| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_sa_tpss.c | 7605 double t4555, t4557, t4559, t4561, t4563, t4567, t4568, t4570; in func_pol() local
10185 t4567 = t3299 * t270; in func_pol()
10186 t4568 = t4567 * t4549; in func_pol()
10233 t4684 = t4567 * t4683; in func_pol()
10821 t6533 = t4567 * t6532; in func_pol()
10923 t6802 = t4567 * t6789; in func_pol()
11314 t7649 = t4567 * t7549; in func_pol()
11325 t7687 = t4567 * t7686; in func_pol()
13239 …t4567 * t14266 + 0.125e3 / 0.3888e4 * t4547 * t14266 + 0.25e2 / 0.144e3 * t4534 * t14271 - 0.125e3… in func_pol()
13818 …t4567 * t18126 - 0.25e2 / 0.324e3 * t4534 * t18178 + 0.125e3 / 0.8748e4 * t4547 * t18181 + 0.25e2 … in func_pol()
[all …]
|
| H A D | mgga_c_tpssloc.c | 4179 double t4566, t4567, t4570, t4571, t4572, t4573, t4577, t4581; in func_pol() local
11015 t4567 = t61 * t4566; in func_pol()
16360 t17655 = t4962 * t4567; in func_pol()
17328 … t1281 / 0.3e1 - t5572 * t4567 / 0.3e1 - t5572 * t4577 / 0.3e1 - t20143 * t1281 / 0.3e1 - t20147 *… in func_pol()
27109 …50 + 0.2e1 * t4570 * t62838 + t4570 * t62843 + t63617 + t16377 * t4567 + t16338 * t4567 + t4562 * … in func_pol()
27545 t65881 = t17672 * t4567; in func_pol()
27565 t66055 = t17707 * t4567; in func_pol()
27638 t66462 = t17703 * t4567; in func_pol()
28855 …t4567 / 0.3e1 + t19314 * t4577 / 0.3e1 + t44180 * t1277 * t1281 / 0.6e1 + t9285 * t4550 * t1281 / … in func_pol()
28958 t72706 = 0.16e2 / 0.9e1 * t20071 * t4567; in func_pol()
[all …]
|
| H A D | mgga_x_revtm.c | 180 double t4525, t4549, t4553, t4557, t4567, t4578, t4596, t4603; in func_unpol() local
1584 …29 * t1470 + 0.3e1 / 0.10e2 * t452 * t1600 + t4428 * t76 + t27 * (t4525 + t4567) + 0.3e1 * t1487 *… in func_unpol()
4769 double t4559, t4560, t4563, t4564, t4567, t4576, t4577, t4578; in func_pol() local
6955 t4567 = t1201 * t1184; in func_pol()
6964 …t4540 + 0.12e2 * t3217 * t475 - 0.324e3 * t767 * t4564 - 0.108e3 * t767 * t4567 + t1799 - t4545 + … in func_pol()
6978 …87 - 0.24e2 * t4632 * t1187 + 0.324e3 * t1200 * t4564 + 0.108e3 * t1200 * t4567 + 0.108e3 * t4611 … in func_pol()
8940 …36 - 0.54e2 * t12385 * t829 - 0.648e3 * t2370 * t4564 - 0.216e3 * t2370 * t4567 - 0.648e3 * t3220 … in func_pol()
8972 …t3386 * t4564 + 0.216e3 * t3386 * t4567 - 0.1296e4 * t10055 * t4560 + 0.648e3 * t3389 * t4564 + 0.… in func_pol()
9619 …8 - 0.162e3 * t2370 * t6351 - 0.972e3 * t3220 * t4564 - 0.324e3 * t3220 * t4567 + 0.1944e4 * t9682… in func_pol()
9638 …42 - 0.36e2 * t4632 * t4542 + 0.972e3 * t4611 * t4564 + 0.324e3 * t4611 * t4567 + 0.162e3 * t4611 … in func_pol()
