| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_op_b88.c | 834 double t3919, t3922, t3925, t3926, t3929, t3930, t3931, t3932; in func_pol() local
2688 t3922 = t383 * M_PI; in func_pol()
2730 t3996 = t3922 * t161; in func_pol()
2773 t4078 = t3922 * t3276; in func_pol()
2836 t4226 = t3922 * t4225; in func_pol()
4429 t14989 = t3922 * t3786; in func_pol()
4632 t16398 = t3922 * t4096; in func_pol()
4698 t16880 = t3922 * t476; in func_pol()
4726 t17170 = t3922 * t3655; in func_pol()
4837 … - 0.53206577036121600000e3 * t3922 * t18116 - 0.25362999590400000000e2 * t3915 * t18116 + 0.11742… in func_pol()
[all …]
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| H A D | gga_x_hjs_b88_v2.c | 6609 double t3917, t3920, t3922, t3925, t3927, t3931, t3940, t3941; in func_pol() local
9777 t3922 = t1478 * t1205; in func_pol()
9779 …t3927 = -0.3e1 / 0.4e1 * t3917 * t608 + 0.3e1 / 0.2e1 * t3920 + 0.3e1 / 0.4e1 * t3922 * t612 - 0.3… in func_pol()
9932 t4401 = -0.3e1 / 0.4e1 * t3917 * t855 + 0.3e1 / 0.4e1 * t3922 * t855; in func_pol()
9941 …t4441 = -0.3e1 / 0.4e1 * t3922 * t4408 - 0.3e1 / 0.2e1 * t1227 * t4411 - t2525 * t1237 / 0.2e1 + t… in func_pol()
12840 …0.4e1 * t13033 * t4408 + 0.3e1 / 0.4e1 * t3922 * t13470 - 0.3e1 / 0.4e1 * t3922 * t13473 + 0.3e1 /… in func_pol()
13133 …5 - 0.3e1 / 0.4e1 * t3917 * t3091 - 0.9e1 / 0.8e1 * t13030 * t3085 + 0.3e1 / 0.4e1 * t3922 * t3091; in func_pol()
13593 t16662 = t3922 * t631; in func_pol()
18262 …- 0.9e1 / 0.2e1 * t3922 * t12923 * t612 + 0.9e1 * t1227 * t38360 + 0.9e1 / 0.4e1 * t3922 * t631 * … in func_pol()
18764 t41546 = t3922 * t1743; in func_pol()
[all …]
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| H A D | gga_xc_th2.c | 532 double t3917, t3919, t3921, t3922, t3946, t3961, t3962, t3969; in func_pol() local
1853 t3922 = t3881 + t3921; in func_pol()
1857 …25 + 0.17390427413333333333e1 * t487 - 0.38407800000000000000e-3 * t102 * t3922 + 0.39347916666666… in func_pol()
1871 …rho[0] * t1873 - 0.67861166666666666666e-1 * t28 * t1610 + 0.10731250000000000000e-1 * t78 * t3922; in func_pol()
1876 …t4122 = -0.13143478333333333333e0 * t72 * t1776 - 0.20358350000000000000e-1 * t67 * t3922 + 0.4465… in func_pol()
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| H A D | gga_x_2d_b86.c | 561 double t3908, t3922, t3923, t3928; in func_pol() local
2326 t3922 = 0.13454298958371704096e-9 * t256 * t1293; in func_pol()
2330 …v4rhosigma3[9] = -t1295 + t1299 + t4 * (-0.40362896875115112290e-9 * t250 * t1293 * t78 - t3922 + … in func_pol()
2360 … -t1295 + t1299 + t4 * (-0.40362896875115112290e-9 * t250 * t1293 * t93 - t3922 + 0.24217738125069… in func_pol()
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| H A D | gga_c_q2d.c | 8131 t3923 = t36 * t3922; in func_pol()
8224 t4037 = t317 * t3922; in func_pol()
8278 t4096 = t477 * t3922; in func_pol()
8404 t4310 = t445 * t171 * t3922; in func_pol()
8506 t4547 = t431 * t3922; in func_pol()
8562 t4722 = t171 * t172 * t3922; in func_pol()
13733 t14105 = t258 * t3922; in func_pol()
15706 t25061 = t468 * t3922; in func_pol()
