| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_x_erf.c | 558 double t4029, t4037, t4040, t4043, t4047, t4049, t4052, t4055; in func_pol() local
2154 t4047 = 0.80e2 / 0.243e3 * t31 * t1351 * t77; in func_pol()
2161 …t4084 = -t4047 + 0.40e2 / 0.243e3 * t4049 + 0.8e1 / 0.81e2 * t4052 - 0.4e1 / 0.27e2 * t4055 + 0.40… in func_pol()
2405 …t5329 = -t4047 + 0.10e2 / 0.81e2 * t4049 - 0.2e1 / 0.27e2 * t4055 + t4064 / 0.27e2 - 0.50e2 / 0.27… in func_pol()
2799 …2e1 / 0.27e2 * t7694 + 0.4e1 / 0.243e3 * t7697 - 0.4e1 / 0.27e2 * t5289 - t4047 + 0.20e2 / 0.243e3… in func_pol()
2996 …243e3 * t4037 - 0.28e2 / 0.81e2 * t5275 - t7643 / 0.9e1 + 0.2e1 * t90 * (-t4047 + 0.10e2 / 0.243e3… in func_pol()
3098 …t10728 = -t4047 + 0.40e2 / 0.243e3 * t5295 + 0.8e1 / 0.81e2 * t7697 - 0.4e1 / 0.27e2 * t7652 + 0.4… in func_pol()
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| H A D | lda_c_vwn_3.c | 926 double t4017, t4020, t4033, t4035, t4039, t4043, t4047, t4055; in func_pol() local
2664 t4047 = t291 * t1828; in func_pol()
2666 …816 * t4039 + 0.3e1 / 0.2e1 * t150 * t896 * t4043 + 0.2e1 * t150 * t896 * t4047 - t150 * t289 * t4… in func_pol()
2680 …t72 + 0.185e3 / 0.864e3 * t4009 - 0.36e2 * t1940 * t4039 + 0.8e1 * t957 * t4047 - 0.4e1 * t1914 * … in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_lag.c | 849 double t4020, t4023, t4028, t4038, t4040, t4042, t4047, t4049; in func_pol() local
2885 t4047 = t718 * t429; in func_pol()
2887 …0194260424281379348e-1 * t77 * t218 * t4007 - 0.25699816195667342894e-3 * t4047 - 0.19274862146750… in func_pol()
2966 … t4040 - 0.20538658501862157139e-10 * t4042 - 0.17133210797111561930e-3 * t4047 - 0.64249540489168… in func_pol()
3047 … t4014 - 0.27384878002482876185e-11 * t4016 - 0.85666053985557809648e-4 * t4047 + t4368 + t4373 - … in func_pol()
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| H A D | gga_xc_th3.c | 611 double t4045, t4047, t4049, t4051, t4072, t4073, t4075, t4078; in func_pol() local
1993 t4047 = t792 * t463; in func_pol()
1995 … 0.3e1 * t4041 - 0.6e1 * t4043 + 0.9e1 / 0.2e1 * t4045 - 0.80e2 / 0.9e1 * t4047 + 0.20e2 / 0.3e1 *… in func_pol()
2097 …4039 + 0.16e2 * t4041 + 0.36e2 * t4043 + 0.27e2 * t4045 + 0.160e3 / 0.3e1 * t4047 + 0.40e2 * t4049; in func_pol()
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| H A D | gga_k_dk.c | 930 double t3989, t4007, t4015, t4023, t4025, t4040, t4047, t4048; in func_pol() local
2680 t4047 = 0.2e1 / 0.3e1 * t873 * t1529; in func_pol()
2681 … t404 * t1503 * t1040 / 0.3e1 - t4040 - t311 * t3830 * t416 - t311 * t1365 * t1049 / 0.2e1 - t4047; in func_pol()
2725 …/ 0.9e1 * t3973 + 0.2e1 / 0.3e1 * t3977 - t3702 / 0.9e1 - t3713 + t4266 - t4047 - t4050 + 0.2e1 / … in func_pol()
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| H A D | gga_c_wl.c | 539 double t4046, t4047, t4054, t4056, t4058, t4070, t4072, t4085; in func_pol() local
2339 …t4047 = t4044 - t4045 - t3709 + t3913 + t3915 + t3916 - t3917 - t4046 - t3685 + t3692 + t3918 + t3… in func_pol()
2341 v4rho2sigma2[10] = t4043 + t4047; in func_pol()
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| H A D | gga_c_op_pw91.c | 895 double t4013, t4021, t4024, t4028, t4033, t4044, t4046, t4047; in func_pol() local
2805 t4047 = t152 * t4046; in func_pol()
