| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_revtca.c | 1483 double t8233, t8234, t8235, t8237, t8240, t8241, t8244, t8245; in func_pol() local
5215 t8245 = 0.13202504757474380897e-2 * t8244; in func_pol()
5224 …0e-2 * t8226 + 0.22542928965267848380e0 * t8230 + t8233 - t8235 - t8241 + t8245 + t8249 + t8253 - … in func_pol()
5534 …3e-2 * t8226 + 0.22542928965267848381e0 * t8230 + t8884 - t8885 - t8886 + t8245 + t8249 + t8253 - … in func_pol()
5673 …793773902851780520e-2 * t8226 + t9244 + t8233 - 0.1e-20 * t8234 - t8241 + t8245 + t8249 + t8253 - … in func_pol()
5790 …241 + t9242 - 0.18793773902851780521e-2 * t8226 + t9244 + t8884 - t8886 + t8245 + t8249 + t8253 - … in func_pol()
5848 …t9766 = t8233 + t8235 - t8241 + t8245 + t8249 + t8253 - t8255 - t8258 + t8260 - t8261 + t8263 - t8… in func_pol()
5907 …t9947 = t8884 + t8885 - t8886 + t8245 + t8249 + t8253 - t8255 - t8258 + t8260 - t8888 + t8890 - t8… in func_pol()
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| H A D | gga_c_op_g96.c | 894 double t8210, t8230, t8231, t8232, t8236, t8245, t8247, t8248; in func_pol() local
3671 t8245 = sigma[2] * t104; in func_pol()
3674 …721276020e-2 * t436 * t2061 * t2091 + 0.27626597637916452045e-6 * t2392 * t8245 * t10 * t8248 - 0.… in func_pol()
3767 …0429683698296836e-2 * t1916 * t2414 + 0.82879792913749356135e-6 * t2392 * t8245 * t149 * t1327 + 0… in func_pol()
4403 …3476561232765612e-2 * t1916 * t3215 + 0.27626597637916452045e-6 * t2392 * t8245 * t181 * t1327 - 0… in func_pol()
4466 …000000000000000e1 * t12510 + t10617 + 0.55253195275832904090e-6 * t2392 * t8245 * t203 * t1327 + 0… in func_pol()
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| H A D | gga_x_ncap.c | 2369 double t8245, t8249, t8253, t8271, t8272, t8279, t8288, t8300; in func_pol() local
4705 t8245 = t3054 * t118; in func_pol()
4713 …* t3514 * t3516 - t3083 * t802 / 0.24e2 + t8272 * t3482 / 0.36e2 - t169 * t8245 * t170 / 0.24e2 - … in func_pol()
4714 …38 * t3854 + 0.6e1 * t144 * t780 * t2755 + t144 * params->alpha * (-t36 * t8245 * t38 / 0.24e2 + t… in func_pol()
4715 … * t5541 / 0.24e2 - 0.4e1 * t729 * t7175 + t3193 * t2714 * t1349 - t125 * t8245 * t140 / 0.2e1 - t… in func_pol()
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| H A D | gga_c_scan_e0.c | 1735 double t8187, t8193, t8206, t8208, t8210, t8231, t8238, t8245; in func_pol() local
5151 t8245 = t2260 * t2959; in func_pol()
5153 …9 * t812 + 0.17348729279022588207e-2 * t7004 + 0.76830240467580968648e0 * t8245 - 0.76830240467580… in func_pol()
5275 … * t8231 + 0.34697458558045176415e-2 * t7004 + 0.30732096187032387460e1 * t8245 - 0.69819907859583… in func_pol()
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| H A D | gga_c_op_pw91.c | 994 double t8222, t8224, t8227, t8237, t8244, t8245, t8253, t8265; in func_pol() local
3637 …t8245 = -t8224 - 0.10819892520000000000e2 * t7345 * t2584 + 0.50000000000000000000e0 * t8227 + 0.3… in func_pol()
3639 …19 + t7948 + t7980 + t8014 + t8046 + t8076 + t8099 + t8120 + t8145 + t8174 + t8201 + t8222 + t8245; in func_pol()
