| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th1.c | 561 double t2643, t2649, t2658, t2688, t2703, t2720, t2722, t2725; in func_pol() local
1578 t2643 = t2335 * t289; in func_pol()
1579 …t2649 = -0.128e3 / 0.9e1 * t2643 + 0.80e2 / 0.9e1 * t2338 * t2622 + 0.16e2 / 0.3e1 * t969 * t480 -… in func_pol()
1583 … - 0.32e2 / 0.9e1 * t76 * t2643 - 0.32e2 / 0.9e1 * t97 * t2643 - 0.32e2 / 0.9e1 * t102 * t2643 - 0… in func_pol()
2297 …t2643 - 0.32e2 / 0.9e1 * t102 * t6123 - 0.128e3 / 0.9e1 * t304 * t2643 - 0.32e2 / 0.9e1 * t107 * t… in func_pol()
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| H A D | gga_x_g96.c | 463 double t2643, t2644, t2649, t2650, t2655, t2656, t2698, t2718; in func_pol() local
1655 t2643 = t38 * t959 / 0.2192e4; in func_pol()
1662 …v4rhosigma3[9] = t2643 + t2337 * t2644 * t79 / 0.2192e4 + t2649 + 0.3e1 / 0.1096e4 * t906 * t2650 … in func_pol()
1692 …v4rhosigma3[19] = t2643 + t2337 * t2644 * t96 / 0.2192e4 + 0.3e1 / 0.4384e4 * t117 * t1921 * t339 … in func_pol()
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| H A D | gga_x_bpccac.c | 1452 double t2614, t2627, t2629, t2643, t2649, t2652, t2655, t2658; in func_pol() local
2746 t2643 = 0.1e1 / t100 / t268; in func_pol()
2751 …419724708283e-1 * t989 * t124 * t653 + 0.37784718670602984081e-3 * t350 * t2643 * t1550 - 0.3e1 / … in func_pol()
2961 t3815 = t116 * t2643; in func_pol()
2970 t3856 = sigma[2] * t2643; in func_pol()
2977 …9e1 * t675 * t1640 - 0.13664e5 / 0.81e2 * t629 * t2643 * t632 * t109 + 0.6832e4 / 0.81e2 * t643 * … in func_pol()
3355 t6152 = t986 * t2643; in func_pol()
3361 …t6232 = 0.41310769678898833132e-1 * t2574 * t2643 * t1533 - 0.20655384839449416566e-1 * t2579 * t1… in func_pol()
3364 …9449416565e-1 * t2652 * t994 * t653 - 0.41310769678898833132e-1 * t2569 * t2643 * t4006 + t6232 - … in func_pol()
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| H A D | gga_c_w94.c | 568 double t2635, t2640, t2643, t2645, t2650, t2654, t2663, t2668; in func_pol() local
1708 t2643 = t272 * t796; in func_pol()
1709 …49 - 0.5e1 / 0.6e1 * t2450 - t2455 - t2458 + t2460 - t2463 - t2466 + t2470 - 0.5e1 / 0.6e1 * t2643; in func_pol()
1739 …t350 * t728 * t460 - t2449 - t2455 - t2458 + t2460 - t2463 - t2466 + t2470 - 0.5e1 / 0.3e1 * t2643; in func_pol()
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| H A D | gga_x_mpbe.c | 794 double t2556, t2561, t2580, t2588, t2643, t2647, t2648, t2654; in func_pol() local
1841 t2643 = t92 / t78 / t225; in func_pol()
1850 …t2643 * t217 + 0.2563e4 / 0.1458e4 * t526 * t2648 * t372 - 0.49e2 / 0.729e3 * t368 * t2654 * t1200… in func_pol()
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| H A D | gga_x_htbs.c | 1168 double t2604, t2609, t2623, t2632, t2634, t2635, t2640, t2643; in func_pol() local
2345 t2643 = t7 * t453 * t556; in func_pol()