16072 t26239 = t2326 * t1364 * t2317 * t3922; in func_pol()
16107 t26338 = t2387 * t476 * t2335 * t3922; in func_pol()
[all …]
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| H A D | gga_x_airy.c | 1177 double t3845, t3848, t3877, t3882, t3905, t3912, t3915, t3922; in func_pol() local
2570 t3922 = t1622 * t125 * t127; in func_pol()
2572 …00188308300354915e-1 * t126 * t2096 * t3915 + 0.44188806526397375082e-2 * t3922 * t130 + 0.1639716… in func_pol()
2660 …- 0.11001120099806877974e-9 * t2191 * t4275 - 0.24856203671098523484e-2 * t3922 * t219 - 0.1229787… in func_pol()
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| H A D | gga_x_ev93.c | 958 double t3893, t3908, t3922, t3928, t3929, t3931, t3936, t3949; in func_pol() local
2587 t3922 = t115 * t723 * t551; in func_pol()
2593 … t253 * t793 - 0.3e1 * t115 * t527 * t847 + t292 * t302 * t1422 / 0.2e1 + t3922 - 0.3e1 * t1334 * … in func_pol()
2628 …t4132 = t3922 / 0.3e1 - 0.2e1 / 0.3e1 * t3929 + t903 * t4077 * t906 / 0.3e1 + t903 * t2523 * t1505… in func_pol()
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| H A D | gga_k_dk.c | 928 double t3922, t3926, t3928, t3933, t3938, t3940, t3945, t3947; in func_pol() local
2655 t3922 = t170 * t605 * t393; in func_pol()
2663 …0 / 0.9e1 + 0.2e1 / 0.3e1 * t3914 + t431 * t1549 * t892 - t3919 / 0.3e1 + t3922 + t170 * t275 * t8… in func_pol()
2705 …t4167 = -0.2e1 / 0.9e1 * t3919 + t3922 / 0.3e1 - t3947 + t3928 - t170 * t3926 / 0.2e1 - t4157 / 0.… in func_pol()
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| H A D | gga_c_op_g96.c | 795 double t3901, t3904, t3907, t3910, t3917, t3918, t3919, t3922; in func_pol() local
2854 t3922 = t544 * t850; in func_pol()
2892 …v3sigma3[9] = 0.25000000000000000000e0 * t77 * t3919 - 0.15000000000000000000e1 * t338 * t3922 + 0… in func_pol()
4743 t15609 = 0.30000000000000000000e1 * t1103 * t3922; in func_pol()
4795 …000000000000e1 * t338 * t2844 * t556 - 0.15000000000000000000e1 * t1108 * t3922 - 0.89907133000000… in func_pol()
4904 …t17255 = -0.15000000000000000000e1 * t1220 * t3922 + t15728 - 0.50000000000000000000e0 * t338 * t1… in func_pol()
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| H A D | gga_c_regtpss.c | 2453 double t3910, t3912, t3915, t3920, t3922, t3923, t3926, t3927; in func_pol() local
5210 t3922 = t3562 + t3596 + t3618 + t3920; in func_pol()
5211 t3923 = t354 * t3922; in func_pol()
7679 t11278 = t727 * t3922 * t1 * t168; in func_pol()
7808 …2039682876708176101e-2 * t7826 + 0.26341796731742046394e1 * t351 * t903 * t3922 * t372 + 0.2926866… in func_pol()
7999 …834e-2 * t11387 - t8182 + 0.39512695097613069591e1 * t351 * t903 * t432 * t3922 - 0.17073386770573… in func_pol()
9119 … t462 * t124 * t17343 + 0.86736281882051994620e0 * t1439 * t1440 * t452 * t3922 - t14419 - 0.17347… in func_pol()
9268 …613327357e-2 * t15378 + 0.86736281882051994620e0 * t1439 * t1440 * t472 * t3922 + 0.86736281882051… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 166 double t3894, t3914, t3920, t3921, t3922, t3926, t3929, t3930; in func_unpol() local
1325 t3922 = t3921 * t169; in func_unpol()
