| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_n12.c | 1157 double t3577, t3578, t3579, t3583, t3585, t3590, t3591, t3599; in func_pol() local
2627 t3591 = t51 * sigma[0]; in func_pol()
2633 …3619 * t3591 + 0.40960000000000000001e-8 * t254 * t249 - 0.17066666666666666667e-3 * t60 * t228 * … in func_pol()
2637 …3648 * t3591 + 0.40960000000000000001e-8 * t287 * t249 - 0.17066666666666666667e-3 * t84 * t228 * … in func_pol()
2641 …3678 * t3591 + 0.40960000000000000001e-8 * t307 * t249 - 0.17066666666666666667e-3 * t101 * t228 *… in func_pol()
2643 …3590 * t3591 + 0.40960000000000000001e-8 * t225 * t249 - 0.17066666666666666667e-3 * t33 * t228 * … in func_pol()
3399 …t3591 - 0.10240000000000000000e-6 * t56 * t751 * t8460 + 0.17476266666666666668e-9 * t741 * t766 +… in func_pol()
3404 …t3591 - 0.10240000000000000000e-6 * t97 * t751 * t8460 + 0.17476266666666666668e-9 * t826 * t766 +… in func_pol()
3405 …t3591 - 0.10240000000000000000e-6 * t80 * t751 * t8460 + 0.17476266666666666668e-9 * t776 * t766 +… in func_pol()
3408 …0 * t3591 - 0.10240000000000000000e-6 * t19 * t751 * t8460 + 0.17476266666666666668e-9 * t797 * t7… in func_pol()
|
| H A D | gga_c_wl.c | 517 double t3571, t3589, t3590, t3591, t3592, t3594, t3595, t3597; in func_pol() local
2135 t3591 = t55 * t1037; in func_pol()
2136 t3592 = 0.10001666666666666667e-1 * t3591; in func_pol()
2154 t3614 = 0.20003333333333333334e-1 * t3591; in func_pol()
2197 … -t3701 + 0.20003333333333333333e-1 * t3589 - 0.40006666666666666666e-1 * t3591 + 0.15002500000000… in func_pol()
2280 t3905 = 0.50008333333333333333e-2 * t3591; in func_pol()
2325 … -t3701 + 0.10001666666666666666e-1 * t3589 - 0.20003333333333333333e-1 * t3591 + t4027 + 0.150025… in func_pol()
|
| H A D | gga_x_lg93.c | 1052 double t3583, t3586, t3591, t3592, t3595, t3603, t3609, t3624; in func_pol() local
3015 t3591 = t7 * t1199 * t237; in func_pol()
3016 t3592 = t3591 * t1399; in func_pol()
3084 t4104 = t3591 * t1587; in func_pol()
3260 t5279 = 0.34686111111111111112e-11 * t3591 * t1911; in func_pol()
3269 t5324 = 0.92496296296296296294e-11 * t3591 * t1882; in func_pol()
3315 t5583 = t3591 * t2028; in func_pol()
3327 t5652 = t3591 * t2086; in func_pol()
3433 t6515 = t3591 * t2199; in func_pol()
3485 t6769 = t3591 * t2254; in func_pol()
|
| H A D | gga_c_p86.c | 1001 double t3589, t3591, t3593, t3598, t3601, t3602, t3605, t3608; in func_pol() local
2737 t3591 = t1321 * t442; in func_pol()
2739 …* t3587 + 0.82602477864757812500e-7 * t3589 + 0.12390371679713671875e-6 * t3591 - 0.82602477864757… in func_pol()
2749 …2178125000000000e-3 * t3585 + t3608 + t3609 + 0.24780743359427343750e-6 * t3591 - t3611 + t3450 + … in func_pol()
2762 …0435625000000000e-2 * t3585 + t3622 + t3623 + 0.49561486718854687500e-6 * t3591 - t3625 + t3517 + … in func_pol()
|