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| H A D | gga_c_regtpss.c | 2656 double t8228, t8234, t8244, t8245, t8247, t8249, t8251, t8259; in func_pol() local
6924 t8245 = t8244 * t740; in func_pol()
6925 t8247 = t915 * t7678 * t8245; in func_pol()
8802 …603595885220126e-3 * t16119 + 0.26020884564615598386e1 * t4857 * t16121 * t8245 - 0.26020884564615… in func_pol()
8922 …e1 * t4549 * t16573 * t4552 + 0.26020884564615598386e1 * t4857 * t16577 * t8245 + 0.43368140941025… in func_pol()
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| H A D | gga_x_wpbeh.c | 13295 double t8244, t8245, t8256, t8259, t8264, t8266, t8269, t8272; in func_pol() local
19511 t8245 = t8244 * t483; in func_pol()
19522 …t8291 = -0.93027173969241974797e-1 * t8229 * t459 + 0.26165591067112574428e-2 * t8245 * t486 + 0.5… in func_pol()
25362 …0e-1 * t26859 * t1278 - 0.13082795533556287214e-1 * t8245 * t1284 + 0.36631827493957604200e-1 * t8… in func_pol()
25944 …t29185 = -0.65413977667781436070e-2 * t8245 * t1799 - 0.65413977667781436070e-2 * t2447 * t5401 + … in func_pol()
36067 t85478 = t8245 * t1282; in func_pol()
37058 t92613 = t8245 * t4145; in func_pol()
37125 … 0.18315913746978802100e-1 * t26698 * t1802 + 0.36631827493957604200e-1 * t8245 * t5406 - t20314 *… in func_pol()
37946 …+ 0.23256793492310493699e0 * t58243 * t2416 + 0.18315913746978802100e-1 * t8245 * t6745 + 0.279081… in func_pol()
38032 …t101277 = 0.22894892183723502624e-1 * t8245 * t6790 - 0.10161144000000000000e1 * t29574 * t20762 +… in func_pol()
[all …]
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| H A D | gga_c_acggap.c | 4338 double t8244, t8245, t8246, t8248, t8251, t8255, t8259, t8262; in func_pol() local
10168 t8245 = t294 * t610; in func_pol()
10169 t8246 = t8245 * t448; in func_pol()
10567 t9049 = t8245 * t534; in func_pol()
16593 t32971 = t8245 * t1194; in func_pol()
16602 t32995 = t8245 * t1237; in func_pol()
18039 t36617 = 0.13170898365871023197e1 * t8245 * t1626; in func_pol()
18504 t38140 = 0.26341796731742046394e1 * t8245 * t1587; in func_pol()
19300 t41041 = t8245 * t1892; in func_pol()
19305 t41060 = t8245 * t1869; in func_pol()
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| H A D | gga_c_bmk.c | 1639 double t8209, t8215, t8218, t8225, t8229, t8233, t8236, t8245; in func_pol() local
5339 t8245 = t84 * t84; in func_pol()
5342 …18835531851851851851e1 * t3405 * t8236 + 0.10874121481481481481e0 * t83 * t8245 / t50 / t1338 / t3… in func_pol()
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| H A D | gga_c_ft97.c | 14480 t8245 = t355 * t1586; in func_pol()
14481 t8246 = t8245 * t100; in func_pol()
14554 t8397 = t8245 * t2; in func_pol()
15688 t10978 = t8245 * t110; in func_pol()
26970 t38516 = t8245 * t488; in func_pol()
27008 t38813 = t8245 * t480; in func_pol()
28742 t46843 = t8245 * t971; in func_pol()
28888 t47766 = t8245 * t499; in func_pol()
31282 t60156 = t8245 * t986; in func_pol()
35647 t91612 = t8245 * t5675; in func_pol()
[all …]
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| H A D | hyb_gga_xc_wb97.c | 2214 double t8241, t8243, t8244, t8245, t8248, t8251, t8252, t8255; in func_pol() local
6699 t8245 = t8244 * t2780; in func_pol()
