t1517, t1519, t1521, t1523, t1524, t1526, t1527, t1529; in func_ferr() local
2019 t1523 = sigma[0] * t585 * t241; in func_ferr()
2020 t1524 = t1521 * t1523; in func_ferr()
2345 …t4007 = 0.74603879574325938637e-4 * t337 * t1917 * t1523 + 0.30396355092701331432e0 * t2613 * t685… in func_ferr()
2348 …637e-4 * t676 * t677 * t1112 + 0.74603879574325938637e-4 * t363 * t1144 * t1523 - t668 * t4054 * t… in func_ferr()
2542 double t1519, t1521, t1522, t1523, t1524, t1525, t1533, t1534; in func_pol() local
5063 t1523 = t439 * t1287; in func_pol()
5064 t1524 = 0.6e1 * t1523; in func_pol()
6915 …t1398 + 0.9e1 * t1400 + 0.3e1 * t1519 - t3000 + 0.18e2 * t1521 + 0.18e2 * t1523 - 0.24e2 * t1177 -… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_rtpss.c | 1534 double t1506, t1508, t1514, t1517, t1520, t1521, t1523, t1524; in func_ferr() local
2230 t1523 = t746 * t1376; in func_ferr()
2231 t1524 = t1374 * t1523; in func_ferr()
2711 …509 - 0.75e2 / 0.16e2 * t2965 * t3934 * t745 + 0.225e3 / 0.64e2 * t3938 * t1523 - 0.45e2 / 0.32e2 … in func_ferr()
2955 double t1515, t1520, t1523, t1526, t1529, t1533, t1536, t1539; in func_pol() local
4048 t1523 = t78 * t83; in func_pol()
4051 … t1515 - 0.73e2 / 0.194400e6 * t298 * t1520 + 0.25e2 / 0.472392e6 * t92 * t1523 + t1526 * t24 / 0.… in func_pol()
4055 t1541 = t1540 * t1523; in func_pol()
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| H A D | mgga_x_mvsb.c | 97 double t1496, t1503, t1506, t1509, t1512, t1515, t1520, t1523; in func_unpol() local
788 t1523 = t1334 * t101; in func_unpol()
790 t1527 = 0.4e1 * t1523 - 0.6e1 * t1525; in func_unpol()
1052 …728 * t3519 + 0.960e3 * t1734 * t3519 - 0.192e3 * t96 * t3590 + 0.240e3 * t1523 - 0.720e3 * t1525)… in func_unpol()
2340 double t1521, t1522, t1523, t1525, t1526, t1528, t1531, t1532; in func_pol() local
3620 …t1523 = -t1433 - t1437 + t1441 - t1444 / 0.1152e4 - t1446 / 0.36864e5 + t1454 - t1460 + t1462 + 0.… in func_pol()
3715 …v3rho3[0] = t10 * (t1523 + t1727) - t444 / 0.288e3 + 0.19e2 / 0.2304e4 * t576 - t465 / 0.1152e4 - … in func_pol()
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| H A D | mgga_x_mbeef.c | 14364 double t1523, t1530, t1532, t1541, t1552, t1555, t1559, t1560; in func_ferr() local
16306 …t1523 = 0.15e2 * t1387 + 0.15e2 / 0.2e1 * t1389 - 0.11e2 / 0.9e1 * t1365 + t1372 / 0.8e1 - t1382 /… in func_ferr()
16328 t1615 = t1523 * t78; in func_ferr()
16384 …* t353 + 0.1793478932e-2 * t424 * t410 - 0.845508103e-2 * t1523 * t97 + 0.896739466e-3 * t1523 * t… in func_ferr()
17346 t6032 = t1523 * t42; in func_ferr()
17768 …30380e0 * t1966 * t912 - 0.265114646e-7 * t1468 * t768 + 0.674910119e-8 * t1523 * t868 + 0.9406757… in func_ferr()
17803 …03750000000e-2 * t7415 - 0.276524680e-6 * t196 * t7325 + 0.896739466e-3 * t1523 * t816 + 0.2382610… in func_ferr()
20695 t21071 = t1523 * t41; in func_ferr()
21519 …e-1 * t2321 * t1498 + 0.2690218398e-2 * t1523 * t2300 + 0.709174233e-7 * t2370 * t1447 - 0.2536524… in func_ferr()
22046 …t1523 * t3210 + 0.38710936090534979424e0 * t26739 * t1764 - 0.52259763722222222223e-1 * t26742 * t… in func_ferr()
[all …]
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| H A D | mgga_x_revtm.c | 4649 double t1510, t1511, t1513, t1519, t1520, t1523, t1528, t1531; in func_pol() local
5842 t1523 = t773 * t609; in func_pol()