[all …]
|
| H A D | mgga_x_msb.c | 149 double t4537, t4544, t4548, t4567, t4603, t4607, t4636, t4672; in func_unpol() local
1265 …t4567 = t62 * (0.1250e4 / 0.1162261467e10 * t1958 * t4528 * t4530 - 0.250e3 / 0.1594323e7 * t793 *… in func_unpol()
1278 …v4rhosigma3[0] = -t325 * t1702 / 0.4e1 - 0.3e1 / 0.16e2 * t77 * t78 * (t4479 + t4524 + t4567 + t46… in func_unpol()
3138 double t4554, t4557, t4560, t4563, t4566, t4567, t4569, t4570; in func_pol() local
5691 t4567 = t128 * t4566; in func_pol()
5692 …2 * t2028 * t4516 - 0.6e1 * t2046 * t4543 + 0.3e1 * t249 * t4539 - t267 * t4567 + 0.18e2 * t4519 *… in func_pol()
7437 …e1 * t1061 * t1352 * t675 - 0.9e1 * t1099 * t1332 * t675 + 0.2e1 * t285 * t4567 * t713 + 0.18e2 * … in func_pol()
7438 …e1 * t261 * t4539 * t670 - 0.18e2 * t261 * t4543 * t5827 - 0.3e1 * t261 * t4567 * t675 - 0.3e1 * t… in func_pol()
8007 … / 0.2e1 * t3685 * t4424 + 0.9e1 / 0.2e1 * t3694 * t4424 + 0.2e1 * t713 * t4567 * t342 - 0.18e2 * … in func_pol()
|
| H A D | mgga_c_scanl.c | 257 double t4557, t4560, t4567, t4570, t4573, t4576, t4580, t4583; in func_unpol() local
2522 t4567 = t1572 * t328; in func_unpol()
4858 …766e0 * t3204 * t18160 + 0.10979019874935515226e0 * t4567 * t2720 + 0.85008516127783659766e0 * t45… in func_unpol()
5053 …t4567 * t3211 + 0.25502554838335097930e1 * t4567 * t3214 - 0.17635028716075421460e1 * t13662 * t40… in func_unpol()
5461 … - 0.25502554838335097930e1 * t4567 * t4631 + 0.33758233860356468336e1 * t13926 * t4588 - 0.455149… in func_unpol()
11209 double t4554, t4556, t4559, t4561, t4563, t4564, t4565, t4567; in func_pol() local
16126 t4567 = 0.1e1 / t1126 / t427; in func_pol()
16129 t4572 = t4567 * t4568 * t4571; in func_pol()
16203 t4705 = t70 * t4567; in func_pol()
22340 t20336 = 0.61524113149298439947e4 * t449 * t4567 * t1128 * t4571 * t1277; in func_pol()
[all …]
|
| H A D | mgga_x_m11.c | 1586 double t4525, t4529, t4533, t4537, t4541, t4549, t4553, t4567; in func_ferr() local
2619 t4567 = t145 * t943 * tau[0]; in func_ferr()
2620 … * t1634 * t4517 - 0.180000e6 * t773 * t4521 - 0.165000e6 * t314 * t4525 - 0.9840e4 * t314 * t4567; in func_ferr()
2622 …e5 * t137 * t4513 - 0.55000e5 * t137 * t4529 - 0.16400e5 / 0.3e1 * t719 * t4567 - 0.328000e6 / 0.2… in func_ferr()
2627 … * t4517 - 0.320000e6 / 0.3e1 * t307 * t4521 - 0.13120e5 / 0.3e1 * t131 * t4567 + 0.440e3 / 0.27e2… in func_ferr()
2631 …* t4521 - 0.209920e6 / 0.27e2 * t381 * t4553 - 0.13120e5 / 0.3e1 * t182 * t4567 + 0.26000e5 * t182… in func_ferr()