2806 t4048 = t4047 * t131; in func_pol()
2817 t4071 = t18 * t4047; in func_pol()
4579 t15329 = t146 * t4047; in func_pol()
5032 …060 * t1061 * t3992 - 0.66789460000000000000e-1 * t1059 * t1060 * t1061 * t4047 + 0.26715784000000… in func_pol()
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| H A D | gga_c_op_b88.c | 841 double t4043, t4046, t4047, t4050, t4051, t4054, t4057, t4060; in func_pol() local
2760 t4047 = t672 * t4046; in func_pol()
2778 …0012820000000000000e0 * t1911 * t4043 + 0.20006410000000000000e0 * t207 * t4047 - 0.20006410000000… in func_pol()
4597 t16264 = 0.40012820000000000000e0 * t551 * t4047; in func_pol()
4603 …0000e0 * t370 * t371 * t4092 + t16274 + 0.20006410000000000000e0 * t554 * t4047 - 0.20006410000000… in func_pol()
4734 …000000e0 * t207 * t672 * t3238 * t733 + 0.20006410000000000000e0 * t706 * t4047 - 0.54017307000000… in func_pol()
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| H A D | gga_x_ncap.c | 2301 double t4008, t4014, t4027, t4032, t4035, t4038, t4044, t4047; in func_pol() local
4066 t4047 = t7 * t61 * t4044 * t565; in func_pol()
4080 …t4092 = -0.3e1 / 0.2e1 * t7 * t547 * t504 * t8 + 0.25e2 / 0.6e1 * t4047 - t4050 / 0.2e1 + 0.7e1 / … in func_pol()
4115 …t4301 = 0.41e2 / 0.9e1 * t4047 - t4050 / 0.3e1 - 0.2e1 / 0.3e1 * t4053 + 0.4e1 / 0.9e1 * t4056 + 0… in func_pol()
4151 …t4565 = -t4047 / 0.3e1 + t4057 + t4060 + t4063 / 0.3e1 - 0.5e1 / 0.9e1 * t4070 - 0.5e1 / 0.9e1 * t… in func_pol()
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| H A D | gga_x_gg99.c | 3641 double t4040, t4042, t4043, t4044, t4045, t4046, t4047, t4048; in func_pol() local
6347 t4047 = t288 * t4046; in func_pol()
6348 t4048 = t4047 * t294; in func_pol()
6486 t4263 = t4047 * t310; in func_pol()
8512 t12288 = t4047 * t798; in func_pol()
8619 t12819 = 0.4e1 / 0.27e2 * t4047 * t872; in func_pol()
8700 t13164 = t4047 * t1072; in func_pol()
8715 t13296 = t4047 * t1141; in func_pol()
9139 t16683 = t4047 * t1355; in func_pol()
9229 t17115 = t4047 * t1524; in func_pol()
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| H A D | gga_c_acgga.c | 2736 double t4029, t4030, t4033, t4036, t4047, t4054, t4055, t4058; in func_pol() local
5992 t4047 = t324 * t373; in func_pol()
6000 …8365871023197e1 * t324 * t373 * t1243 * t133 - 0.13170898365871023197e1 * t4047 * t1346 - 0.658544… in func_pol()
8676 …9512695097613069592e1 * t324 * t10729 * t133 - 0.79025390195226139184e1 * t4047 * t3059 - 0.158050… in func_pol()
9200 …t4047 * t4063 - 0.39512695097613069591e1 * t2810 * t13368 * t2814 + 0.39512695097613069591e1 * t91… in func_pol()
9337 …3170898365871023197e1 * t910 * t14042 * t913 - 0.13170898365871023197e1 * t4047 * t5040 - 0.658544… in func_pol()
9385 …6341796731742046394e1 * t324 * t1319 * t1346 - 0.13170898365871023197e1 * t4047 * t5030 - 0.658544… in func_pol()
9667 …5 + 0.52683593463484092788e1 * t5003 * t4030 - 0.26341796731742046394e1 * t4047 * t5036 - 0.263417… in func_pol()
9926 …t19376 = -0.19756347548806534796e1 * t4047 * t5586 + 0.15805078039045227836e2 * t13481 * t5196 * t… in func_pol()
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| H A D | gga_c_gaploc.c | 239 double t4042, t4043, t4047, t4051, t4054, t4055, t4058, t4059; in func_unpol() local