5863 …15 * t281 - 0.6e1 * t760 * t617 + 0.54e2 * t1200 * t1520 - 0.6e1 * t243 * t1523 - 0.12e2 * t1208 *… in func_pol()
6816 …t4046 = -0.6e1 * t2367 * t617 - 0.12e2 * t760 * t1523 - 0.12e2 * t760 * t1528 - 0.9e1 / 0.100e3 * … in func_pol()
7214 …100e3 * t4018 * t1263 - 0.9e1 / 0.100e3 * t3504 * t1563 - 0.6e1 * t1194 * t1523 - 0.6e1 * t1194 * … in func_pol()
7466 …* t5900 - 0.6e1 * t5843 * t245 - 0.12e2 * t3945 * t617 - 0.12e2 * t1513 * t1523 + 0.50310579753086… in func_pol()
8786 …t11142 = -0.18e2 * t2367 * t1523 - 0.4959e4 / 0.10000e5 * t7802 * t650 * t2578 - 0.36e2 * t3945 * … in func_pol()
9250 … t844 - 0.6e1 * t1194 * t3998 - 0.12e2 * t1194 * t4001 - 0.12e2 * t3217 * t1523 - 0.12e2 * t3217 *… in func_pol()
9864 …t18312 = 0.54e2 * t3948 * t4593 - 0.6e1 * t12380 * t617 - 0.6e1 * t4546 * t1523 - 0.6e1 * t4546 * … in func_pol()
10149 …1528 - 0.12e2 * t3945 * t1962 - 0.12e2 * t14121 * t617 - 0.12e2 * t5160 * t1523 + 0.171e3 / 0.1000… in func_pol()
[all …]
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| H A D | mgga_x_pbe_gx.c | 1351 double t1518, t1522, t1523, t1530, t1547, t1548, t1561, t1567; in func_ferr() local
2087 t1523 = t1522 * t216; in func_ferr()
2095 …t1523 + 0.27407407407407407407e0 * t268 * t1478 + 0.36543209876543209876e0 * t671 * t1481 - 0.8222… in func_ferr()
2102 …* t1621 * t227 - 0.20e2 / 0.9e1 * t252 * t595 - 0.500e3 / 0.81e2 * t650 * t1523 - 0.5e1 / 0.9e1 * … in func_ferr()
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| H A D | mgga_x_tau_hcth.c | 71 double t1380, t1408, t1411, t1444, t1480, t1484, t1486, t1523; in func_unpol() local
553 …t1523 = -0.39200e5 / 0.3e1 * t675 * t1480 + 0.56000e5 / 0.3e1 * t1030 * t1486 + 0.2600e4 / 0.3e1 *… in func_unpol()
555 …19 * t530 - 0.3e1 / 0.8e1 * t103 * t104 * t156 * t919 - 0.3e1 / 0.16e2 * t103 * t104 * t65 * t1523; in func_unpol()
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| H A D | mgga_x_regtpss.c | 115 double t1517, t1518, t1519, t1522, t1523, t1526, t1527, t1528; in func_unpol() local
1236 t1523 = t457 * t379; in func_unpol()
1252 …t1563 = (-0.27562962421875000000e-1 * t1522 * t1523 + 0.51680554541015625000e-2 * t1526 * t1529 - … in func_unpol()
8449 double t1517, t1519, t1520, t1522, t1523, t1525, t1528, t1530; in func_pol() local
10110 t1523 = t315 * t1522; in func_pol()
10111 …074074074074075e-1 * t1517 - 0.30864197530864197531e-1 * t1520 + 0.41152263374485596707e-1 * t1523; in func_pol()
10149 t1608 = t367 * t1523; in func_pol()
11333 t4220 = t1045 * t1523; in func_pol()
11791 …304526748971193414e0 * t1520 + 0.24691358024691358024e0 * t5395 + 0.54869684499314128941e0 * t1523; in func_pol()
12144 t6320 = t1633 * t1523; in func_pol()
[all …]
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| H A D | hyb_mgga_x_pjs18.c | 1809 double t1506, t1507, t1510, t1513, t1516, t1519, t1520, t1523; in func_ferr() local
2474 t1523 = t156 * t423; in func_ferr()
2482 …386989866666666666e-1 * t131 * t1520 + 0.84254737777777777777e-1 * t131 * t1523 + 0.16850947555555… in func_ferr()
2887 …5037037037037e0 * t131 * t156 * t1530 + 0.33701895111111111112e0 * t275 * t1523 - 0.14154795946666… in func_ferr()
2950 …531842222222222222e-1 * t1339 * t392 + 0.84254737777777777777e-1 * t384 * t1523 - 0.31595526666666… in func_ferr()
3522 double t1497, t1499, t1504, t1507, t1510, t1519, t1523, t1529; in func_pol() local