| H A D | gga_x_ft97.c | 1087 double t3591, t3592, t3594, t3661, t3668, t3690, t3699, t3719; in func_pol() local
2440 t3591 = t3265 * t708 / 0.6e1; in func_pol()
2454 …v4rho2sigma2[0] = -t3591 - 0.4e1 / 0.3e1 * t3592 - t3594 - t209 * t390 * t707 * t284 / 0.6e1 - t20… in func_pol()
2475 …v4rho2sigma2[6] = -t3591 - 0.2e1 / 0.3e1 * t3592 - t3594 / 0.2e1 - 0.2e1 / 0.3e1 * t3803 - t1399 *… in func_pol()
2495 …v4rho2sigma2[12] = -t3591 - 0.4e1 / 0.3e1 * t3803 - t209 * t390 * t707 * t439 / 0.6e1 - t209 * t52… in func_pol()
|
| H A D | gga_c_tca.c | 931 double t3571, t3575, t3578, t3581, t3587, t3589, t3591, t3593; in func_pol() local
2758 t3591 = 0.13930446375635527841e-4 * t3543; in func_pol()
2761 …v4sigma4[1] = t3589 - 0.18109580288326186193e-4 * t3538 + t3591 + 0.29318287288448777610e-2 * t354… in func_pol()
2784 …v4sigma4[4] = t3589 - t3613 + t3591 + t3614 - t3593 + t3615 + t3616 - t3617 + t3618 + 0.7608238525… in func_pol()
|
| H A D | gga_x_pbetrans.c | 1364 double t3549, t3552, t3591, t3594, t3600, t3612, t3644, t3656; in func_pol() local
2694 t3591 = t3382 * t88 * t2395; in func_pol()
2696 …477366255144e2 * t461 * t3399 * t467 - 0.26105679012345679012e1 * t3381 * t3591 + 0.39158518518518… in func_pol()
3075 …00000000001e-1 * t478 * t2165 * t482 + 0.13766666666666666667e0 * t5568 * t3591 - 0.20650000000000… in func_pol()
3150 …00000000000e0 * t173 * t732 * t1962 - 0.51625000000000000000e-1 * t6001 * t3591 + 0.77437500000000… in func_pol()
|
| H A D | gga_xc_b97.c | 1784 double t3580, t3581, t3584, t3587, t3589, t3590, t3591, t3593; in func_pol() local
4164 t3591 = t1390 * t518; in func_pol()
4191 …t3630 = -t3590 - 0.22831111111111111110e-1 * t3591 + 0.11415555555555555555e-1 * t3593 - 0.3424666… in func_pol()
4243 …3 + 0.26472937500000000000e1 * t3738 * t3733 - 0.68863333333333333332e0 * t3591 + 0.34431666666666… in func_pol()
4248 …t3768 = -t3757 - 0.4e1 / 0.9e1 * t3591 + 0.2e1 / 0.9e1 * t3593 - 0.2e1 / 0.3e1 * t3595 + t3597 / 0… in func_pol()
4638 …t4480 = -t3757 - 0.8e1 / 0.27e2 * t3591 + 0.2e1 / 0.27e2 * t3593 - 0.2e1 / 0.9e1 * t3595 + t3597 /… in func_pol()
4658 …7 - 0.17648625000000000000e1 * t1929 * t1119 - 0.45908888888888888888e0 * t3591 + 0.11477222222222… in func_pol()
4816 …t4875 = -t3590 - 0.15220740740740740740e-1 * t3591 + 0.38051851851851851851e-2 * t3593 - 0.1141555… in func_pol()
5144 …t5686 = -t3757 - 0.4e1 / 0.27e2 * t3591 - 0.8e1 / 0.27e2 * t4435 + t4438 - t4440 - 0.4e1 / 0.9e1 *… in func_pol()
5162 …1 * t5636 - 0.11577222222222222222e0 * t3711 - 0.22954444444444444444e0 * t3591 - t3756 - 0.231544… in func_pol()
[all …]
|
| H A D | gga_x_sfat.c | 154 double t3576, t3580, t3584, t3588, t3591, t3592, t3599, t3604; in func_unpol() local
1222 t3591 = t1048 * t97; in func_unpol()
1225 …* t3580 - 0.3e1 * t616 * t3584 + 0.4e1 / 0.3e1 * t628 * t3588 - 0.270e3 * t3591 * t3592 - 0.4e1 / … in func_unpol()