6709 …0.4e1 / 0.27e2 * t2491 * t8237 - t8241 + t8243 - 0.4e1 / 0.81e2 * t2491 * t8245 - 0.2e1 / 0.81e2 *… in func_pol()
10205 t20441 = t7192 * t8245; in func_pol()
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| H A D | gga_c_sg4.c | 3026 double t8245, t8246, t8247, t8251, t8252, t8254, t8256, t8258; in func_pol() local
9042 t8245 = 0.4e1 * t1746 * t1996; in func_pol()
9044 …34543615403812755166e0 * t8147 + 0.83235307280031379477e-2 * t8039 + t8243 + t8245 - t8246 + t8157; in func_pol()
9147 …* t8072 + 0.4e1 * t396 * t8404 - t8240 + 0.83235307280031379476e-2 * t8039 + t8243 + t8245 - t8246; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_m06l.c | 2968 double t8220, t8224, t8228, t8232, t8237, t8245, t8255, t8275; in func_pol() local
5961 t8245 = t72 * t8080 * t2309; in func_pol()
5964 …t8245 - 0.32800e5 / 0.27e2 * t943 * t8186 + 0.6500e4 / 0.3e1 * t2546 * t8192 + 0.32500e5 / 0.3e1 *… in func_pol()
5976 … * t8232 - 0.320000e6 / 0.3e1 * t344 * t8318 - 0.5000e4 / 0.9e1 * t6009 * t8245 - 0.50000e5 / 0.9e… in func_pol()
5977 …t8245 - 0.5000e4 / 0.9e1 * t52 * t8212 - 0.3280e4 / 0.9e1 * t923 * t8154 - 0.3280e4 / 0.3e1 * t308… in func_pol()
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| H A D | mgga_x_mvsb.c | 2566 double t8226, t8230, t8237, t8238, t8243, t8245, t8249, t8251; in func_pol() local
5985 t8245 = t1551 * t381; in func_pol()
5987 …0.216e3 - t1002 * t2854 * t1434 / 0.2e1 - 0.2e1 / 0.3e1 * t8243 + t1002 * t8245 * t1555 / 0.9e1 - … in func_pol()
6016 … * t614 / 0.864e3 - t2862 * t1795 / 0.27648e5 - t8238 / 0.648e3 + t1002 * t8245 * t1758 / 0.9e1 - … in func_pol()
6042 …- t8357 - t8327 - 0.4e1 / 0.3e1 * t8354 - 0.2e1 / 0.9e1 * t8419 + t1002 * t8245 * t1930 / 0.9e1 - … in func_pol()
6063 …- 0.2e1 / 0.3e1 * t8350 - 0.2e1 / 0.3e1 * t8419 - 0.2e1 * t8432 + t1002 * t8245 * t2129 / 0.9e1 - … in func_pol()
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| H A D | hyb_mgga_x_pjs18.c | 3758 double t8162, t8195, t8197, t8206, t8214, t8226, t8233, t8245; in func_pol() local
7066 t8245 = t2865 * t462; in func_pol()
7075 …2 * t2768 * t1393 + 0.6e1 * t4520 * t8091 - 0.2e1 * t532 * t185 * t7991 + t8245 * t489 + t8270 + t… in func_pol()
7280 …e3 * t5635 * t2758 - 0.2e1 * t532 * t185 * t8943 + t9274 * t489 / 0.2e1 + t8245 * t710 / 0.2e1 + t… in func_pol()
7816 …t11365 = t8245 * t943 + t2867 * t2820 - 0.3e1 / 0.2e1 * t4517 * t3695 + t11349 * t187 - 0.360e3 * … in func_pol()
10008 …12 + 0.432e3 * t1507 * t22920 + 0.432e3 * t8318 * t4359 + 0.3e1 / 0.2e1 * t8245 * t1454 + 0.3e1 / … in func_pol()
10292 …* t4523 * t1842 * t2817 - t4487 * t1842 * t2817 + t23408 * t710 / 0.2e1 + t8245 * t1914 + t2867 * … in func_pol()
10575 … * t943 / 0.2e1 + t6527 * t2820 / 0.2e1 + t25617 * t710 + t9274 * t1914 + t8245 * t2359 / 0.2e1 + … in func_pol()
11185 …t32853 = 0.6e1 * t4520 * t32339 + 0.48e2 * t532 * t3638 * t1393 + 0.2e1 * t8245 * t2820 + t2867 * … in func_pol()
11375 …t1497 * t11915 / 0.2e1 + t516 * t34491 / 0.2e1 + t15257 * t3695 / 0.4e1 + t8245 * t3232 + t2867 * … in func_pol()
[all …]