2632 …t4863 = -0.13120e5 / 0.3e1 * t844 * t4553 - 0.9840e4 * t386 * t4567 + 0.18200e5 * t2053 * t4494 + … in func_ferr()
2634 …e1 * t858 * t4529 - 0.55000e5 * t185 * t4529 - 0.16400e5 / 0.3e1 * t851 * t4567 - 0.328000e6 / 0.2… in func_ferr()
|
| H A D | mgga_xc_b98.c | 5639 double t4566, t4567, t4568, t4569, t4571, t4572, t4573, t4575; in func_pol() local
9749 t4567 = t4566 * t17; in func_pol()
9752 t4571 = t8 * t4567 * t4569; in func_pol()
10953 t7130 = t8 * t4567 * t7128; in func_pol()
15945 … * t348 * t5281 * t1057 + 0.15000000000000000000e1 * t5716 * t1044 + t8 * t4567 * t618 * t4568 / 0… in func_pol()
17215 …* t7139 + 0.12000000000000000000e2 * t5089 * t7139 + 0.4e1 / 0.9e1 * t8 * t4567 * t618 * t7127 + 0… in func_pol()
17383 …0000e0 * t18492 * t2532 + 0.15000000000000000000e1 * t4435 * t2524 + t8 * t4567 * t793 * t4568 / 0… in func_pol()
17675 …t29872 = t8 * t4567 * t793 * t7127 / 0.9e1 + 0.11658750000000000000e-1 * t719 * t8689 - t8 * t1173… in func_pol()
17846 … t30539) + t4419 * t898 - 0.30000000000000000000e1 * t4623 * t9128 + t8 * t4567 * t873 * t4568 / 0… in func_pol()
18255 …+ 0.3e1 * t1455 * t3034 + 0.15000000000000000000e1 * t4435 * t3017 + t8 * t4567 * t935 * t4568 / 0… in func_pol()
[all …]
|
| H A D | mgga_x_mvs.c | 2067 double t4507, t4524, t4545, t4567, t4584, t4594, t4600, t4607; in func_pol() local
4767 …t4567 = -t1444 / 0.3e1 + 0.2e1 / 0.3e1 * t1448 - 0.2e1 / 0.3e1 * t1451 - t1455 / 0.3e1 + 0.2e1 / 0… in func_pol()
4770 v4rho4[2] = t4524 + t4545 + t4567 + t4584; in func_pol()
|
| H A D | mgga_x_rtpss.c | 1589 double t4525, t4530, t4539, t4545, t4549, t4559, t4567, t4573; in func_ferr() local
2753 t4567 = t119 * t1708; in func_ferr()
2757 … * t3154 / 0.2e1 + 0.9e1 / 0.8e1 * t565 * t2065 * t1719 + 0.9e1 / 0.8e1 * t4567 * t1718 * t1731 - … in func_ferr()
2815 …9 * t2067 * t775 + 0.9e1 / 0.8e1 * t565 * t2065 * t1985 + 0.9e1 / 0.8e1 * t4567 * t1718 * t1997 - … in func_ferr()
|
| /dports/science/libint2/libint-2.7.1/include/libint2/ |
| H A D | boys.h | 1207 libint2::simd::VectorAVXDouble t4567 = horizontal_add(t4, t5, t6, t7); in interpolate_Gm() local
1245 auto tall = horizontal_add(t0123, t4567, t89ab, tcdef); in interpolate_Gm()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_wl.c | 558 double t4564, t4566, t4567, t4568, t4569, t4570, t4571, t4574; in func_pol() local
2531 t4567 = 0.40506750000000000000e-2 * t4566; in func_pol()
2534 … t4501 - t4503 + t4561 + t4563 - t4564 - 0.90015000000000000000e-2 * t4431 - t4524 - t4567 - t4569; in func_pol()