5037 …t1523 = 0.30720e5 * t1387 * t229 + 0.448e3 * t1393 + 0.448e3 * t1440 - 0.17280e5 * t1442 - 0.5760e… in func_pol()
5042 … t1393 + 0.144e3 * t1510 * t456 + 0.72e2 * t519 * t1387 + 0.24e2 * t227 * t1523 + 0.240e3 * t63 * … in func_pol()
6085 t4531 = t184 * t1523; in func_pol()
8816 t14324 = t179 * t1523; in func_pol()
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| H A D | mgga_c_revscan.c | 3837 double t1505, t1508, t1509, t1516, t1517, t1522, t1523, t1526; in func_pol() local
6778 t1523 = t718 * t1522; in func_pol()
6786 ….62833333333333333333e0 * t839 * t675 - 0.62833333333333333333e0 * t507 * t1523 - 0.12566666666666… in func_pol()
8855 …62833333333333333333e0 * t507 * t5167 - 0.12566666666666666667e1 * t839 * t1523 - 0.25133333333333… in func_pol()
9003 …566666666666666667e1 * t1497 * t1509 - 0.12566666666666666667e1 * t1497 * t1523 - 0.25133333333333… in func_pol()
9970 t7456 = t2164 * t1523; in func_pol()
10676 …472222222222222222e1 * t8396 * t8822 - 0.62833333333333333333e0 * t8455 * t1523 - 0.12566666666666… in func_pol()
10729 …472222222222222222e1 * t8633 * t8990 - 0.62833333333333333333e0 * t8645 * t1523 - 0.12566666666666… in func_pol()
14725 …444 - 0.10053333333333333334e2 * t5063 * t5585 * t19448 - 0.25133333333333333334e1 * t5120 * t1523; in func_pol()
16640 t25937 = t7113 * t1523; in func_pol()
[all …]
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| H A D | mgga_c_scanl.c | 122 double t1511, t1513, t1514, t1515, t1517, t1523, t1526, t1530; in func_unpol() local
1420 t1523 = t456 * t79; in func_unpol()
5407 …t1523 * t5857 + 0.94814814814814814818e1 * t360 * t19757 * t5856 * t455 + 0.64000000000000000002e1… in func_unpol()
5616 double t1520, t1523, t1524; in func_ferr() local
6896 …t1523 = my_piecewise3(t155, t1508 * t161 + t1511, -0.210e1 * t780 * t1500 * t163 + 0.105e1 * t329 … in func_ferr()
6897 t1524 = rho[0] * t1523; in func_ferr()
7975 v3rholapl2[0] = t1523 * t166 + t1524 * t342 + t4535 * t166; in func_ferr()
8225 t5489 = t169 * t1523; in func_ferr()
9702 …v4rho2lapl2[0] = rho[0] * t14272 * t166 + 0.2e1 * t1523 * t342 + t1524 * t808 + 0.2e1 * t4534 * t1… in func_ferr()
10321 t18942 = t81 * t1523; in func_ferr()
[all …]
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| H A D | mgga_x_task.c | 1578 double t1499, t1506, t1508, t1517, t1520, t1521, t1523, t1525; in func_ferr() local
2259 t1523 = t669 * t181; in func_ferr()
2303 …3 * t231 * t531 + 0.18000e3 * t221 * t531 + t1506 * t103 + t1521 * t103 + t1523 * t103 + 0.2e1 * t… in func_ferr()
2711 …00000e4 * t102 * t2530 * t688 * t416 + 0.200e2 * t1506 * t185 + 0.200e2 * t1523 * t185 + 0.200e2 *… in func_ferr()
2808 … * t534 + 0.27000e3 * t509 * t689 + 0.720000e3 * t182 * t1997 + 0.300e2 * t1523 * t233 + 0.27000e3… in func_ferr()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 4159 double t1515, t1516, t1519, t1523, t1526, t1527, t1530, t1534; in func_pol() local
5374 t1523 = t578 * t1515; in func_pol()
5379 …2e1 * t977 * t1516 - t981 * t1519 / 0.3e1 - t370 * t1388 + 0.2e1 * t981 * t1523 + 0.2e1 / 0.3e1 * … in func_pol()
6325 …0 * t3875 - t370 * t3023 - 0.2e1 / 0.3e1 * t981 * t3025 + 0.2e1 * t3888 * t1523 + 0.2e1 * t981 * t… in func_pol()
7688 t9951 = t3002 * t1523; in func_pol()
7927 … t1516 + 0.2e1 * t2056 * t1388 + 0.2e1 * t6700 * t1519 - 0.12e2 * t6700 * t1523 - 0.2e1 / 0.3e1 * … in func_pol()
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