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| H A D | hyb_mgga_x_m05.c | 2363 double t8227, t8230, t8232, t8234, t8237, t8240, t8244, t8245; in func_pol() local
5361 t8245 = t1906 * params->csi_HF; in func_pol()
5363 … / 0.3e1 * t8234 - 0.2e1 / 0.3e1 * t8237 - 0.2e1 * t8240 + t8244 + t466 * t8245 * t587 * t1909 / 0… in func_pol()
5471 …466 * t1399 * t1571 * t953 - t466 * t1399 * t587 * t2600 / 0.2e1 + t466 * t8245 * t587 * t2611 / 0… in func_pol()
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| H A D | mgga_c_scan.c | 3946 double t8245, t8246, t8248, t8249, t8250, t8253, t8256, t8257; in func_pol() local
9706 t8245 = t6723 * t2342; in func_pol()
9707 t8246 = t8245 * t8212; in func_pol()
9825 t8452 = t8245 * t8435; in func_pol()
16770 t30071 = t8245 * t30070; in func_pol()
16783 t30095 = t8245 * t30094; in func_pol()
16785 t30097 = t8245 * t30066; in func_pol()
17094 t30910 = t8245 * t30894; in func_pol()
17103 t30929 = t8245 * t30808; in func_pol()
17352 t31689 = t8245 * t31688; in func_pol()
[all …]
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| H A D | mgga_c_tpss.c | 3805 double t8221, t8233, t8236, t8237, t8241, t8245, t8249, t8253; in func_pol() local
11065 t8245 = t188 * t62 * t6259; in func_pol()
11070 …* t2823 * t8253 + 0.2e1 * t2823 * t2824 * t6176 - 0.6e1 * t2824 * t8086 * t8245 - 0.2e1 * t2833 * … in func_pol()
11747 …t10235 = -t10018 * t262 * t738 + 0.4e1 * t10040 * t2823 * t2824 - 0.6e1 * t10111 * t10187 * t8245 … in func_pol()
18488 …8724 * t6264 + 0.24e2 * t262 * t6270 * t6359 - 0.36e2 * t28009 * t28656 * t8245 + 0.8e1 * t2823 * … in func_pol()
19175 …t8245 * t2824 * t10111 * t2018 - 0.3e1 * t2833 * t8249 * t2019 + 0.24e2 * t32107 * t2824 * t31881 … in func_pol()
19714 …t35342 = -0.24e2 * t10111 * t2784 * t2824 * t8245 - 0.2e1 * t10018 * t2069 * t262 - t10230 * t2024… in func_pol()
19776 …e1 * t10187 * t28009 * t8245 + 0.12e2 * t10200 * t1893 * t2823 - 0.2e1 * t10200 * t2024 * t2833 - … in func_pol()
19777 …t8245 + 0.14e2 * t10187 * t1893 * t2823 + 0.24e2 * t10187 * t32107 * t35635 - 0.36e2 * t10187 * t8… in func_pol()
20610 …t8245 * t2824 * t42986 * t707 - 0.3e1 * t262 * t2836 * t10018 - 0.18e2 * t8245 * t42932 * t10111 +… in func_pol()
[all …]
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| H A D | mgga_c_kcis.c | 4937 double t8231, t8232, t8235, t8236, t8239, t8242, t8245, t8247; in func_pol() local
11617 t8245 = t1279 * t1196; in func_pol()
11619 t8248 = t8245 * t8247; in func_pol()
13690 t13119 = t8245 * t1581 * t2406; in func_pol()
15653 t18447 = t8245 * t18446; in func_pol()
16779 t21593 = t8245 * t1581 * t6080; in func_pol()
21169 …t8245 * t2267 * t2406 + 0.23653546800000000000e-1 * t981 * t4058 * t30950 - 0.19200000000000000002… in func_pol()
23154 …e-2 * t981 * t13181 * t4151 * t2297 - 0.78845155999999999998e-2 * t4018 * t8245 * t4078 * t2406 - … in func_pol()
24451 …00000000e-2 * t981 * t42966 * t52243 + 0.13140859333333333333e-2 * t981 * t8245 * t18445 * t2219 +… in func_pol()
24461 …t8245 * t5979 * t2406 - 0.98556445000000000000e-3 * t981 * t8221 * t5979 * t2277 - 0.4380286444444… in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 3183 double t8210, t8235, t8237, t8240, t8245, t8264, t8289, t8316; in func_pol() local