2351 ….2e1 / 0.3e1 * t2476 - 0.3e1 / 0.8e1 * t7 * t17 * t2635 - t2640 / 0.2e1 + t2643 / 0.2e1 - 0.5e1 / … in func_pol()
2388 …t2845 = -t2640 / 0.8e1 + t2643 / 0.4e1 - 0.5e1 / 0.12e2 * t2646 - 0.3e1 / 0.2e1 * t7 * t599 * t238… in func_pol()
2423 …* t1321 * t1300 * t609 * t8 + 0.4e1 / 0.9e1 * t1306 * t1315 * t586 * t8 + t2643 / 0.12e2 - 0.5e1 /… in func_pol()
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| H A D | gga_c_wl.c | 484 double t2628, t2629, t2630, t2631, t2632, t2633, t2640, t2643; in func_pol() local
1848 t2643 = 0.10001666666666666667e-1 * t2395; in func_pol()
1854 …t2666 = -0.27000000000000000000e1 * t2389 - 0.24000000000000000000e1 * t2392 + t2643 + t2403 + t26… in func_pol()
1913 …t2865 = t2629 + t2631 - t2633 + t2643 + 0.30000000000000000000e0 * t126 * t99 * t81 * t137 - t2850… in func_pol()
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| H A D | gga_x_sogga11.c | 1465 double t2633, t2635, t2642, t2643, t2645, t2653, t2672, t2696; in func_pol() local
2706 t2643 = t381 * t2565; in func_pol()
2707 t2645 = t407 * t2643 * t55; in func_pol()
2708 t2653 = t407 * t2643 * t387; in func_pol()
2709 t2672 = t407 * t2643; in func_pol()
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| H A D | gga_k_apbeint.c | 761 double t2565, t2587, t2603, t2613, t2618, t2642, t2643, t2648; in func_pol() local
1869 t2643 = t420 * t420; in func_pol()
1871 …4 / 0.243e3 * t73 * t57 * t2587) - 0.36e2 / 0.5e1 * t164 * t104 * t2642 * t2643 - 0.9e1 / 0.5e1 * … in func_pol()
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| H A D | gga_x_lg93.c | 1031 double t2602, t2603, t2606, t2609, t2612, t2617, t2624, t2643; in func_pol() local
2846 t2643 = t211 * t983 * t464; in func_pol()
2854 …5 / t190 + 0.10332004681120687083e-3 * t71 / t72 / t37) + 0.2e1 / 0.3e1 * t2643 - 0.2e1 / 0.3e1 * … in func_pol()
2940 …+ 0.62435000000000000001e-2 * t2606 - 0.31217500000000000000e-2 * t2609 + t2643 / 0.3e1 - t2646 / … in func_pol()
2999 …- 0.69372222222222222223e-2 * t2603 + 0.20811666666666666667e-2 * t2606 + t2643 / 0.9e1 + t2667 / … in func_pol()
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| H A D | gga_x_pbetrans.c | 1345 double t2622, t2636, t2643, t2648, t2659, t2660, t2663, t2672; in func_pol() local
2530 t2643 = t384 * t1013 * t969; in func_pol()
2531 …3e1 * t2636 - 0.2e1 / 0.3e1 * t407 * t408 * t948 * t148 - 0.2e1 / 0.3e1 * t2643 - 0.2e1 * t384 * t… in func_pol()
2576 … t1036 / 0.2e1 - t384 * t385 * t160 * t935 / 0.6e1 + t2618 + t2622 - t2636 / 0.6e1 - t2643 / 0.6e1; in func_pol()
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| H A D | gga_k_meyer.c | 1327 double t2617, t2623, t2626, t2628, t2632, t2639, t2643, t2646; in func_pol() local
2559 t2643 = t6 * t63 * t1079 * t100; in func_pol()
