Home
last modified time | relevance | path

Searched refs:t5622 (Results 1 – 25 of 44) sorted by relevance

12

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F375 t5622, t5625, t5628, t5631, t5632, t5635, t5638, t5641, t5643, t5647, t5650, t5653, & local
2449 t5622 = 0.1666666667e0_dp*t165*t1392*t4729
2494 *t165*t166*t5613 + t5619 + t5622 - t5625 - t5628 + t5631 &
2764 + t5619 + t5622 - t5625 - t5628 + t5631 + t5716
3153 t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & local
5225 t5622 = 0.1666666667e0_dp*t165*t1392*t4729
5270 *t165*t166*t5613 + t5619 + t5622 - t5625 - t5628 + t5631 &
5540 + t5619 + t5622 - t5625 - t5628 + t5631 + t5716
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F375 t5622, t5625, t5628, t5631, t5632, t5635, t5638, t5641, t5643, t5647, t5650, t5653, & local
2449 t5622 = 0.1666666667e0_dp*t165*t1392*t4729
2494 *t165*t166*t5613 + t5619 + t5622 - t5625 - t5628 + t5631 &
2764 + t5619 + t5622 - t5625 - t5628 + t5631 + t5716
3153 t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & local
5225 t5622 = 0.1666666667e0_dp*t165*t1392*t4729
5270 *t165*t166*t5613 + t5619 + t5622 - t5625 - t5628 + t5631 &
5540 + t5619 + t5622 - t5625 - t5628 + t5631 + t5716
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_c_revtca.c1371 double t5620, t5622, t5624, t5629, t5630, t5632, t5633, t5637; in func_pol() local
4274 t5622 = t813 * t1542 * t479; in func_pol()
4275 … t5598 - t5600 + t5605 + t5609 - t5614 + t5616 - t5618 + t5620 + 0.15055475041882017741e-1 * t5622; in func_pol()
4482 … t6083 + t6086 + t6089 + t6092 + t6095 + t6098 - t6099 - t6100 + 0.30110950083764035480e-1 * t5622; in func_pol()
4627 …487 - t6488 - t5614 + t5616 - t6489 + t5620 + 0.10036983361254678494e-1 * t5622 + t5630 - 0.597897… in func_pol()
4735 …t6836 = -t6100 + 0.20073966722509356986e-1 * t5622 + t6104 - 0.11957950315158929999e-1 * t6492 + t… in func_pol()
4802 … t6486 - t6487 - t6488 - t5614 + t5616 + t6489 + t5620 + 0.50184916806273392469e-2 * t5622 + t5630; in func_pol()
4837 …t7302 = -t6099 - t6100 + 0.10036983361254678493e-1 * t5622 + t6104 - 0.23915900630317859997e-1 * t… in func_pol()
H A Dgga_c_op_pbe.c889 double t5610, t5612, t5614, t5620, t5622, t5623, t5625, t5629; in func_pol() local
3203 t5622 = t1083 * t1398; in func_pol()
3204 t5623 = t5622 * t1427; in func_pol()
3206 t5629 = t5622 * t1424; in func_pol()
3413 t6586 = 0.14994632292919624050e-3 * t5622 * t1805; in func_pol()
3414 t6588 = 0.23196567369804621250e-3 * t5622 * t1808; in func_pol()
H A Dgga_c_scan_e0.c1669 double t5595, t5598, t5601, t5603, t5605, t5611, t5615, t5622; in func_pol() local
4617 t5622 = t1725 * t892; in func_pol()
4618 t5623 = 0.64025200389650807209e0 * t5622; in func_pol()
4848 …83466926433871473e0 * t6726 - 0.14457274399185490173e-3 * t6730 - 0.85366933852867742946e0 * t5622; in func_pol()
H A Dgga_x_sfat_pbe.c1770 double t5617, t5622, t5645, t5654, t5660, t5679, t5683, t5696; in func_ferr() local