6317 t8245 = t178 * t1425; in func_pol()
6318 ….3e1 * t8240 * t1463 - 0.100e3 / 0.3e1 * t1718 * t7918 - 0.50e2 / 0.3e1 * t8245 * t7918 - 0.30250e… in func_pol()
8630 …9e1 * t551 * t20802 + 0.440e3 / 0.9e1 * t179 * t20795 + 0.650e3 / 0.3e1 * t8245 * t4423 - 0.1000e4… in func_pol()
9071 …t23405 = 0.200e3 * t8245 * t23084 + 0.1040e4 * t194 * t8041 + 0.2340e4 * t582 * t8041 + 0.1300e4 *… in func_pol()
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| H A D | mgga_x_mbeefvdw.c | 349 double t8232, t8233, t8237, t8238, t8242, t8243, t8245, t8246; in func_unpol() local
3626 t8245 = t2513 * t8133; in func_unpol()
3627 t8246 = t8245 * t346; in func_unpol()
3712 t8564 = t8245 * t516; in func_unpol()
7139 t24900 = t8245 * t995; in func_unpol()
17203 double t8245, t8246, t8248, t8249, t8250, t8252, t8253, t8255; in func_pol() local
21751 t8245 = t1960 * t8244; in func_pol()
21752 t8246 = t8245 * t7745; in func_pol()
25407 …+ 0.74705719506172839504e1 * t20356 * t20351 + 0.54975342962962962964e1 * t8245 * t20346 - 0.36650… in func_pol()
26423 …t24514 = 0.34359589351851851853e0 * t20361 * t24474 - 0.34359589351851851853e0 * t8245 * t24478 - … in func_pol()
[all …]
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| H A D | mgga_x_m11_l.c | 4248 double t8245, t8249, t8254, t8256, t8257, t8263, t8264, t8268; in func_pol() local
7131 t8245 = t298 * t8244; in func_pol()
7139 ….27e2 * t210 * t3109 * t8101 - t210 * t891 * t8105 / 0.27e2 + t23 * t25 * t8245 / 0.9e1 + 0.2e1 / … in func_pol()
9966 t21457 = t23 * t504 * t8245; in func_pol()
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| H A D | mgga_x_scanl.c | 11193 double t8245, t8247, t8255, t8258, t8263, t8268, t8269, t8282; in func_pol() local
16067 t8245 = t188 * t551; in func_pol()
16068 t8247 = t68 * t8245 * t563; in func_pol()
17099 t11272 = t68 * t8245 * t776; in func_pol()
20194 …t26101 = -t4631 * t2812 / 0.2e1 - t1477 * t8296 - t68 * t8245 * t1506 / 0.17496e5 + 0.3e1 * t19858… in func_pol()
21915 …t36549 = 0.2e1 / 0.2187e4 * t68 * t26116 * t776 + t2807 * t36468 / 0.3888e4 - t68 * t8245 * t2035 … in func_pol()
23911 …t48879 = t68 * t26112 * t2799 / 0.1944e4 - t68 * t8245 * t2812 / 0.2916e4 - 0.15e2 / 0.2e1 * t1986… in func_pol()
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| H A D | mgga_x_revtm.c | 223 double t8237, t8245, t8246, t8267, t8292, t8310, t8327, t8349; in func_unpol() local
1957 …t8245 = -0.27e2 / 0.32e2 * t1269 * t762 * t865 - 0.27e2 / 0.16e2 * t1269 * t963 * t640 - 0.1388888… in func_unpol()
1958 t8246 = t8210 + t8245; in func_unpol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pmgb06.c | 1789 double t8239, t8242, t8243, t8245, t8247, t8251, t8256, t8260; in func_pol() local
6560 t8245 = t386 * t3592; in func_pol()
6574 …t8280 = 0.17777777777777777778e-1 * t8243 - 0.10666666666666666667e0 * t8245 - 0.24000000000000000… in func_pol()
7882 …t11476 = 0.44444444444444444445e-2 * t8243 - 0.26666666666666666667e-1 * t8245 - 0.719833333333333… in func_pol()
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