2567 …t2676 = -0.2e1 * t2639 + 0.2e1 * t2643 + 0.4e1 / 0.45e2 * t2646 + t2448 / 0.5e1 - t2451 / 0.5e1 + … in func_pol()
2611 …t2903 = 0.2e1 / 0.3e1 * t2639 - 0.2e1 / 0.3e1 * t2643 + 0.8e1 / 0.45e2 * t2646 - t2451 / 0.15e2 - … in func_pol()
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| H A D | gga_c_p86.c | 955 double t2618, t2630, t2643, t2652, t2662, t2668, t2673, t2679; in func_pol() local
2310 …t2643 = -0.3e1 / 0.2e1 * t1763 - 0.3e1 / 0.2e1 * t1767 - 0.9e1 / 0.2e1 * t2087 + t2091 - t2105 + t… in func_pol()
2319 …045 + 0.3e1 * t1068 + t1140 + t7 * (t2594 + t2605 + t2609 + t2618 + t2630 + t2643 + t2668 + t2721); in func_pol()
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| H A D | gga_c_op_pbe.c | 788 double t2643, t2644, t2648, t2652, t2655, t2657, t2658, t2659; in func_pol() local
2326 t2643 = t1560 * sigma[0]; in func_pol()
2327 t2644 = t2636 * t686 * t2643; in func_pol()
2329 t2652 = t2627 * t263 * t2643; in func_pol()
3834 …t2643 + 0.81911304559081863714e-7 * t9070 - 0.30716739209655698892e-6 * t1551 * t1553 * t2638 + 0.… in func_pol()
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| H A D | gga_c_zvpbeloc.c | 2109 double t2635, t2636, t2637, t2638, t2639, t2640, t2642, t2643; in func_pol() local
4365 t2643 = t389 * t297; in func_pol()
4377 …t2658 = -0.6e1 * t952 * t979 * t2643 + t1885 - t2134 + t2138 + t2142 + t2325 - t2327 + t2634 - t26… in func_pol()
6607 …t8040 = -t6784 + t6786 + t6788 - 0.36e2 * t952 * t4567 * t2643 + t6796 - t6798 - t6836 + t7110 + t… in func_pol()
6996 …+ t8412 + t9756 + 0.18e2 * t1024 * t3228 * t614 - 0.18e2 * t952 * t3243 * t2643 + 0.3e1 * t952 * t… in func_pol()
7028 …t9896 = 0.6e1 * t107 * t3247 * t1264 + 0.12e2 * t952 * t3812 * t2643 + t6756 + t6760 - t6763 + t67… in func_pol()
7302 …t2643 - 0.12e2 * t952 * t979 * t1041 * t389 + 0.12e2 * t107 * t947 * t10155 + 0.3e1 * t107 * t291 … in func_pol()
7891 t14540 = t14538 * t1779 * t2643; in func_pol()
7977 t15071 = t14538 * t4772 * t2643; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mn12.c | 127 double t2631, t2633, t2634, t2638, t2639, t2643, t2646, t2648; in func_unpol() local
1074 t2643 = t1470 * t10; in func_unpol()
3690 double t2631, t2640, t2642, t2643, t2650, t2657, t2668, t2679; in func_pol() local
5204 t2643 = t2642 * t286; in func_pol()
5216 …1333333333333333334e-1 * t864 * t928 - 0.38400000000000000001e-3 * t867 * t2643 - 0.40e2 / 0.9e1 *… in func_pol()
5226 t2739 = t2643 * t318; in func_pol()
5227 …111111111111111112e-1 * t261 * t2729 + 0.54044444444444444444e-3 * t280 * t2643 + 0.4608e-5 * t296… in func_pol()
5230 t2774 = t2643 * t348; in func_pol()
6529 …331851851851851853e-2 * t867 * t7178 + 0.16213333333333333333e-2 * t890 * t2643 - 0.6e1 * t6872 * … in func_pol()
6992 …t2643 - 0.100e3 / 0.3e1 * t2785 * t9838 - 0.50e2 / 0.3e1 * t9841 * t9838 - 0.21333333333333333334e… in func_pol()