2075 t4047 = t1120 * t477 * t2996; in func_unpol()
2079 …171462976960374838e1 * t4042 * t4043 - 0.38342925953920749676e0 * t3207 * t4047 + 0.15337170381568… in func_unpol()
2850 …337170381568299871e1 * t6394 * t4051 + 0.10224780254378866580e1 * t2507 * t4047 - 0.51123901271894… in func_unpol()
3241 double t4035, t4038, t4039, t4044, t4047, t4048, t4053, t4054; in func_ferr() local
5084 t4047 = t157 * t3716; in func_ferr()
5097 …8 - 0.10725146985555128001e1 * t4044 * t1378 + 0.42900587942220512003e1 * t4047 * t4048 - 0.798810… in func_ferr()
5861 …t10963 = 0.42900587942220512003e1 * t4047 * t6358 - 0.10725146985555128001e1 * t4044 * t2647 + 0.4… in func_ferr()
6284 double t4047, t4054, t4058, t4059, t4060, t4063, t4064, t4066; in func_pol() local
10279 t4047 = t4046 * t306; in func_pol()
[all …]
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| H A D | gga_c_regtpss.c | 2460 double t4039, t4047, t4048, t4059, t4064, t4065, t4066, t4071; in func_pol() local
5266 t4047 = t1340 * t432; in func_pol()
5267 t4048 = t2549 * t4047; in func_pol()
7990 t12998 = t7791 * t4047 * t1 * t168; in func_pol()
8003 …338778996e-1 * t11427 + t8228 + 0.15805078039045227836e2 * t351 * t7733 * t4047 * t372 + 0.3951269… in func_pol()
9313 …t18607 = 0.10408353825846239354e2 * t1439 * t14776 * t452 * t4047 - 0.51405703062096148814e-2 * t1… in func_pol()
9337 …3e1 * t17505 * t1576 + 0.10408353825846239354e2 * t1439 * t14776 * t472 * t4047 - 0.68549505033305… in func_pol()
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| H A D | gga_c_op_g96.c | 804 double t4032, t4034, t4036, t4039, t4040, t4041, t4045, t4047; in func_pol() local
2914 t4047 = t997 * t1001; in func_pol()
2916 …0 * t4041 - 0.12000000000000000000e2 * t4045 + 0.43155423840000000000e2 * t4047 - 0.21577711920000… in func_pol()
2983 …1 * t4356 - 0.30000000000000000000e1 * t4045 + 0.10788855960000000000e2 * t4047 + 0.30000000000000… in func_pol()
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| H A D | gga_c_optc.c | 2421 double t4038, t4040, t4041, t4043, t4044, t4046, t4047, t4050; in func_pol() local
6231 t4047 = t4046 * t693; in func_pol()
6287 …0000000000000000000e1 * t2050 * t4015 + 0.10000000000000000000e1 * t674 * t4047 + 0.32164683177870… in func_pol()
9388 t11757 = t4047 * t692; in func_pol()
9694 …000000000000000000e1 * t6368 * t4015 + 0.10000000000000000000e1 * t2196 * t4047 + 0.10000000000000… in func_pol()
10412 …t14710 = 0.30000000000000000000e1 * t3232 * t4047 + 0.96494049533612093922e2 * t9020 * t4050 - 0.1… in func_pol()
15916 …6722418785e3 * t6389 * t4050 * t2091 - 0.20000000000000000000e1 * t2050 * t4047 * t2091 - 0.192988… in func_pol()
15949 …87158296e5 * t21102 * t11740 * t2051 + 0.60000000000000000000e1 * t2097 * t4047 * t2051 + 0.240000… in func_pol()
15976 …00000000000000000e1 * t21023 * t4015 + 0.10000000000000000000e1 * t6364 * t4047 + 0.20000000000000… in func_pol()
17633 …196 * t14612 + t9732 * t4225 / 0.4e1 + 0.30000000000000000000e1 * t9009 * t4047 + 0.30000000000000… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_task.c | 152 double t4003, t4006, t4015, t4036, t4039, t4046, t4047, t4050; in func_unpol() local
1277 t4047 = t566 * t381; in func_unpol()