1384 …4855 + t4911 + t4967 + t5299 + t5348 + t5393 + t5441 + t5499) - 0.360e3 * t3591 * t5332 + 0.8e1 / … in func_unpol()
1396 …07 * t2346 + 0.4e1 / 0.9e1 * t44 * t168 * t2498 + 0.30e2 * t3064 * t2326 - 0.270e3 * t3591 * t5733; in func_unpol()
1637 double t3536, t3547, t3554, t3563, t3569, t3573, t3591, t3594; in func_ferr() local
2659 t3591 = t1088 * t208; in func_ferr()
2662 … * t707 / 0.6e1 - 0.7e1 / 0.54e2 * t38 * t331 * t278 + 0.405e3 / 0.16e2 * t3591 * t1450 - 0.135e3 … in func_ferr()
2771 …6e2 * t1541 * t4558 + 0.135e3 / 0.8e1 * t4856 * t1450 + 0.135e3 / 0.8e1 * t3591 * t1865 + 0.135e3 … in func_ferr()
|
| H A D | gga_c_pbe.c | 1551 double t3577, t3578, t3582, t3583, t3586, t3587, t3590, t3591; in func_pol() local
3705 t3591 = t1108 * t3590; in func_pol()
3711 …- t3569 * t397 - 0.6e1 * t395 * t3578 + 0.4e1 * t395 * t3587 + 0.2e1 * t395 * t3591 - t395 * t3604; in func_pol()
5430 …* t3376 - 0.4e1 * t3150 * t3396 * t3362 - t10805 * t397 + 0.2e1 * t1106 * t3591 - 0.2e1 * t3336 * … in func_pol()
5517 … t3396 * t3582 - t11472 * t397 - 0.18e2 * t1173 * t3578 + 0.6e1 * t1173 * t3591 - 0.6e1 * t3349 * … in func_pol()
5913 …4e3 - t13245 + 0.24e2 * t12246 * t1254 * t3582 + t13248 + 0.4e1 * t1251 * t3591 + t13539 / 0.384e3… in func_pol()
|
| H A D | gga_c_op_b88.c | 820 double t3587, t3588, t3591, t3594, t3601, t3604, t3607, t3610; in func_pol() local
2574 t3591 = t155 * t978; in func_pol()
2604 …458688888888888889e-1 * t841 * t3588 - 0.66688033333333333333e-1 * t207 * t3591 + 0.33344016666666… in func_pol()
4235 t13332 = t551 * t3591; in func_pol()
4238 …58688888888888889e-1 * t2961 * t3588 - 0.66688033333333333333e-1 * t554 * t3591 + 0.33344016666666… in func_pol()
4392 …917377777777777778e-1 * t3324 * t3588 - 0.13337606666666666667e0 * t706 * t3591 - 0.13337606666666… in func_pol()
|
| H A D | gga_x_q2d.c | 1171 double t3581, t3584, t3591, t3598, t3620, t3626, t3627, t3634; in func_pol() local
3101 …t3591 = -t3541 / 0.3e1 - t332 * t3148 / 0.3e1 + t3546 / 0.27e2 + 0.2e1 / 0.9e1 * t3549 + t3552 / 0… in func_pol()
3120 … t1421 / 0.432e3 + t1425 / 0.32e2 + t9 * (t3455 + t3491 + t3510 + t3536 + t3591 + t3640 + t3683 + … in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_3.c | 917 double t3586, t3588, t3591, t3593, t3620, t3668, t3672, t3674; in func_pol() local
2588 t3591 = 0.10363566666666666667e-1 * t170 * t171 * t1430; in func_pol()
2597 … + 0.15610188163490359988e-4 * t1321 * t34 * t1 * t2757 - t3586 - t3588 - t3591 - t3593 - t3672 - … in func_pol()
2720 …t4602 = t3588 + t3591 - t4585 / 0.6e1 - t4587 / 0.2e1 - t4589 / 0.2e1 + 0.6e1 * t4592 + 0.16e2 * t… in func_pol()
2933 …t5104 = t3591 - t4585 / 0.8e1 - 0.3e1 / 0.8e1 * t4587 - 0.3e1 / 0.8e1 * t4589 + 0.3e1 * t4592 - 0.… in func_pol()