3088 t5622 = t132 * t5616; in func_ferr()
3094 …+ 0.59991248883451602030e-7 * t5622 * t2176 + 0.18561189352816638831e-6 * t5622 * t2180 + 0.143570… in func_ferr()
H A Dhyb_gga_xc_wb97.c2075 double t5616, t5617, t5618, t5619, t5620, t5622, t5623, t5624; in func_pol() local
5586 t5622 = t4453 * t6 * t12; in func_pol()
5587 t5623 = t5622 * t207; in func_pol()
8985 …74 * t14442 - 0.3e1 / 0.32e2 * t13522 * t6 * t12 * t207 - 0.3e1 / 0.8e1 * t5622 * t649 - t14454 / … in func_pol()
8986 t14457 = t5622 * t572; in func_pol()
9941 …67 * t7042 - 0.28948214860083628177e3 * t15273 * t7043 - 0.3e1 / 0.32e2 * t5622 * t1006 + 0.9e1 / … in func_pol()
9960 …9e1 / 0.32e2 * t1649 * t2757 - 0.3e1 / 0.16e2 * t19096 - 0.3e1 / 0.32e2 * t5622 * t1053 - 0.9e1 / … in func_pol()
12041 …0e1 * t1654 * t2113 * t12225 - 0.3e1 / 0.32e2 * t35693 - 0.3e1 / 0.32e2 * t5622 * t1298 - 0.9e1 / … in func_pol()
H A Dgga_c_zvpbeint.c2514 double t5621, t5622, t5623, t5624, t5625, t5626, t5627, t5628; in func_pol() local
6514 t5622 = t5252 * t421; in func_pol()
6515 t5623 = 0.9e1 / 0.64e2 * t5622; in func_pol()
6589 t5723 = 0.9e1 / 0.32e2 * t5622; in func_pol()
6659 t5840 = 0.9e1 / 0.16e2 * t5622; in func_pol()
10784 … * (t22561 + t22584 + t22606 + t22621 + t22646 + t22665 + t22797 + t22817) - 0.9e1 / 0.8e1 * t5622; in func_pol()
H A Dgga_c_zpbeint.c2093 double t5621, t5622, t5623, t5625, t5626, t5627, t5628, t5630; in func_pol() local
5909 t5622 = 0.3e1 / 0.8e1 * t5575; in func_pol()
5933 …t5658 = t5617 + t5618 + t5560 - t5619 + t5562 + t5620 + t5621 + t5622 - t5623 + t5628 + t5643 - t5… in func_pol()
9286 …v4rhosigma3[3] = t5617 + t5618 + t5560 - t5619 + t5562 + t5620 + t5621 + t5622 - t5623 + t5628 + t… in func_pol()
9457 …v4rhosigma3[13] = t5617 + t5618 + t5560 - t5619 + t5562 + t5620 + t5621 + t5622 - t5623 + t5628 + … in func_pol()
H A Dgga_x_gg99.c3739 double t5622, t5633, t5637, t5641, t5644, t5651, t5658, t5661; in func_pol() local
7179 t5622 = t127 * t5621; in func_pol()
7186 … t33 * t3060 * t1745 / 0.16e2 + t33 * t905 * t1768 / 0.8e1 + t33 * t324 * t5622 / 0.8e1 + t33 * t5… in func_pol()
9338 …t33 * t17857 * t920 / 0.16e2 + t33 * t2981 * t1768 / 0.8e1 + t33 * t905 * t5622 / 0.4e1 + t33 * t3… in func_pol()
9626 …433 + 0.3e1 / 0.8e1 * t33 * t4544 * t1768 + 0.3e1 / 0.8e1 * t33 * t1390 * t5622 + t33 * t905 * t64… in func_pol()
H A Dgga_c_gapc.c327 double t5615, t5620, t5622, t5623, t5628, t5630, t5633, t5634; in func_unpol() local
2895 t5622 = t5403 + t5469 + t5550 + t5620; in func_unpol()
2896 t5623 = t416 * t5622; in func_unpol()
3880 … * t5203 - t1115 * t1863 - 0.4e1 * t1566 * t1774 + 0.4e1 * t414 * t1120 * t5622 * t521 + 0.8e1 * t… in func_unpol()
3986 …475 + 0.2e1 * t1115 * t1804 - 0.2e1 * t16205 * t521 - 0.4e1 * t14684 * t582 - 0.2e1 * t587 * t5622; in func_unpol()
4017 …06 * t1862 + 0.2e1 * t414 * t1120 * t5721 * t521 + 0.6e1 * t414 * t1571 * t5622 - t414 * t416 * (t… in func_unpol()