1280 …772 * t1201 - 0.160e3 * t1697 * t507 - 0.160e3 * t1700 * t507 + 0.400e3 * t4047 * t504 + 0.400e3 *… in func_unpol()
1348 … t223 * t749 * t165 * t166 - 0.1600e4 * t1534 * t1684 * t457 + 0.2000e4 * t4047 * t673 + 0.4000e4 … in func_unpol()
3218 double t4047, t4048, t4050, t4053, t4054, t4061, t4062, t4065; in func_pol() local
5318 t4047 = t19 * t1034; in func_pol()
5321 t4053 = 0.5e1 * t48 * t4050 + 0.5e1 * t4047; in func_pol()
5334 t4096 = t1642 * t4047; in func_pol()
6958 …545 * t718 * t7328 - 0.100e3 * t1079 * t1642 * t10579 - 0.200e3 * t1079 * t4047 * t4092 + 0.100e3 … in func_pol()
7419 …t4993 + 0.200e3 * t442 * t2757 * t1646 * t279 - 0.200e3 * t1079 * t4985 * t4047 - 0.100e3 * t1079 … in func_pol()
[all …]
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| H A D | mgga_k_pc07.c | 8082 double t4032, t4037, t4046, t4047, t4050, t4053, t4060, t4067; in func_pol() local
10721 t4047 = t865 * t1398; in func_pol()
11269 …t5565 = -0.3e1 * t163 * t350 * t5537 - 0.48501e1 * t3475 * t1378 - 0.48501e1 * t1130 * t4047 - 0.6… in func_pol()
13441 …00 + 0.68315264359428321e1 * t13809 * t2572 * t170 - 0.145503e2 * t2721 * t4047 + 0.784115667e1 * … in func_pol()
14293 …18377 * t2600 - 0.25353595976778e2 * t11495 * t4222 - 0.97002e1 * t3475 * t4047 + 0.1045487556e2 *… in func_pol()
15721 …* t163 * t350 * (t26062 + t26088 + t26115 + t26144) + 0.97002e1 * t4659 * t4047 - 0.48501e1 * t162… in func_pol()
15758 …t4047 - 0.32334e1 * t4148 * t6661 - 0.97002e1 * t1130 * t19354 - 0.64668e1 * t5428 * t4662 - 0.60e… in func_pol()
16202 …62668e2 * t1124 * t1884 + 0.97002e1 * t6225 * t5462 - 0.97002e1 * t5449 * t4047 - 0.97002e1 * t413… in func_pol()
16588 …0.2817066219642e1 * t30621 * t13621 - 0.4704694002e2 * t21007 * t6363 - 0.145503e2 * t6357 * t4047; in func_pol()
16602 …018e2 * t6297 * t5662 - 0.145503e2 * t4133 * t6216 + 0.291006e2 * t6232 * t4047 + 0.291006e2 * t13… in func_pol()
[all …]
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| H A D | mgga_x_m06l.c | 2871 double t4047, t4050, t4051, t4052, t4055, t4056, t4059, t4060; in func_pol() local
4697 t4047 = t4046 * tau[1]; in func_pol()
4717 …t4089 = 0.720e3 * t488 * t4047 - 0.1000e4 / 0.3e1 * t3181 * t4052 - 0.1500e4 * t1287 * t4056 - 0.2… in func_pol()
4722 …68 + 0.1620e4 * t510 * t4064 + 0.200e3 * t189 * t4109 + 0.420e3 * t1296 * t4047 + 0.980e3 * t496 *… in func_pol()
4742 …00e4 / 0.3e1 * t1278 * t4052 - 0.1250e4 * t481 * t4056 + 0.300e3 * t194 * t4047 - 0.1750e4 / 0.3e1… in func_pol()
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| H A D | mgga_x_mvsb.c | 2479 double t4045, t4046, t4047, t4048, t4049, t4051, t4052, t4054; in func_pol() local
5002 t4047 = 0.1e1 / t2109; in func_pol()
5003 t4048 = t4046 * t4047; in func_pol()
6621 t11002 = t982 * t4047; in func_pol()
7232 …09 / t118 * t440 + 0.17e2 / 0.16777216e8 * t1258 * t2106 * t1513 * t115 * t4047 - 0.3e1 / 0.262144… in func_pol()
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| H A D | mgga_c_pkzb.c | 2691 double t4041, t4042, t4045, t4046, t4047, t4049, t4050, t4051; in func_pol() local
6669 t4047 = t4046 * t1115; in func_pol()
6670 t4049 = 0.59765625000000000000e-2 * t1094 * t4047; in func_pol()
11546 t14065 = t3728 * t4047; in func_pol()
12335 t14931 = 0.35859375000000000000e-1 * t4021 * t4047; in func_pol()