3063 …12e2 + t5576 / 0.12e2 + t5579 / 0.12e2 + t5583 / 0.12e2 + t3586 + t3588 + t3591 - t4585 / 0.12e2 -… in func_pol()
3109 …t5982 = t5574 / 0.4e1 + t5576 / 0.4e1 + t5579 / 0.8e1 + t5583 / 0.8e1 + t3586 + t3588 + t3591 - t4… in func_pol()
3146 …1 + t5564 / 0.2e1 + t5572 + t5574 / 0.2e1 + t5576 / 0.2e1 + t3586 + t3588 + t3591 + 0.72e2 * t5588; in func_pol()
|
| H A D | lda_x_erf.c | 539 double t3591, t3595, t3599, t3603, t3610, t3617, t3621, t3622; in func_pol() local
2008 t3591 = t308 * t1031; in func_pol()
2032 …- 0.4e1 / 0.81e2 * t2486 - t2811 / 0.9e1 + 0.4e1 / 0.27e2 * t136 * t426 * t3591 - t136 * t138 * t3… in func_pol()
2963 …243e3 * t4631 - t9068 / 0.27e2 + t4635 - 0.28e2 / 0.81e2 * t136 * t1683 * t3591 * t120 + 0.16e2 / … in func_pol()
2964 t9141 = t136 * t1677 * t3591; in func_pol()
|
| H A D | lda_c_ml1.c | 415 double t3574, t3576, t3577, t3582, t3589, t3590, t3591, t3594; in func_pol() local
2100 t3591 = t34 * t3590; in func_pol()
2105 …84433621260203302392e0 * t143 * t3553 - 0.28144540420067767464e0 * t143 * t3591 - 0.28144540420067… in func_pol()
4115 …87560792417988609888e0 * t789 * t8258 - 0.28144540420067767464e0 * t428 * t3591 + 0.28144540420067… in func_pol()
4291 …7526053893423689952e0 * t485 * t14033 - 0.11257816168027106986e1 * t786 * t3591 + 0.11257816168027… in func_pol()
|
| H A D | lda_xc_bn05.c | 933 double t3583, t3584, t3587, t3591, t3597, t3600, t3603, t3606; in func_pol() local
2672 t3591 = t1579 * t225; in func_pol()
2680 …59 - t2800 + t2802 + t2811 - t2813 + t3587 * t46 + 0.2e1 * t451 * t1192 + t3591 * t46 - t48 * t51 … in func_pol()
4256 …87 * t441 + 0.4e1 * t1194 * t1554 + 0.4e1 * t451 * t440 * t1192 + 0.2e1 * t3591 * t441 + 0.2e1 * t… in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mbeef.c | 16773 t3641 = t67 * t3591; in func_ferr()
16776 t3656 = t120 * t3591; in func_ferr()
16777 t3659 = t28 * t3591; in func_ferr()
16786 t3693 = t154 * t3591; in func_ferr()
16788 t3697 = t112 * t3591; in func_ferr()
16793 t3720 = t151 * t3591; in func_ferr()
16860 t4179 = t3591 * t78; in func_ferr()
18611 t11152 = t3591 * t42; in func_ferr()
19557 t15761 = t89 * t3591; in func_ferr()
22922 t32175 = t3591 * t41; in func_ferr()
[all …]
|
| H A D | hyb_mgga_x_js18.c | 5836 t3591 = t572 * t887; in func_ferr()
7038 t9616 = t3591 * t32; in func_ferr()
11574 t3591 = t3539 * t86; in func_pol()
14974 t15717 = t13834 * t3591; in func_pol()
19129 t35254 = t3591 * t2810; in func_pol()
19599 t39692 = t3591 * t3534; in func_pol()
20375 t46344 = t41399 * t3591; in func_pol()
20594 t48204 = t43873 * t3591; in func_pol()
21812 t58776 = t18466 * t3591; in func_pol()
21821 t58815 = t18437 * t3591; in func_pol()
[all …]
|
| H A D | mgga_xc_b97mv.c | 6905 t3616 = t307 * t3591; in func_pol()
10058 t11044 = t306 * t3591; in func_pol()
10062 t11073 = t287 * t3591; in func_pol()
10085 t11164 = t3591 * t651; in func_pol()