4371 double t5613, t5616, t5619, t5620, t5621, t5622, t5628, t5632; in func_ferr() local
6988 t5622 = t95 * t5621; in func_ferr()
6998 …+ 0.10120442708333333334e-4 * t5616 * t1875 + 0.15387284965264388984e-8 * t5622 * t4935 - 0.337348… in func_ferr()
8176 …74569930528777968e-8 * t254 * t5621 * t4935 + 0.30774569930528777968e-8 * t5622 * t14397 - 0.20010… in func_ferr()
H A Dgga_c_sogga11.c3114 double t5612, t5613, t5614, t5616, t5617, t5618, t5620, t5622; in func_pol() local
6619 t5622 = t5220 * t312; in func_pol()
6620 t5623 = t5276 * t5622; in func_pol()
6701 t5756 = t1445 * t5622; in func_pol()
11948 t20551 = t18868 * t5622; in func_pol()
H A Dgga_x_wpbeh.c13185 double t5616, t5619, t5622, t5633, t5637, t5639, t5641, t5643; in func_pol() local
18620 …t5622 = (0.17059169152930056821e1 * t5272 - 0.24973623243864237938e2 * t1825 * t1175 - 0.124868116… in func_pol()
18621 …8e1 * t425 * t5272 - t5581 * t420 / 0.2e1 + t5596 * t415 + t5608 * t395 + t5622 * t410 / 0.2e1 - t… in func_pol()
25944 …71704407e-1 * t26810 * t1790 + 0.23256793492310493699e0 * t8309 * t5419 + t5622 * t2381 / 0.4e1 + … in func_pol()
31667 …t54611 = 0.3e1 / 0.4e1 * t14821 * t1260 + t1880 * t11527 / 0.2e1 + 0.3e1 / 0.4e1 * t5622 * t4073 +… in func_pol()
32138 t57285 = t5622 * t1254; in func_pol()
32348 …984620987398e0 * t457 * t1271 * t57414 + t14821 * t1819 / 0.2e1 + t5622 * t5373 + t5622 * t5381 - … in func_pol()
33955 …3 * t20346 - 0.54480027063369067932e0 * t14964 * t20059 - 0.3e1 / 0.8e1 * t5622 * t6814 - 0.3e1 / … in func_pol()
34028 … t4069 * t23609 / 0.4e1 + t403 * t1256 * t71005 / 0.4e1 + 0.3e1 / 0.4e1 * t5622 * t6855 + 0.137369… in func_pol()
34137 …/ 0.4e1 * t6902 * t5373 + 0.3e1 / 0.4e1 * t6902 * t5381 + 0.3e1 / 0.4e1 * t5622 * t6867 + 0.348851… in func_pol()
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_c_tpss.c9979 t5622 = t1326 * t1326; in func_pol()
9980 t5623 = t82 * t5622; in func_pol()
9987 t5637 = t5622 * t227; in func_pol()
9993 t5652 = t96 * t5622; in func_pol()
16321 t22872 = t446 * t5622; in func_pol()
16335 t22916 = t5622 * t751; in func_pol()
16348 t22960 = t464 * t5622; in func_pol()
16438 t23203 = t915 * t5622; in func_pol()
16456 t23276 = t928 * t5622; in func_pol()
17536 t25450 = t73 * t5622; in func_pol()
[all …]
H A Dmgga_xc_cc06.c1144 double t5622, t5645, t5651, t5674, t5676, t5679, t5685, t5686; in func_pol() local
3543 t5622 = t560 * t2150; in func_pol()
3546 …6666666666667e-3 * t5622 * t1245 * t251 * t1902 + 0.61643808127998300145e-5 * t2136 * t4613 * t245… in func_pol()
H A Dmgga_c_revtpss.c17989 t21018 = t541 * t5622; in func_pol()
18003 t21060 = t265 * t5622; in func_pol()
18026 t21173 = t5622 * t535; in func_pol()
18050 t21255 = t5622 * t546; in func_pol()
18604 t23019 = t5622 * t1098; in func_pol()
18609 t23034 = t5622 * t1151; in func_pol()
18626 t23124 = t5622 * t1103; in func_pol()
20197 t27230 = t1363 * t5622; in func_pol()
29742 t78787 = t578 * t5622; in func_pol()