[all …]
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| H A D | mgga_c_m06l.c | 1706 t2643 = t299 * t490; in func_unpol()
1707 t2644 = t1372 * t2643; in func_unpol()
1724 t2674 = t1335 * t2643; in func_unpol()
1727 t2679 = t1352 * t2643; in func_unpol()
4776 t2643 = t1409 * t2630; in func_ferr()
8729 t2643 = t24 * t2498; in func_pol()
8730 t2644 = t2643 * t470; in func_pol()
11588 t7733 = t2643 * t2100; in func_pol()
11691 t7946 = t2643 * t2140; in func_pol()
13652 t11561 = t2643 * t3548; in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 2334 t2643 = 0.1e1 / t2642; in func_ferr()
2335 t2644 = t1536 * t2643; in func_ferr()
2484 t3352 = t1586 * t2643; in func_ferr()
2485 t3355 = t1590 * t2643; in func_ferr()
2486 t3358 = t1608 * t2643; in func_ferr()
2487 t3361 = t1619 * t2643; in func_ferr()
2488 t3368 = t1647 * t2643; in func_ferr()
2489 t3373 = t1601 * t2643; in func_ferr()
2490 t3382 = t1594 * t2643; in func_ferr()
2497 t3432 = t1643 * t2643; in func_ferr()
[all …]
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| H A D | mgga_x_gx.c | 126 double t2620, t2627, t2632, t2643, t2646, t2653, t2656, t2659; in func_unpol() local
1060 t2643 = t1278 * t122; in func_unpol()
1068 …6 - 0.25e2 / 0.27e2 * t1229 + 0.325e3 / 0.486e3 * t1232 + 0.5e1 / 0.9e1 * t2643 * t84 - 0.5e1 / 0.… in func_unpol()
1138 t3036 = t2643 * t10; in func_unpol()
2427 double t2629, t2631, t2633, t2636, t2638, t2639, t2641, t2643; in func_pol() local
4000 t2643 = t1736 * t1026; in func_pol()
4003 … 0.25e2 / 0.324e3 * t2639 + 0.10e2 / 0.27e2 * t2641 + 0.25e2 / 0.5184e4 * t2643 + 0.125e3 / 0.7776… in func_pol()
5371 …t6722 = -0.50e2 / 0.27e2 * t2636 + 0.200e3 / 0.81e2 * t2641 + 0.325e3 / 0.972e3 * t2643 + 0.1625e4… in func_pol()
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| H A D | mgga_x_mbeefvdw.c | 10398 t2643 = t31 * t80; in func_ferr()
10399 t2644 = t2643 * t19; in func_ferr()
10647 t3353 = t2643 * t3231; in func_ferr()
10912 t4339 = t2643 * t4078; in func_ferr()
11106 t5066 = t2643 * t1649; in func_ferr()
11386 t5955 = t2643 * t266; in func_ferr()
11393 t5967 = t2643 * t1915; in func_ferr()
11544 t6515 = t2643 * t2134; in func_ferr()
12407 t9609 = t255 * t2643; in func_ferr()
12697 t10486 = t2643 * t357; in func_ferr()
[all …]
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| H A D | mgga_x_m06l.c | 2813 double t2631, t2633, t2636, t2637, t2639, t2641, t2642, t2643; in func_pol() local
4168 t2643 = -t2254; in func_pol()
4169 t2644 = t150 * t2643; in func_pol()
5493 …t5547 = -0.2e1 / 0.3e1 * t5470 - 0.2e1 / 0.3e1 * t5473 - 0.2e1 / 0.3e1 * t1086 * t1087 * t2643 * t… in func_pol()
5597 …1 * t5563 - t8 * t793 * t150 * t5565 / 0.2e1 - 0.2e1 * t8 * t266 * t414 * t2643 + t8 * t266 * t150… in func_pol()