2623 …t4755 = t4697 - t4699 - t4501 + t4561 + t4563 - t4564 - t4524 - t4567 - t4569 - t4719 - 0.90015000… in func_pol()
|
| H A D | gga_x_q2d.c | 1186 double t4567, t4569, t4571, t4576, t4577, t4579, t4591, t4593; in func_pol() local
3228 t4567 = t1097 * t681; in func_pol()
3234 … t294 / 0.2048e4 - t4561 / 0.110592e6 - t186 * t4563 * t441 / 0.36864e5 + t4567 / 0.1152e4 - t4569… in func_pol()
3285 …6144e4 + t4554 / 0.442368e6 + t4556 / 0.84934656e8 - t4561 / 0.331776e6 + t4567 / 0.1728e4 - t4569… in func_pol()
3348 … t1855 * t8 / 0.2304e4 + t4822 - t4507 / 0.1327104e7 - t4517 / 0.9216e4 + t4567 / 0.3456e4 + t4576… in func_pol()
|
| H A D | gga_c_zvpbeloc.c | 2208 double t4556, t4558, t4560, t4564, t4567, t4568, t4570, t4572; in func_pol() local
5163 t4567 = t582 * t943; in func_pol()
5164 t4568 = t1393 * t4567; in func_pol()
5237 t4780 = t1532 * t4567; in func_pol()
6607 …t8040 = -t6784 + t6786 + t6788 - 0.36e2 * t952 * t4567 * t2643 + t6796 - t6798 - t6836 + t7110 + t… in func_pol()
7893 t14546 = t4567 * t297; in func_pol()
7935 …t14688 = -0.3e1 * t1398 * t4604 * t4567 - 0.18e2 * t1398 * t4612 * t4584 + 0.18e2 * t1396 * t14655… in func_pol()
8006 …t1398 * t1399 * t15194 + 0.6e1 * t1398 * t4594 * t15180 - t1398 * t5139 * t4567 - 0.2e1 * t1396 * … in func_pol()
9149 …t1398 * t5909 * t14647 - 0.2e1 * t1398 * t20351 * t1529 - t1398 * t5765 * t4567 - 0.6e1 * t1398 * … in func_pol()
9423 … t5925 * t4579 + 0.6e1 * t21308 + 0.2e1 * t1396 * t6054 - t1398 * t5925 * t4567 - 0.2e1 * t1398 * … in func_pol()
[all …]
|
| H A D | gga_x_ncap.c | 2311 double t4508, t4515, t4521, t4528, t4560, t4563, t4565, t4567; in func_pol() local
4152 t4567 = t7 * t516 * t1919; in func_pol()
4158 …t4613 = -t4567 / 0.2e1 + t4570 / 0.27e2 - t4573 / 0.6e1 - t4576 / 0.6e1 + t4579 / 0.27e2 + t3873 +… in func_pol()
4172 …/ 0.2e1 + t4292 / 0.2e1 - 0.2e1 * t4560 - 0.2e1 / 0.3e1 * t4563 - 0.2e1 * t4567 + 0.4e1 / 0.27e2 *… in func_pol()
|
| H A D | gga_c_zvpbeint.c | 2428 double t4562, t4565, t4566, t4567, t4569, t4572, t4574, t4575; in func_pol() local
5792 t4567 = t1361 * t4566; in func_pol()
5866 …64e2 * t4554 - t4558 / 0.64e2 - 0.3e1 / 0.64e2 * t4562 - 0.9e1 / 0.64e2 * t4567 - 0.3e1 / 0.32e2 *… in func_pol()
5932 t4806 = 0.9e1 / 0.32e2 * t4567; in func_pol()
6158 t5191 = 0.9e1 / 0.16e2 * t4567; in func_pol()
9564 … - t4467 - t4468 - t15512 - 0.3e1 / 0.8e1 * t4554 - t4558 / 0.8e1 - t15514 - 0.9e1 / 0.8e1 * t4567; in func_pol()
9610 … t5059 - 0.9e1 / 0.32e2 * t4554 - 0.3e1 / 0.32e2 * t4558 - 0.27e2 / 0.32e2 * t4567 + 0.6e1 * t5061; in func_pol()
