| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_bmk.c | 1733 double t12466, t12477, t12480, t12483, t12486, t12488, t12490, t12492; in func_pol() local
6093 t12483 = t168 * t1043 * t12321; in func_pol()
6095 …0222 + 0.2e1 / 0.3e1 * t12477 + 0.4e1 / 0.3e1 * t12480 - 0.4e1 / 0.9e1 * t12483 - 0.2e1 / 0.9e1 * … in func_pol()
6120 …t12630 = -0.68863333333333333334e0 * t12483 - 0.34431666666666666667e0 * t12486 - 0.57386111111111… in func_pol()
6156 …12477 + 0.68493333333333333331e-1 * t12480 - 0.22831111111111111110e-1 * t12483 - 0.11415555555555… in func_pol()
|
| H A D | gga_c_q2d.c | 4516 double t12483, t12484, t12485, t12486, t12487, t12488, t12491, t12493; in func_pol() local
13104 t12483 = t12137 * t879; in func_pol()
13204 …t12710 = t12480 + t12481 - t12482 + t12483 - t12486 + t12488 + t12669 + t12670 - t12671 + t12679 +… in func_pol()
13354 …t12984 = t12475 + t12476 + t12479 / 0.12288e5 + t12481 - t12482 + t12483 - t12486 + t12488 + t1267… in func_pol()
13450 …t13230 = t12481 - t12482 + t12483 - t12486 + t12488 + t12670 - t12671 + t12679 + t13216 + t12680 +… in func_pol()
21683 …t46298 = t12480 + t12481 - t12482 + t12483 - t12486 + t12488 + t4 * (t45346 + t45384 + t45455 + t4… in func_pol()
22228 …t48137 = t12481 - t12482 + t12483 - t12486 + t12488 + t12670 - t12671 + t12679 + t13216 + t12680 +… in func_pol()
22529 …t48856 = t12480 + t12481 - t12482 + t12483 - t12486 + t12488 + t12669 + t4 * (t48535 + t48558 + t4… in func_pol()
22770 …t49584 = t12476 + t12481 - t12482 + t12483 - t12486 + t12488 + t12670 - t12671 + t12679 + t13216 +… in func_pol()
|
| H A D | gga_c_sogga11.c | 3384 double t12476, t12477, t12479, t12482, t12483, t12486, t12489, t12491; in func_pol() local
8834 t12483 = t12482 * t1119; in func_pol()
8852 …t12519 = 0.27802633833333333332e-2 * t12483 + 0.83407901499999999996e-1 * t12489 - 0.1390131691666… in func_pol()
9535 …t14054 = 0.55605267666666666664e-2 * t12483 + 0.16681580299999999999e0 * t12489 - 0.27802633833333… in func_pol()
|
| H A D | gga_x_wpbeh.c | 6957 double t12431, t12442, t12454, t12483, t12485, t12487, t12495, t12509; in func_ferr() local
10756 t12483 = t592 * t3523; in func_ferr()
10817 …t12873 = -0.297366688e1 * t12483 - 0.74341672e0 * t12485 - 0.617723688e0 * t12867 * t602 - 0.18531… in func_ferr()
13474 double t12481, t12483, t12484, t12485, t12486, t12488, t12489, t12490; in func_pol() local
20955 t12483 = t3168 * t3175; in func_pol()
20956 t12484 = 0.24603528893990676640e1 * t12483; in func_pol()
20976 t12511 = 0.10e2 / 0.9e1 * t12483; in func_pol()
22283 t16305 = 0.82011762979968922135e0 * t12483; in func_pol()
22299 t16333 = 0.10e2 / 0.27e2 * t12483; in func_pol()
29492 … t40731 + 0.39365646230385082625e1 * t12475 + 0.49207057787981353280e1 * t12483 - 0.29524234672788… in func_pol()