14684 t34893 = t3591 * t304; in func_pol()
14717 t35141 = t640 * t3591; in func_pol()
14994 t36940 = t3591 * t873; in func_pol()
15001 t36959 = t3591 * t876; in func_pol()
15765 t42551 = t3591 * t75; in func_pol()
15829 t43107 = t3591 * t26; in func_pol()
[all …]
|
| H A D | mgga_x_gvt4.c | 1375 double t3527, t3538, t3548, t3561, t3590, t3591, t3593, t3630; in func_pol() local
3278 t3591 = t104 * t1491; in func_pol()
3286 …v4rho2sigma2[0] = t3590 + 0.32e2 / 0.9e1 * t3591 + 0.8e1 / 0.3e1 * t3593 + 0.4e1 / 0.9e1 * t1137 *… in func_pol()
3307 …v4rho2sigma2[6] = t3590 + 0.16e2 / 0.9e1 * t3591 + 0.4e1 / 0.3e1 * t3593 + 0.16e2 / 0.9e1 * t3675 … in func_pol()
|
| H A D | mgga_x_m08.c | 2793 double t3563, t3571, t3572, t3582, t3585, t3588, t3591, t3598; in func_pol() local
4287 t3591 = t1395 * t1738; in func_pol()
4291 …e1 * t206 * t3591 - 0.11200e5 / 0.9e1 * t1399 * t3588 - 0.25600e5 / 0.9e1 * t530 * t3591 - 0.1600e… in func_pol()
4362 …t3894 = -0.25600e5 / 0.9e1 * t604 * t3591 - 0.1600e4 * t250 * t3598 - 0.1600e4 * t1640 * t3591 - 0… in func_pol()
4369 …9 * t3744 - 0.19600e5 / 0.9e1 * t599 * t3588 - 0.11200e5 / 0.9e1 * t248 * t3591 - 0.11200e5 / 0.9e… in func_pol()
|
| H A D | mgga_xc_b98.c | 2120 t3591 = t1339 / t78 / t1471; in func_unpol()
2259 t4730 = t3591 * t10; in func_unpol()
2428 t5868 = t3591 * t9; in func_unpol()
2677 t7603 = t3591 * t3019 * t146; in func_unpol()
2727 t7885 = t3591 * t3143 * t146; in func_unpol()
2789 t8308 = t3591 * t3319 * t146; in func_unpol()
2867 t8850 = t3591 * t8802 * t8693; in func_unpol()
2911 t9009 = t3591 * t8961 * t8693; in func_unpol()
2958 t9223 = t3591 * t9175 * t8693; in func_unpol()
3007 t9495 = t3591 * t3560 * t8693; in func_unpol()
[all …]
|
| H A D | mgga_x_tau_hcth.c | 1436 double t3542, t3562, t3572, t3591, t3596, t3631, t3661, t3668; in func_pol() local
3254 …t3591 = -t8 * t272 * t1775 * t273 / 0.2e1 + 0.2e1 / 0.3e1 * t3367 + t3370 / 0.3e1 + t3373 / 0.3e1 … in func_pol()
3260 …e1 - t1621 + t1625 / 0.3e1 - t1629 / 0.2e1 - t3055 - t3057 + t10 * (t3572 + t3591 + t3631 + t3677); in func_pol()
|
| H A D | mgga_x_gx.c | 2467 double t3570, t3575, t3579, t3581, t3587, t3589, t3591, t3593; in func_pol() local
4691 t3591 = t516 * t417; in func_pol()
4692 t3593 = t8 * t3591 * t519; in func_pol()
4803 t4157 = t8 * t3591 * t599; in func_pol()
|
| H A D | mgga_x_msb.c | 3103 double t3586, t3589, t3591, t3593, t3595, t3598, t3599, t3602; in func_pol() local
5096 t3591 = t347 * t1099; in func_pol()
5106 …249 * t3586 + 0.3e1 * t249 * t3595 - t267 * t3570 - t267 * t3589 - t267 * t3591 - t267 * t3593 - 0… in func_pol()
6587 …t3591 * t675 - 0.6e1 * t261 * t3593 * t675 + 0.12e2 * t261 * t3595 * t670 + 0.4e1 * t285 * t3570 *… in func_pol()
7022 …1 * t1060 - 0.21e2 / 0.16e2 * t249 * t128 * t1935 * t111 + 0.4e1 * t713 * t3591 * t342 + 0.4e1 * t… in func_pol()
|