| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_2.c | 892 double t4121, t4125, t4127, t4130, t4133, t4135, t4136, t4141; in func_pol() local
2316 t4130 = 0.10363566666666666667e-1 * t167 * t168 * t1481; in func_pol()
2319 …t4136 = -t4096 - t4098 - t4101 + t4104 - t4107 - t4109 + t4117 + t4121 - t4125 - t4127 - t4130 + t… in func_pol()
2322 t4143 = t4101 - t4104 + t4107 + t4109 - t4117 - t4121 + t4125 + t4127 + t4130 - t4133 + t4135; in func_pol()
2379 …96 + t4098 + t4101 - t4104 + t4107 + t4109 - t4117 - t4121 + t4125 + t4127 + t4130 - t4133 + t4135; in func_pol()
2431 …96 + t4098 + t4101 - t4104 + t4107 + t4109 - t4117 - t4121 + t4125 + t4127 + t4130 - t4133 + t4135; in func_pol()
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| H A D | lda_xc_bn05.c | 953 double t4101, t4103, t4108, t4113, t4118, t4124, t4130, t4131; in func_pol() local
2835 t4130 = t1623 * t149; in func_pol()
2836 t4131 = t4130 * t412; in func_pol()
4087 t9974 = t4130 * t990; in func_pol()
4093 t10038 = t4130 * t982; in func_pol()
4094 t10040 = t4130 * t940; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_lm.c | 922 double t4121, t4122, t4124, t4129, t4130, t4131, t4132, t4133; in func_pol() local
2862 t4130 = 0.64947768486905587512e0 * t4074; in func_pol()
2873 t4141 = -t4130 + t4131 + t4132 - t4133 - t4134 + t4135 - t4136 + t4137 - t4138 - t4139 + t4140; in func_pol()
2898 t4165 = -t4130 + t4131 + t4132 - t4133 - t4134 + t4164 - t4136 + t4137 - t4138 - t4139 + t4140; in func_pol()
2925 t4189 = -t4130 + t4131 + t4132 - t4186 - t4134 + t4135 - t4187 + t4137 - t4138 - t4139 + t4188; in func_pol()
2939 t4200 = -t4130 + t4131 + t4132 - t4186 - t4134 + t4164 - t4187 + t4137 - t4138 - t4139 + t4188; in func_pol()
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| H A D | gga_c_pbe.c | 1578 double t4114, t4116, t4120, t4123, t4128, t4129, t4130, t4133; in func_pol() local
3968 t4130 = t4129 * t1230; in func_pol()
3969 t4133 = t4130 * t1237; in func_pol()
3976 …t4145 = -t4128 + 0.6e1 * t4130 * t1233 - t4134 / 0.768e3 - 0.6e1 * t4103 * t4137 + t4140 + t4143 /… in func_pol()
5987 t14089 = t4130 * t3761; in func_pol()
5999 …-t14074 / 0.192e3 + 0.12e2 * t4130 * t3755 - 0.6e1 * t13987 * t4137 - 0.6e1 * t4103 * t4104 * t113… in func_pol()
6011 t14134 = t4130 * t3770; in func_pol()
6032 …t14220 = -t14074 / 0.48e2 + t14090 / 0.96e2 + 0.12e2 * t4130 * t3834 - t14099 / 0.64e2 - t14101 - … in func_pol()
6111 …t4130 * t3948 - 0.6e1 * t14397 * t4137 + t14138 + t14498 / 0.768e3 - t14500 / 0.256e3 - t14502 - t… in func_pol()
6118 …39 * t3164 * t353 + t14465 - t14466 + t14467 - t14218 - t14468 + 0.12e2 * t4130 * t4014 - 0.18e2 *… in func_pol()
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| H A D | gga_k_dk.c | 932 double t4121, t4124, t4130, t4137, t4139, t4144, t4147, t4157; in func_pol() local
2698 t4130 = t170 * t1484 * t189; in func_pol()
2715 …t4238 = t8 * (0.5e1 / 0.6e1 * t4124 + t170 * t639 * t393 / 0.2e1 - t4130 / 0.9e1 + t383 * t639 * t… in func_pol()
2742 …* t4364 + 0.2e1 / 0.5e1 * t4367 - 0.2e1 / 0.3e1 * t4124 - 0.2e1 / 0.9e1 * t4130 + t4137 + 0.2e1 / … in func_pol()
2771 …- 0.3e1 / 0.5e1 * t4361 + 0.2e1 / 0.3e1 * t4364 + 0.6e1 / 0.5e1 * t4367 - t4130 / 0.3e1 + t4139 / … in func_pol()
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| H A D | gga_xc_th2.c | 535 double t4118, t4120, t4122, t4125, t4128, t4130, t4133, t4135; in func_pol() local
1882 t4130 = t2142 * t160; in func_pol()
1886 …1 * t4125 - 0.50302074074074074072e0 * t4128 + 0.50302074074074074072e0 * t4130 + 0.86463611111111… in func_pol()
1945 …t4475 = 0.20120829629629629629e1 * t4130 - 0.34585444444444444444e0 * t4133 - 0.345854444444444444… in func_pol()
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| H A D | gga_xc_th1.c | 600 double t4127, t4130, t4133, t4134, t4141, t4155, t4157, t4159; in func_pol() local