1339 …77997391555634274e-3 * t3876 * t605 - 0.35379554045979537498e-2 * t3920 * t3922 * t3926 - 0.437854… in func_unpol()
1419 …30301170e-2 * t2062 * t2275 * t4289 + 0.13267332767242326562e-2 * t4439 * t3922 * t4443 + 0.164195… in func_unpol()
1483 …t3959 * t980 * t3964 * t250 * t4961 - 0.49752497877158724608e-3 * t5199 * t3922 * t5201 - 0.615733… in func_unpol()
1577 … t3959 * t897 * t3964 * t250 * t685 + 0.18657186703934521728e-3 * t5791 * t3922 * t5793 + 0.230900… in func_unpol()
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| H A D | gga_c_hcth_a.c | 1536 double t3902, t3903, t3904, t3905, t3906, t3907, t3908, t3922; in func_pol() local
3900 t3922 = t608 * t1017; in func_pol()
4308 …t4877 = t3922 / 0.2e1 + t3925 / 0.2e1 + t3928 + t3929 + t3931 + 0.2e1 * t3933 + 0.2e1 * t3936 - 0.… in func_pol()
6423 …t12639 = 0.3e1 / 0.2e1 * t3922 + 0.3e1 / 0.2e1 * t3925 + 0.3e1 * t3928 + 0.3e1 * t3929 + t3907 + t… in func_pol()
6879 …t15717 = t4940 + t4942 + t4948 + t2 * (t14094 + t15471 + t15492 + t15707) + t3922 + t3925 + 0.2e1 … in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_cs.c | 799 double t3919, t3920, t3922, t3924, t3925, t3927, t3935, t3939; in func_pol() local
2807 t3922 = t508 * t1503; in func_pol()
2819 …t3949 = -0.19488744391111111111e-2 * t3920 + 0.97443721955555555555e-2 * t3922 - t3927 - 0.5770453… in func_pol()
2915 …* t4275 - 0.38977488782222222222e-2 * t3920 + 0.97443721955555555557e-2 * t3922 - t3927 + t3939 - … in func_pol()
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| H A D | mgga_x_m11_l.c | 144 double t3921, t3922, t3925, t3926, t3929, t3930, t3933, t3934; in func_unpol() local
1227 t3922 = t3921 * t1061; in func_unpol()
1238 …t3955 = -0.7000e4 / 0.3e1 * t2984 * t3922 - 0.9800e4 * t1109 * t3926 - 0.39200e5 / 0.3e1 * t370 * … in func_unpol()
1252 …971 - 0.1600e4 * t1156 * t3979 - 0.8000e4 / 0.3e1 * t348 * t4007 - 0.4000e4 / 0.3e1 * t104 * t3922; in func_unpol()
1255 …t4007 - 0.5000e4 * t355 * t3922 - 0.7000e4 / 0.3e1 * t110 * t3926 - 0.4000e4 / 0.3e1 * t2973 * t40… in func_unpol()
1274 …0 * t3926 - 0.11200e5 / 0.3e1 * t173 * t3930 - 0.7000e4 / 0.3e1 * t3249 * t3922 - 0.9800e4 * t1314… in func_unpol()
1275 …971 - 0.1600e4 * t1238 * t3979 - 0.8000e4 / 0.3e1 * t436 * t4007 - 0.4000e4 / 0.3e1 * t167 * t3922; in func_unpol()
1276 …1 * t3230 * t3979 - 0.10000e5 / 0.3e1 * t1293 * t4007 - 0.5000e4 * t443 * t3922 - 0.7000e4 / 0.3e1… in func_unpol()
1286 ….4000e4 / 0.3e1 * t205 * t3922 - 0.2000e4 / 0.3e1 * t3467 * t3979 - 0.10000e5 / 0.3e1 * t1422 * t4… in func_unpol()
1287 …459 = -0.6000e4 * t1430 * t3922 - 0.8400e4 * t543 * t3926 - 0.11200e5 / 0.3e1 * t211 * t3930 - 0.7… in func_unpol()
[all …]
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| H A D | mgga_x_2d_prhg07.c | 2349 double t3919, t3922, t3925, t3929, t3932, t3933, t3936, t3939; in func_ferr() local
3629 t3922 = t140 * t3906; in func_ferr()
3632 …1 * t775 * t3916 + 0.11e2 / 0.4e1 * t775 * t3919 + 0.9e1 / 0.4e1 * t783 * t3922 + 0.3e1 / 0.4e1 * … in func_ferr()
3644 …0.4e1 * t775 * t3961 - 0.3e1 / 0.2e1 * t162 * t3964 + 0.11e2 / 0.4e1 * t775 * t3922 - t162 * t3969; in func_ferr()