[all …]
|
| H A D | gga_c_gapc.c | 9038 double t12478, t12479, t12481, t12482, t12483, t12484, t12499, t12513; in func_pol() local
16256 t12483 = t195 * t12482; in func_pol()
16257 …+ t12235 - t12236 + t12238 - t12241 + t12244 + t12247 - t12248 + t12251 - t12337 + t12338 + t12483; in func_pol()
16358 …+ t12235 - t12236 + t12238 - t12241 + t12244 + t12247 - t12248 + t12251 - t12337 + t12885 + t12483; in func_pol()
22266 t37009 = 0.2e1 * t12483; in func_pol()
|
| H A D | gga_c_optc.c | 2847 double t12462, t12471, t12473, t12474, t12478, t12481, t12482, t12483; in func_pol() local
9672 t12483 = t12482 * t11794; in func_pol()
9673 …9 * t4074 + 0.11590881986385010472e0 * t2298 * t12478 - 0.77272546575900069816e-1 * t2298 * t12483; in func_pol()
15499 …155031418e0 * t2298 * t264 * t34358 + 0.41212024840480037235e0 * t6687 * t12483 + 0.92727055891080… in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 4450 double t12483, t12485, t12499, t12514, t12517, t12518, t12519, t12524; in func_pol() local
8468 …t12483 = 0.2e1 / 0.3e1 * t4026 * t2129 + t9397 - 0.4e1 * t2135 * t12467 + 0.4e1 / 0.3e1 * t2141 * … in func_pol()
8469 t12485 = t424 * t401 * t12483; in func_pol()
8470 t12499 = t423 * t12483; in func_pol()
8477 t12538 = t423 * t26 * t12483; in func_pol()
8488 t12577 = t423 * t29 * t12483; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_rscan.c | 29609 t12483 = t3277 * t538; in func_pol()
29610 t12484 = t615 * t12483; in func_pol()
29622 t12515 = t597 * t12483; in func_pol()
29649 t12598 = t661 * t12483; in func_pol()
29718 t12720 = t671 * t12483; in func_pol()
29860 t13132 = t646 * t12483; in func_pol()
29938 t13318 = t521 * t12483; in func_pol()
29939 t13321 = t581 * t12483; in func_pol()
54431 t86981 = t3651 * t12483; in func_pol()
54631 t87621 = t3687 * t12483; in func_pol()
[all …]
|
| H A D | mgga_xc_b98.c | 6180 double t12479, t12480, t12481, t12482, t12483, t12484, t12485, t12486; in func_pol() local
14305 t12483 = t399 * t3651; in func_pol()
14306 t12484 = t398 * t12483; in func_pol()
19893 …e-2 * t249 * t12455 * t1139 - 0.77725000000000000000e-2 * t249 * t1053 * t12483 + 0.10000000000000… in func_pol()
20975 …00000000e-2 * t541 * t13724 - 0.38862500000000000000e-2 * t249 * t2465 * t12483 + 0.38862500000000… in func_pol()
21324 …0e-2 * t249 * t9014 * t3652 - 0.38862500000000000000e-2 * t249 * t2762 * t12483 + t555 * t14175 + … in func_pol()
21382 …t249 * t398 * t399 * t14277 - 0.11658750000000000000e-1 * t249 * t2972 * t12483 + 0.58293750000000… in func_pol()
|
| H A D | mgga_x_scanl.c | 11339 double t12483, t12490, t12497, t12506, t12508, t12510, t12512, t12514; in func_pol() local
17472 t12483 = t1773 * t2982; in func_pol()