29780 t79245 = t536 * t5622; in func_pol()
[all …]
H A Dmgga_c_bc95.c2395 double t5606, t5607, t5609, t5614, t5616, t5618, t5622, t5628; in func_pol() local
6384 t5622 = t1569 * t506; in func_pol()
6385 …1 * t5391 - 0.48245938496077605201e2 * t5394 - 0.15000000000000000000e1 * t5622 - 0.15000000000000… in func_pol()
6448 t5748 = t5622 * t338; in func_pol()
10044 …4 + 0.83333333333333333333e0 * t5618 * t1239 + 0.41666666666666666666e0 * t5622 * t1239 + 0.416666… in func_pol()
10047 …8 + 0.44444444444444444444e1 * t1654 * t4285 - 0.55555555555555555557e1 * t5622 * t1415 + 0.193453… in func_pol()
10514 …636177777777777778e0 * t1551 * t2047 * t1923 + 0.83333333333333333334e0 * t5622 * t122 - 0.1381808… in func_pol()
10519 …7 + 0.20833333333333333332e0 * t5618 * t2007 + 0.10416666666666666666e0 * t5622 * t2007 + 0.462962… in func_pol()
H A Dmgga_x_mbeef.c28427 double t5547, t5554, t5583, t5603, t5621, t5622, t5635, t5637; in func_pol() local
32970 …t5622 = -0.818125e6 / 0.648e3 * t5225 - 0.1925e4 / 0.16e2 * t5221 + 0.1925e4 / 0.96e2 * t5302 - 0.… in func_pol()
33041 …t5622 - 0.303347141e-2 * t288 * t5583 + 0.119130546e-2 * t6061 - 0.416393106e-7 * t998 * t1868 - 0… in func_pol()
33047 …* t1820 * t1057 - 0.493824365e-8 * t5443 * t346 + 0.912223751e-8 * t351 * t5622 - 0.303347141e-2 *… in func_pol()
35892 …0 * t16376 + 0.27331759139944487311e1 * t16379 + 0.4013881314e-7 * t996 * t5622 + 0.96029592639750… in func_pol()
35960 …t1780 * t3789 - 0.790811707e-7 * t351 * t17091 - 0.433721136e-7 * t1216 * t5622 - 0.1383185928e-7 … in func_pol()
36047 …8 - 0.16373116148148148148e-1 * t5801 * t3474 + 0.1824447502e-7 * t1162 * t5622 + 0.169805915e-6 *… in func_pol()
36102 …t17777 = -0.338128188e-7 * t1918 * t3909 - 0.1548449924e-7 * t1094 * t5622 - 0.669043971e-8 * t181… in func_pol()
36139 …t18085 = -0.1028409352e-3 * t991 * t5622 + 0.694482484e-8 * t3554 * t1767 + 0.1388964968e-7 * t998… in func_pol()
37665 …* t23169 + 0.42190961265393750000e-1 * t23171 + 0.4013881314e-7 * t1818 * t5622 - 0.26241915836231… in func_pol()
[all …]
H A Dmgga_x_mggac.c15428 t5622 = t927 * t5621; in func_ferr()
31887 t5622 = t5621 * t5407; in func_pol()
31889 t5624 = t5622 * t5623; in func_pol()
31891 t5627 = t5622 * t5617; in func_pol()
34012 t8540 = t5622 * t8536; in func_pol()
34015 t8544 = t5622 * t8543; in func_pol()
37220 t12833 = t5622 * t12829; in func_pol()
37223 t12837 = t5622 * t12836; in func_pol()
41732 t19271 = t5622 * t19267; in func_pol()
41735 t19275 = t5622 * t19274; in func_pol()
[all …]
H A Dmgga_x_mbeefvdw.c8790 double t5612, t5614, t5616, t5618, t5620, t5622, t5624, t5626; in func_ferr() local
11269 t5622 = t1574 * t1338; in func_ferr()
17087 double t5617, t5619, t5621, t5622, t5623, t5625, t5627, t5629; in func_pol() local
20793 t5622 = t5 * t5621; in func_pol()
20795 t5625 = t5622 * t1640 * t5623; in func_pol()
20829 t5695 = t5622 * t1640 * t5693; in func_pol()