3714 …6 * t3946 - 0.7e1 / 0.8e1 * t122 * t619 * t4263 + 0.11e2 / 0.4e1 * t876 * t3922 + 0.11e2 / 0.4e1 *… in func_ferr()
4475 double t3914, t3915, t3916, t3917, t3922, t3925, t3927, t3932; in func_pol() local
7625 t3922 = t3916 * t1299; in func_pol()
7629 …e1 * t150 * t3917 - 0.3e1 / 0.8e1 * t446 * t3891 + 0.3e1 / 0.8e1 * t446 * t3922 + t150 * t3925 - t… in func_pol()
11866 t17956 = 0.9e1 / 0.16e2 * t353 * t3922; in func_pol()
11916 …t18206 = -0.3e1 / 0.8e1 * t1662 * t3891 + 0.3e1 / 0.8e1 * t1662 * t3922 + t17956 + t17958 - t17960… in func_pol()
[all …]
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| H A D | mgga_c_kcis.c | 1968 t3922 = t3921 * t140; in func_unpol()
9484 t3923 = t854 * t3922; in func_pol()
12368 t10085 = t3881 * t860 * t3922; in func_pol()
12397 t10142 = t794 * t3922; in func_pol()
14396 t14889 = t1395 * t3922; in func_pol()
14410 t14922 = t5441 * t3922; in func_pol()
17598 t23971 = t867 * t3922; in func_pol()
21504 t33877 = t3922 * t860; in func_pol()
21576 t34221 = t3922 * t3922; in func_pol()
23807 t48422 = t713 * t3922; in func_pol()
[all …]
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| H A D | mgga_x_regtpss.c | 230 double t3911, t3914, t3917, t3918, t3921, t3922, t3925, t3926; in func_unpol() local
2184 t3922 = t1281 * t3921; in func_unpol()
4508 double t3904, t3907, t3910, t3911, t3919, t3921, t3922, t3923; in func_ferr() local
6339 t3922 = t108 * t86; in func_ferr()
8101 …t15434 + 0.22476648705244966951e-3 * t3922 * t7321 + 0.3878496e1 * t391 * t15439 + 0.7633120170386… in func_ferr()
8569 double t3898, t3903, t3905, t3906, t3909, t3910, t3915, t3922; in func_pol() local
11192 …t3922 = t3903 * t219 + 0.98154045368605272900e0 * t3906 * t452 + 0.48171083111111111114e0 * t3910 … in func_pol()
11193 t3924 = 0.646416e0 * t430 * t3922; in func_pol()
14437 t12673 = 0.5171328e1 * t3782 * t3922; in func_pol()
14794 t15276 = 0.1292832e1 * t1703 * t3922; in func_pol()
[all …]
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| H A D | mgga_x_mvsb.c | 2472 double t3909, t3914, t3915, t3919, t3922, t3923, t3928, t3939; in func_pol() local
4918 t3922 = t275 * t3867; in func_pol()
4919 t3923 = t3922 * tau[1]; in func_pol()
5235 t4257 = t749 * t3922; in func_pol()
7027 …154 * t3914 - 0.20e2 * t2233 * t11873 + 0.18e2 * t4138 + 0.24e2 * t2233 * t3922 * t246 + 0.100e3 *… in func_pol()
7179 …12162 - 0.48e2 * t256 * t12166 - 0.200e3 * t99 * t12170 + 0.120e3 * t99 * t3922 + 0.60e2 * t4249 -… in func_pol()
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| H A D | mgga_x_tm.c | 4191 double t3915, t3918, t3919, t3922, t3923, t3926, t3937, t3939; in func_pol() local
6147 t3922 = t921 * t1438; in func_pol()
6148 t3923 = t3922 * t331; in func_pol()
6520 t4855 = t3922 * t484; in func_pol()
7947 t10667 = t3922 * t903; in func_pol()
8339 t13235 = t3922 * t1193; in func_pol()
8938 t16718 = t3922 * t1617; in func_pol()
9225 t18151 = t3922 * t1793; in func_pol()
9422 t19217 = t3922 * t1961; in func_pol()