17488 …t12562 = -0.1844001259520e1 * t2263 * t12483 + 0.42504258063891829882e0 * t6728 * t12483 - 0.25830… in func_pol()
22809 …364414e1 * t3755 * t10105 * t35735 + 0.42504258063891829882e0 * t21741 * t12483 + 0.29967321450326… in func_pol()
22877 …773 * t2982 * t390 + 0.325024956416e0 * t107 * t10158 * t1835 - 0.1844001259520e1 * t6794 * t12483; in func_pol()
24679 …0.16879116930178234169e1 * t5399 * t46227 + 0.8298005667840e1 * t10155 * t12483 - 0.16468529812403… in func_pol()
24686 …32257502646895e1 * t10275 * t12678 + 0.29391714526792369101e0 * t46383 * t12483 - 0.11756685810716… in func_pol()
24698 …298285083840779e1 * t2276 * t43008 - 0.38253832257502646895e1 * t32302 * t12483 - 0.16468529812403… in func_pol()
|
| H A D | mgga_x_vt84.c | 336 double t12417, t12419, t12440, t12443, t12480, t12483, t12498, t12503; in func_unpol() local
2981 t12483 = t117 * t304; in func_unpol()
2983 …01 + 0.4e1 * t3377 * t12480 - 0.18217372327200000000e-4 * t3385 * t238 * t12483 + 0.4e1 * t9377 * … in func_unpol()
3191 …e-4 * t3355 * t329 * t12538 - 0.36434744654400000000e-4 * t3385 * t329 * t12483 + 0.4e1 * t1220 * … in func_unpol()
3206 …e-2 * t4230 * t316 * t3023 - 0.54652116981600000000e-4 * t13406 * t386 * t12483 + 0.6e1 * t3332 * … in func_unpol()
|
| H A D | mgga_x_edmgga.c | 3607 double t12462, t12479, t12483, t12488, t12504, t12536, t12556, t12575; in func_pol() local
7274 …t12483 = -0.3e1 * t293 * t3106 - 0.6e1 * t231 * t4233 + 0.24e2 * t104 * t6818 * t4232 * t251 - 0.1… in func_pol()
7276 …8e2 * t293 * t3048 + 0.12e2 * t293 * t3051 + 0.6e1 * t293 * t3056 - 0.3e1 * t3036 * t303 + t12483); in func_pol()
|
| H A D | mgga_x_mbrxc_bg.c | 578 double t12466, t12468, t12469, t12472, t12477, t12478, t12483, t12484; in func_unpol() local
5806 t12483 = t8524 * t46; in func_unpol()
5807 t12484 = t12483 * t12468; in func_unpol()
6616 t17407 = t12483 * t17406; in func_unpol()
7906 …e1 * t3127 * t24565 - 0.10e2 / 0.3e1 * t3119 * t24565 + 0.20e2 * t3119 * t12483 * t24564 - 0.2e1 *… in func_unpol()
8177 t26087 = t12483 * t26081; in func_unpol()
8324 t26875 = t12483 * t4039; in func_unpol()
10010 ….3e1 * t3127 * t36962 - 0.4e1 / 0.3e1 * t3119 * t36962 + 0.8e1 * t3119 * t12483 * t36961 + 0.4e1 *… in func_unpol()
10018 … - 0.12e2 * t34483 * t36976 - 0.4e1 * t1146 * t13533 + 0.36e2 * t34336 * t12483 * t5430 + 0.4e1 / … in func_unpol()
11358 ….3e1 * t43539 - t7624 - t7625 - t7626 + 0.4e1 * t43551 + 0.8e1 * t3119 * t12483 * t44881 + 0.4e1 *… in func_unpol()
[all …]
|
| H A D | mgga_x_mbeef.c | 414 double t12465, t12467, t12469, t12472, t12474, t12476, t12483, t12485; in func_unpol() local
4755 t12483 = t6825 * t12304; in func_unpol()