9732 …059 - 0.9e1 / 0.16e2 * t4554 - 0.3e1 / 0.16e2 * t4558 - 0.27e2 / 0.16e2 * t4567 - 0.27e2 / 0.8e1 *… in func_pol()
|
| H A D | gga_c_bmk.c | 1492 double t4560, t4563, t4564, t4566, t4567, t4569, t4570, t4573; in func_pol() local
4076 t4567 = t1449 * t4566; in func_pol()
4094 …/ 0.9e1 * t4583 - 0.2e1 / 0.9e1 * t4597 - 0.2e1 * t4564 - 0.8e1 / 0.3e1 * t4567 + t4601 / 0.9e1 - … in func_pol()
4105 …7 * t4560 - 0.30988500000000000000e1 * t4564 - 0.41318000000000000000e1 * t4567 + 0.10329500000000… in func_pol()
4160 …1 * t4597 - 0.10274000000000000000e0 * t4564 - 0.13698666666666666666e0 * t4567 + 0.57077777777777… in func_pol()
|
| H A D | gga_c_op_g96.c | 818 double t4555, t4559, t4562, t4566, t4567, t4568, t4569, t4570; in func_pol() local
3026 t4567 = 0.53944279800000000000e1 * t4566; in func_pol()
3041 …6 - 0.10788855960000000000e2 * t4248 + 0.10788855960000000000e2 * t4250 - t4567 - t4569 + t4571 - … in func_pol()
3135 …00000000000e1 * t274 * t4026 * t1363 - 0.30000000000000000000e1 * t5171 - t4567 - t4569 - 0.539442… in func_pol()
|
| H A D | gga_x_ityh.c | 2623 double t4554, t4555, t4559, t4560, t4561, t4566, t4567, t4568; in func_pol() local
4677 t4567 = rho[0] * t4440; in func_pol()
4683 … t4553 * t4555 - 0.36e2 * t4561 * t233 * t4440 * t3990 - 0.36e2 * t4566 * t4567 * t4568 - 0.27e2 /… in func_pol()
5753 …228 - t65 * t6 * t12428 * t69 / 0.24e2 - t43 * t12428 * t63 / 0.2e1 + 0.72e2 * t4535 * t4567 * t63; in func_pol()
|
| H A D | gga_xc_b97.c | 1847 double t4565, t4567, t4569, t4571, t4573, t4575, t4577, t4578; in func_pol() local
4666 t4567 = t1078 * t1967; in func_pol()
4684 …1 * t4563 + 0.10000000000000000000e1 * t4565 + 0.10000000000000000000e1 * t4567 + 0.10000000000000… in func_pol()
6959 …1 * t4563 + 0.30000000000000000000e1 * t4565 + 0.30000000000000000000e1 * t4567 + 0.30000000000000… in func_pol()
7428 …1 * t4563 + 0.20000000000000000000e1 * t4565 + 0.20000000000000000000e1 * t4567 + 0.20000000000000… in func_pol()
|
| H A D | gga_x_sfat.c | 3160 double t4567, t4570, t4575, t4576, t4577, t4581, t4585, t4589; in func_pol() local
5274 t4567 = t32 * t1791; in func_pol()
5354 …3e1 * t254 * t4560 - 0.2e1 / 0.3e1 * t4564 * t256 + 0.4e1 / 0.9e1 * t48 * t4567 - 0.4e1 / 0.3e1 * … in func_pol()
6564 t11886 = t252 * t4567 * M_PI; in func_pol()
|
| H A D | gga_c_gaploc.c | 264 double t4549, t4552, t4560, t4567, t4573, t4582, t4593, t4606; in func_unpol() local
2268 t4567 = t869 * t956; in func_unpol()
2269 …78 + 0.69017266717057349418e2 * t2653 * t951 - 0.41410360030234409651e2 * t4567 * t962 - 0.4907894… in func_unpol()