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| H A D | mgga_c_m06l.c | 9457 t3922 = t142 * t1227; in func_pol()
9458 t3923 = t128 * t3922; in func_pol()
13742 t11722 = t3922 * t587; in func_pol()
13799 t11819 = t542 * t3922; in func_pol()
13801 t11822 = t558 * t3922; in func_pol()
14061 t12276 = t867 * t3922; in func_pol()
14084 t12299 = t876 * t3922; in func_pol()
20136 t37585 = t1444 * t3922; in func_pol()
20141 t37667 = t1477 * t3922; in func_pol()
20142 t37670 = t1480 * t3922; in func_pol()
[all …]
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| H A D | mgga_x_gx.c | 2477 double t3907, t3914, t3920, t3922, t3927, t3931, t3946, t3956; in func_pol() local
4771 t3922 = t562 * t3920 * t1466; in func_pol()
4772 ….6e1 - t3914 / 0.3e1 - t539 * t17 * t511 * t541 / 0.2e1 - 0.7e1 / 0.6e1 * t3922 - t562 * t1548 * t… in func_pol()
4805 … t3895 + 0.4e1 / 0.27e2 * t3906 - 0.2e1 / 0.9e1 * t3914 + 0.2e1 / 0.9e1 * t3922 - t8 * t125 * t511… in func_pol()
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| H A D | hyb_mgga_x_m05.c | 2278 double t3922, t3926, t3930, t3933, t3936, t3940, t3948, t3949; in func_pol() local
4297 t3922 = t963 * t3920 * sigma[2]; in func_pol()
4301 …2081382197517859e-2 * t1194 * t3917 - 0.10815532482459210266e-3 * t1209 * t3922 + 0.59124162764395… in func_pol()
5642 t9302 = t343 * t3922; in func_pol()
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| H A D | mgga_c_tpss.c | 9113 t3922 = t169 * t3921; in func_pol()
15747 t21341 = t5427 * t3922; in func_pol()
15800 t21445 = 0.2e1 * t5475 * t3922; in func_pol()
28036 t87013 = 0.4e1 * t21204 * t3922; in func_pol()
28047 t87047 = 0.4e1 * t21207 * t3922; in func_pol()
28061 t87091 = 0.4e1 * t21201 * t3922; in func_pol()
28197 t87490 = 0.4e1 * t21467 * t3922; in func_pol()
28247 t87618 = 0.4e1 * t21465 * t3922; in func_pol()
28301 t87804 = 0.4e1 * t21469 * t3922; in func_pol()
28663 t90005 = 0.2e1 * t22050 * t3922; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pk09.c | 167 double t3887, t3904, t3910, t3917, t3922, t3947, t3971, t3976; in func_unpol() local
1314 t3922 = t1415 * t1664; in func_unpol()
1315 …e1 - t1571 * t1385 * t1519 / 0.3e1 - t3917 * t85 * t1560 * t953 / 0.4e1 + t3922 * t85 * t1560 * t1… in func_unpol()
1335 …221484387501268666e1 * t1461 * t3589 * t1388 - 0.56416113290625951498e1 * t3922 * t1399 + 0.216009… in func_unpol()
2489 double t3922, t3926, t3931, t3932, t3933, t3939, t3941, t3951; in func_pol() local
4699 t3922 = t921 / t3920; in func_pol()
4700 t3926 = t116 * t117 * (-0.2e1 * t3917 * t902 + t3922 * t917); in func_pol()
6752 …9178833072667e1 * t8303 * t116 * t117 * (-0.2e1 * t2265 * t3917 + t2273 * t3922) + 0.1476049945255… in func_pol()
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| H A D | lda_xc_bn05.c | 945 double t3908, t3909, t3914, t3917, t3920, t3922, t3926, t3930; in func_pol() local
2770 t3922 = t1504 * t257; in func_pol()
2775 … 0.81e2 - 0.4e1 / 0.243e3 * t3917 + 0.2e1 / 0.81e2 * t3920 - t23 * t271 * t3922 / 0.27e2 + 0.4e1 /… in func_pol()
3850 t8286 = t23 * t698 * t3922; in func_pol()
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