12498 t15088 = 0.11953125000000000000e-1 * t4103 * t4047; in func_pol()
18893 …00000000000000e-1 * t14159 * t3766 - 0.35859375000000000000e-1 * t12392 * t4047 + t50336 + 0.11953… in func_pol()
20926 …0.66250000000000000000e-1 * t57925 - 0.23906250000000000000e-1 * t14511 * t4047 + 0.28708333333333… in func_pol()
21593 …3122286580185e-2 * t59269 + t58913 - 0.71718750000000000000e-1 * t14927 * t4047 - 0.50343963122286… in func_pol()
21769 …0000000e-1 * t15081 * t126 * t1116 + 0.71718750000000000000e-1 * t15084 * t4047 - 0.71718750000000… in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 3027 double t4032, t4035, t4037, t4044, t4047, t4048, t4050, t4052; in func_pol() local
5012 t4047 = 0.40e2 / 0.243e3 * t54 * t4044 * t230; in func_pol()
5018 …5 / 0.9e1 + t414 * t657 * t4037 / 0.27e2 - t414 * t662 * t4030 / 0.18e2 + t4047 + 0.10e2 / 0.81e2 … in func_pol()
5438 … 0.27e2 - 0.4e1 / 0.27e2 * t414 * t2139 * t5297 - t5303 + t5306 + t5336 + t4047 - 0.2e1 / 0.27e2 *… in func_pol()
5738 …1 / 0.81e2 * t414 * t1340 * t6246 + 0.20e2 / 0.81e2 * t414 * t5288 * t6250 + t4047 + t6277 + t5358; in func_pol()
5908 … t6779 / 0.9e1 - 0.4e1 / 0.27e2 * t6210 - 0.5e1 / 0.27e2 * t5373 + 0.10e2 / 0.81e2 * t5376 + t4047; in func_pol()
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| H A D | mgga_x_rtpss.c | 150 double t4015, t4037, t4042, t4047, t4065, t4068, t4088, t4093; in func_unpol() local
1278 t4047 = t209 * t728 * t115; in func_unpol()
1296 … * t1644 * t215 * t4037 / 0.16e2 - t650 * t4042 * t1341 / 0.12e2 - t650 * t4047 * t1341 / 0.12e2 -… in func_unpol()
1380 … * t795 - 0.9e1 / 0.16e2 * t126 * t781 * t1951 + 0.3e1 / 0.32e2 * t1635 * t4047 * t107 - 0.3e1 / 0… in func_unpol()
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| H A D | mgga_c_m08.c | 3936 double t4035, t4036, t4040, t4041, t4042, t4043, t4046, t4047; in func_pol() local
6357 t4047 = t4046 * t257; in func_pol()
6358 t4048 = t4041 * t4047; in func_pol()
8638 t15109 = t15094 * t4047; in func_pol()
8752 t15318 = t15306 * t4047; in func_pol()
9300 t18446 = t18443 * t4047; in func_pol()
13027 t55006 = t55004 * t4047 * t266; in func_pol()
13185 t55736 = t55588 * t4047 * t266; in func_pol()
13332 t56600 = t56598 * t4047 * t266; in func_pol()
14687 t72570 = t72568 * t4047 * t266; in func_pol()
[all …]
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| H A D | mgga_c_bc95.c | 2285 double t4039, t4041, t4042, t4043, t4045, t4047, t4050, t4052; in func_pol() local
5497 t4047 = t3787 * t258; in func_pol()
5516 …2 * t4043 - 0.11111111111111111111e1 * t4045 + 0.11111111111111111111e1 * t4047 - 0.18424118518518… in func_pol()
8463 …3 * t4043 - 0.33333333333333333333e1 * t4045 + 0.33333333333333333333e1 * t4047 - 0.55272355555555… in func_pol()
9439 …1 * t5071 - 0.22222222222222222222e1 * t4045 + 0.22222222222222222222e1 * t4047 - 0.36848237037037… in func_pol()
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| H A D | mgga_x_edmgga.c | 139 double t4047, t4059, t4060, t4062, t4066, t4069, t4073, t4078; in func_unpol() local
1189 t4047 = t356 * t356; in func_unpol()
1202 …t4047 * t272 * t58 - 0.76217237139506171188e1 * t270 * t582 * t236 - 0.70819478890314631336e-1 * t… in func_unpol()
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