4758 …e5 / 0.216e3 * t3739 + 0.1625e4 / 0.432e3 * t3750 + 0.87500e5 / 0.81e2 * t12483 - 0.87500e5 / 0.81… in func_unpol()
4898 …e5 / 0.96e2 * t3739 - 0.11375e5 / 0.2592e4 * t3750 - 0.21875e5 / 0.9e1 * t12483 + 0.21875e5 / 0.9e… in func_unpol()
4931 …5e4 / 0.108e3 * t3739 - 0.325e3 / 0.108e3 * t3750 - 0.25000e5 / 0.81e2 * t12483 + 0.25000e5 / 0.81… in func_unpol()
9984 …0.81e2 * t39989 - 0.10000e5 / 0.243e3 * t39993 - 0.4000000e7 / 0.243e3 * t12483 + 0.4000000e7 / 0.… in func_unpol()
10247 …5 / 0.4e1 * t40646 + 0.10395e5 / 0.4e1 * t40648 - 0.3500000e7 / 0.27e2 * t12483 + 0.3500000e7 / 0.… in func_unpol()
14681 double t12450, t12452, t12454, t12458, t12472, t12483, t12485, t12486; in func_ferr() local
18881 t12483 = t6631 * t12203; in func_ferr()
18884 …e3 * t3601 - 0.11375e5 / 0.5184e4 * t3611 - 0.1485859375e10 / 0.6561e4 * t12483 + 0.175175e6 / 0.5… in func_ferr()
[all …]
|
| H A D | mgga_xc_b97mv.c | 4223 double t12452, t12476, t12477, t12480, t12483, t12486, t12510, t12511; in func_pol() local
10595 t12483 = t2934 * t1036; in func_pol()
10597 …20000000000000e-2 * t5110 * t12480 - 0.92548800000000000000e-3 * t8967 * t12483 + 0.11105856000000… in func_pol()
16632 …t37 + 0.93705660000000000000e-8 * t1844 * t33197 * t37 - 0.18509760000000000000e-2 * t662 * t12483; in func_pol()
|
| H A D | mgga_k_pc07.c | 362 double t12420, t12423, t12442, t12449, t12475, t12478, t12483, t12500; in func_unpol() local
3251 t12483 = t1572 * t185; in func_unpol()
3252 …3364 - 0.15e2 / 0.2e1 * t12478 * t2615 + 0.6e1 * t2190 * t2618 + 0.3e1 * t12483 * t551 + 0.5e1 / 0… in func_unpol()
3700 ….2187e4 * t11051 * t3398 - 0.15e2 / 0.4e1 * t935 * t821 * t643 + 0.6e1 * t12483 * t730 - t1849 * t… in func_unpol()
|
| H A D | mgga_c_m06l.c | 6226 double t12452, t12459, t12460, t12465, t12466, t12480, t12483, t12487; in func_pol() local
14189 t12483 = t2011 * t2963; in func_pol()
14196 …t12524 = -0.768e3 * t2002 * t12452 + 0.480e3 * t2009 * t12483 * sigma[2] - 0.2560e4 / 0.3e1 * t557… in func_pol()
21323 t48826 = t12483 * t14731; in func_pol()
|
| H A D | mgga_x_br89.c | 14347 double t12476, t12477, t12480, t12483, t12486, t12492, t12495, t12500; in func_ferr() local
19491 t12483 = t592 * t11065; in func_ferr()
19500 …t12517 = 0.6e1 * t12480 * t11019 - 0.4e1 * t12483 * t11019 + 0.3e1 * t12486 * t11019 + 0.12e2 * t1… in func_ferr()
20472 …1 * t12486 * t17850 + 0.46e2 / 0.9e1 * t17853 * t17855 - 0.4e1 / 0.3e1 * t12483 * t15452 - 0.12e2 … in func_ferr()
20722 …63 + 0.4e1 * t19308 * t19253 - 0.4e1 * t19311 * t19259 - 0.4e1 / 0.3e1 * t12483 * t19273 + 0.4e1 /… in func_ferr()
21369 …+ t295 * t24217 / 0.3e1 + 0.8e1 * t553 * t771 * t22138 - 0.4e1 / 0.3e1 * t12483 * t19381 + t12486 … in func_ferr()
22488 …e1 * t19308 * t29476 + 0.8e1 / 0.3e1 * t19301 * t29701 - 0.4e1 / 0.3e1 * t12483 * t30254 + 0.5e1 /… in func_ferr()