2849 …t10762 = 0.10224780254378866580e1 * t444 * t2316 * t1502 - 0.69017266717057349418e1 * t4567 * t149… in func_unpol()
6310 double t4567, t4568, t4571, t4574, t4575, t4576, t4577, t4580; in func_pol() local
10487 t4567 = t1557 * t362; in func_pol()
10488 t4568 = t4567 * t481; in func_pol()
15373 …5334639871601137784e0 * t482 * t1386 * t4320 - 0.42900587942220512004e1 * t4567 * t487 * t1365 + 0… in func_pol()
15550 t16185 = t4567 * t98 * t498; in func_pol()
15613 t16711 = t4567 * t508; in func_pol()
[all …]
|
| H A D | gga_x_wpbeh.c | 18275 t4567 = t1480 * t711; in func_pol()
25685 t27935 = t7439 * t4567; in func_pol()
25688 t27946 = t7458 * t4567; in func_pol()
25694 t27969 = t7427 * t4567; in func_pol()
33696 t68557 = t6032 * t4567; in func_pol()
33701 t68588 = t18269 * t4567; in func_pol()
33703 t68598 = t18544 * t4567; in func_pol()
33743 t68995 = t6138 * t4567; in func_pol()
33778 t69456 = t18305 * t4567; in func_pol()
33804 t69790 = t6142 * t4567; in func_pol()
[all …]
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_2.c | 904 double t4540, t4551, t4567, t4574, t4577, t4579, t4582, t4584; in func_pol() local
2417 …t4567 = -t2539 / 0.12e2 - t2546 - t2548 / 0.12e2 - t2891 - t4263 / 0.6e1 - t4267 / 0.12e2 - t4276 … in func_pol()
2432 …1 * t2136 + 0.6e1 * t2138 + t4148 - t4149 + t7 * (t4458 + t4533 + t4551 + t4567 + t4574 + t4612 + … in func_pol()
|
| H A D | lda_c_pk09.c | 2511 double t4566, t4567, t4568, t4581, t4583, t4588, t4598, t4605; in func_pol() local
4876 …t4567 = -0.26666666666666666666e1 * t3005 - 0.20000000000000000000e1 * t3008 - 0.66666666666666666… in func_pol()
4877 t4568 = t4547 + t4567; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 176 double t4566, t4567, t4585, t4602, t4611, t4615, t4620, t4623; in func_unpol() local
1510 t4567 = t62 * t4566; in func_unpol()
1511 …e1 / 0.3e1 * t589 * t3456 + 0.8e1 / 0.3e1 * t584 * t390 * t4485 - 0.4e1 * t4567 * t392 - 0.8e1 * t… in func_unpol()
1892 …4 + 0.8e1 / 0.3e1 * t584 * t5812 + 0.4e1 / 0.3e1 * t196 * t5351 - 0.4e1 * t4567 * t762 - 0.4e1 / 0… in func_unpol()
2006 …1 * t2204 * t1018 - 0.2e1 * t549 * t1087 + 0.8e1 * t4460 * t965 - 0.4e1 * t4567 * t957 + t6817 + t… in func_unpol()
4274 double t4551, t4552, t4553, t4558, t4562, t4563, t4566, t4567; in func_pol() local
6530 t4567 = t2698 * t4566; in func_pol()
6540 …/ 0.3e1 * t4549 * t2660 * t4558 + 0.2e1 / 0.3e1 * t4562 * t4563 + 0.4e1 * t4567 * t4570 - 0.4e1 * … in func_pol()
7290 …t7948 = t152 * t222 * t7899 / 0.12e2 + 0.8e1 * t4539 * t7227 + 0.12e2 * t4567 * t7223 + 0.4e1 * t4… in func_pol()
|