5630 … / 0.6e1 * t6234 - t1086 * t2712 * t2716 / 0.2e1 - t1086 * t1087 * t431 * t2643 / 0.6e1 - t1086 * … in func_pol()
5828 …2e1 - 0.3e1 / 0.2e1 * t581 * t1402 * t1454 * t809 - t581 * t1402 * t602 * t2643 / 0.2e1 - t581 * t… in func_pol()
5996 …v4rho3tau[0] = -t581 * t1402 * t705 * t2643 / 0.2e1 - 0.3e1 / 0.8e1 * t581 * t582 * (t8065 + t8485… in func_pol()
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| H A D | mgga_x_m11_l.c | 2204 double t2643, t2646, t2647, t2650, t2651, t2652, t2660, t2661; in func_ferr() local
3003 t2643 = t2642 * t2630; in func_ferr()
3014 …e6 / 0.9e1 * t398 * t2643 + 0.55000e5 / 0.9e1 * t142 * t2647 + 0.13750e5 / 0.3e1 * t2650 * t2652 +… in func_ferr()
3048 …4 * t1000 * t2696 + 0.11250e5 * t391 * t2652 + 0.13750e5 / 0.3e1 * t136 * t2643 + 0.500e3 * t348 *… in func_ferr()
3078 …3750e5 / 0.3e1 * t184 * t2643 + 0.10000e5 / 0.3e1 * t2949 * t2696 + 0.12500e5 * t1163 * t2652 + 0.… in func_ferr()
3084 … t2676 + 0.13750e5 / 0.3e1 * t3005 * t2652 + 0.151250e6 / 0.9e1 * t1170 * t2643 + 0.60500e5 / 0.3e… in func_ferr()
3111 …4 * t1319 * t2696 + 0.11250e5 * t535 * t2652 + 0.13750e5 / 0.3e1 * t225 * t2643 + 0.10000e5 / 0.3e… in func_ferr()
3116 …e6 / 0.9e1 * t540 * t2643 + 0.55000e5 / 0.9e1 * t228 * t2647 + 0.13750e5 / 0.3e1 * t3373 * t2652 +… in func_ferr()
3125 … t2861 + 0.13750e5 / 0.3e1 * t3451 * t2652 + 0.151250e6 / 0.9e1 * t1475 * t2643 + 0.60500e5 / 0.3e… in func_ferr()
3135 …4 * t1510 * t2696 + 0.11250e5 * t597 * t2652 + 0.13750e5 / 0.3e1 * t261 * t2643 + 0.250e3 / 0.9e1 … in func_ferr()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_3.c | 889 double t2642, t2643, t2644, t2645, t2646, t2647, t2649, t2650; in func_pol() local
2376 t2643 = t112 * t2642; in func_pol()
2377 t2644 = t2643 / 0.24e2; in func_pol()
3152 …144e3 * t2314 + 0.384e3 * t2316 + t2708 - t2618 / 0.6e1 - t2621 / 0.2e1 - t2643 / 0.6e1 - t2646 / … in func_pol()
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| H A D | lda_x_erf.c | 504 double t2639, t2641, t2643, t2645, t2647, t2649, t2651, t2653; in func_pol() local
1724 t2643 = t877 * t202; in func_pol()
1725 t2645 = t115 * t547 * t2643; in func_pol()
2468 t5701 = t115 * t254 * t2643; in func_pol()
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| H A D | lda_c_pk09.c | 144 double t2637, t2642, t2643, t2646, t2648, t2651, t2654, t2655; in func_unpol() local
1128 t2643 = 0.1e1 / t2642; in func_unpol()
1178 …4 * t319 * t1106 * t85 * t122 * t2637 - 0.21324527244551553650e2 * t373 * t2643 * t1106 * t2648 - … in func_unpol()
1199 t3072 = t2643 * t263 * t9 * t2648; in func_unpol()
1275 t3738 = t2643 * t408 * t9 * t3737; in func_unpol()
1335 …99 + 0.21600980567784757866e2 * t4060 - 0.21324527244551553650e2 * t511 * t2643 * t1558 * t3737 - … in func_unpol()
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