23557 …65 + t12486 * t34564 / 0.3e1 - 0.2e1 * t19285 * t32865 - 0.2e1 / 0.3e1 * t12483 * t34564 - 0.8e1 *… in func_ferr()
23790 …e1 / 0.3e1 * t14204 * t35868 - 0.4e1 * t20624 * t35074 - 0.2e1 / 0.3e1 * t12483 * t35322 + 0.2e1 *… in func_ferr()
24456 … t4678 * t4715 + 0.2e1 * t20109 * t4712 + 0.2e1 * t20109 * t4717 - 0.2e1 / 0.3e1 * t12483 * t40786; in func_ferr()
[all …]
|
| H A D | mgga_c_scanl.c | 11609 double t12468, t12471, t12474, t12475, t12478, t12483, t12484, t12487; in func_pol() local
19399 t12483 = t5583 * t3619; in func_pol()
19400 t12484 = t12483 * t140; in func_pol()
27963 t45842 = t12483 * t162; in func_pol()
32021 … t3256 + 0.74856120607073277417e-1 * t17028 * t67414 - 0.74856120607073277417e-1 * t12483 * t67400; in func_pol()
32562 …0.19444444444444444444e2 * t67417 * t69205 - 0.74856120607073277417e-1 * t12483 * t69199 + 0.25925… in func_pol()
35433 …3333333333334e1 * t12458 * t17010 * t87453 - 0.22456836182121983225e-1 * t12483 * t9159 * t87398 -… in func_pol()
|
| H A D | hyb_mgga_xc_wb97mv.c | 4579 double t12475, t12476, t12477, t12478, t12479, t12480, t12482, t12483; in func_pol() local
11597 t12483 = 0.3e1 / 0.32e2 * t12482; in func_pol()
11600 … - t12344 - t12346 - t12389 + t12391 - t12393 - t5574 + t12474 + t12477 + t12479 - t12483 - t12485; in func_pol()
17996 … 0.48245938496077605201e2 * t11200 + 0.30000000000000000000e1 * t11202 - t12483 - t12485 - t12489 … in func_pol()
|
| H A D | mgga_c_kcis.c | 5166 double t12483, t12485, t12487, t12488, t12492, t12493, t12495, t12497; in func_pol() local
13446 t12483 = t397 * t448; in func_pol()
13447 t12485 = t213 * t2379 * t12483; in func_pol()
22951 t42725 = t213 * t7890 * t12483; in func_pol()
|
| H A D | mgga_c_tpssloc.c | 4591 double t12469, t12472, t12473, t12474, t12477, t12478, t12483, t12484; in func_pol() local
14436 t12483 = t7321 * t3942; in func_pol()
14437 t12484 = t535 * t12483; in func_pol()
24669 t45257 = t1795 * t12483; in func_pol()
|
| H A D | mgga_x_mggac.c | 24524 double t12477, t12478, t12479, t12480, t12481, t12482, t12483, t12484; in func_pol() local
37021 t12483 = t12482 / 0.6e1; in func_pol()
37049 …t12512 = t12481 + t12483 - t12485 + t12489 + t12492 - t12496 - t12499 + t12502 - t12504 - t12507 -… in func_pol()
51720 …t56438 = t12477 - t12479 + t12481 + t12483 - t12485 + t12489 + t12492 - t12496 - t12499 + t12502 -… in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_ksdt.c | 2841 double t12446, t12452, t12457, t12460, t12463, t12483, t12497, t12498; in func_pol() local
9446 …t12483 = 0.46760844993141289437e0 * t6789 + 0.10967206218564243256e1 * t6801 + 0.74776406035665294… in func_pol()
9448 t12498 = t12483 + t12497; in func_pol()
|