25290 …9 / 0.6e1 - t1616 * t19611 * t5617 - t1616 * t5616 * t9 * t1194 / 0.2e1 - t5622 * t5561 * t9 * t15… in func_pol()
25302 t19681 = t5622 * t5627 * t5623; in func_pol()
25326 t19832 = t5622 * t5627 * t5693; in func_pol()
25335 …t5622 * t5721 * t5623 + t8 * t1648 * t692 - t8 * t19648 * t496 / 0.3e1 - t8 * t1594 * t2066 * t159… in func_pol()
[all …]
H A Dmgga_x_ms.c2928 double t5608, t5610, t5611, t5618, t5622, t5634, t5637, t5638; in func_pol() local
5686 t5622 = t1147 * t295; in func_pol()
5688 …/ 0.3e1 - 0.2e1 / 0.9e1 * t5145 - t5618 * t1983 * t1401 / 0.3e1 + t1982 * t5622 * t1392 / 0.9e1 + … in func_pol()
5705 …- t5608 - t5590 - 0.4e1 / 0.3e1 * t5611 - 0.2e1 / 0.9e1 * t5669 + t1982 * t5622 * t1528 / 0.9e1 - … in func_pol()
H A Dmgga_x_rscan.c317 double t5611, t5614, t5615, t5618, t5619, t5620, t5621, t5622; in func_unpol() local
3170 t5622 = t1017 * t1937; in func_unpol()
3171 t5623 = 0.26048173828125000000e-1 * t5622; in func_unpol()
5405 t15470 = 0.52096347656250000000e-1 * t5622; in func_unpol()
14518 double t5607, t5610, t5613, t5614, t5615, t5618, t5621, t5622; in func_pol() local
18807 t5622 = t5621 * t979; in func_pol()
18829 …5615 + 0.80565022027453500000e3 * t1656 * t5618 + 0.12225726302783760e5 * t5622 * t5623 + 0.306748… in func_pol()
19953 …t8042 + 0.78774688204621200000e3 * t8048 * t8049 + 0.4075242100927920e4 * t5622 * t8049 - 0.365726… in func_pol()
20672 …t9931 + 0.78774688204621200000e3 * t8048 * t9936 + 0.4075242100927920e4 * t5622 * t9936 - 0.365726… in func_pol()
26724 t33146 = 0.4075242100927920e4 * t5622 * t33137; in func_pol()
[all …]
H A Dmgga_x_tpss.c181 double t5622, t5635, t5655, t5663, t5665, t5690, t5708, t5711; in func_unpol() local
1565 t5622 = t4370 * t25; in func_unpol()
1566 …e3 * t2055 * t1898 - 0.73e2 / 0.300e3 * t5619 * t705 - 0.73e2 / 0.600e3 * t5622 * t705 + 0.73e2 / … in func_unpol()
1675 … * t2415 - 0.5913e4 / 0.200e3 * t2062 * t1993 * t787 - 0.73e2 / 0.300e3 * t5622 * t870 - 0.73e2 / … in func_unpol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_ml1.c483 double t5606, t5608, t5615, t5616, t5619, t5620, t5622, t5625; in func_pol() local
2636 t5622 = t276 * t501 * t2252; in func_pol()
2641 …20067767464e0 * t1424 * t728 - t5616 - t5620 + 0.26265909022844765013e0 * t5622 + 0.13132954511422… in func_pol()
3218 …0 * t5615 - 0.16678246174854973312e0 * t5619 + 0.17510606015229843341e0 * t5622 + 0.87553030076149… in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/
H A Dmgga_x_tb09.c210 double t5618, t5619, t5620, t5621, t5622, t5623, t5624, t5625; in func_unpol() local
1797 t5622 = 0.4e1 / 0.3e1 * t4823; in func_unpol()
1802 …t5633 = -t5612 - t5613 - t5614 + t5615 - t5616 - t5617 + t5618 + t5619 + t5620 - t5621 + t5622 + t… in func_unpol()
1866 …t5880 = t5622 + t5623 - t5624 - t5625 - t5626 - t671 + t739 - 0.2e1 / 0.3e1 * t172 * t3356 - 0.2e1… in func_unpol()
1923 … 0.3e1 * t1032 * t4787 - 0.10e2 / 0.9e1 * t4442 * t5606 - t6084 - t5621 + t5622 - t5617 + t5618 + … in func_unpol()

12