1968 t4130 = t2773 * t480; in func_pol()
1969 … t3861 * t1848 - 0.32e2 / 0.27e2 * t3847 * t4127 + 0.32e2 / 0.27e2 * t3854 * t4130 + t3895 - t3906; in func_pol()
2003 t4237 = t3739 * t4130; in func_pol()
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| H A D | gga_c_zvpbeint.c | 5492 t4130 = t4129 * t183; in func_pol()
5493 t4131 = t4128 * t4130; in func_pol()
5859 t4698 = t4697 * t4130; in func_pol()
6276 t5308 = t5307 * t4130; in func_pol()
6395 t5487 = t5486 * t4130; in func_pol()
8501 t13481 = t1361 * t13449 * t4130; in func_pol()
8712 t14387 = t1361 * t14385 * t4130; in func_pol()
9344 t16348 = t1361 * t16346 * t4130; in func_pol()
9908 t19210 = t1361 * t19208 * t4130; in func_pol()
10112 t19764 = t1361 * t19642 * t4130; in func_pol()
[all …]
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| H A D | gga_x_pbetrans.c | 1372 double t4070, t4072, t4085, t4088, t4101, t4113, t4130, t4138; in func_pol() local
2789 t4130 = t1558 * t1605; in func_pol()
2794 …- 0.2e1 / 0.9e1 * t4000 + t4007 - t4085 / 0.3e1 - t4088 - 0.2e1 / 0.9e1 * t4130 + t1562 * t4072 * … in func_pol()
2837 …09 * t406 * t672 * t443 / 0.2e1 - 0.3e1 / 0.2e1 * t4156 - 0.2e1 / 0.3e1 * t4130 - 0.4e1 * t4138 - … in func_pol()
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| H A D | gga_x_hjs.c | 4601 double t4099, t4104, t4106, t4109, t4110, t4117, t4129, t4130; in func_pol() local
7577 t4130 = t223 * t4129; in func_pol()
7578 … * t1362 * t3097 + 0.2e1 * t1362 * t3100 - 0.2e1 * t4117 * t768 - 0.2e1 * t4130 * t768 + 0.2e1 * t… in func_pol()
10508 …29545555555555555555e-1 * t262 * t12762 - 0.2e1 * t1372 * t9701 - 0.4e1 * t4130 * t3117 - 0.2e1 * … in func_pol()
11062 t14715 = t4130 * t1758; in func_pol()
11067 …04 * t3114 + 0.2e1 * t4669 * t3114 + 0.2e1 / 0.3e1 * t19 * t25 * t14736 - t4130 * t4725 + t4110 * … in func_pol()
15362 …11990 * t1854 + 0.2e1 * t1372 * t23238 + 0.4e1 * t1372 * t22699 + 0.4e1 * t4130 * t5742 + 0.4e1 * … in func_pol()
15780 t36611 = t4130 * t5819; in func_pol()
15794 … t4117 * t9003 + 0.2e1 * t4117 * t9000 + 0.4e1 * t4130 * t9003 + 0.2e1 * t11753 * t3114 + 0.4e1 * … in func_pol()
16719 t43959 = t4130 * t767; in func_pol()
[all …]
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| H A D | gga_c_gapc.c | 257 double t4114, t4120, t4124, t4127, t4130, t4131, t4132, t4136; in func_unpol() local
2331 t4130 = t918 * t6; in func_unpol()
2332 t4131 = t470 * t4130; in func_unpol()
3317 t8946 = t469 * t1162 * t4130; in func_unpol()
3361 t9176 = t3328 * t846 * t4130; in func_unpol()
4300 double t4122, t4123, t4126, t4127, t4130, t4133, t4136, t4139; in func_ferr() local
6413 t4130 = t1243 * t227; in func_ferr()
7987 …86776611874080e-6 * t1734 * t11028 - 0.70772228231615465680e-5 * t12744 * t4130 - 0.70772228231615… in func_ferr()
8556 double t4117, t4118, t4119, t4122, t4123, t4126, t4129, t4130; in func_pol() local
12361 t4130 = t1110 * t4129; in func_pol()
[all …]
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| H A D | gga_c_scan_e0.c | 1605 double t4123, t4124, t4125, t4128, t4130, t4131, t4132, t4133; in func_pol() local
4099 t4130 = t409 * t4 * t388; in func_pol()
4100 t4131 = 0.65061487801810439052e-1 * t4130; in func_pol()
4481 t5308 = 0.32530743900905219526e-1 * t4130; in func_pol()
4975 t7414 = 0.10843581300301739842e-1 * t4130; in func_pol()
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| H A D | gga_x_ncap.c | 2304 double t4115, t4122, t4128, t4130, t4133, t4139, t4146, t4152; in func_pol() local
4086 t4130 = t555 * t4128 * t1545; in func_pol()
4092 …2e1 - t4122 / 0.6e1 - t1523 * t1544 * t8 * t511 / 0.3e1 - 0.7e1 / 0.6e1 * t4130 - 0.5e1 / 0.27e2 *… in func_pol()
4129 … 0.2e1 / 0.27e2 * t4387 - t4115 / 0.9e1 - t4122 / 0.9e1 + 0.2e1 / 0.9e1 * t4130 + 0.2e1 / 0.27e2 *… in func_pol()
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| H A D | gga_c_bmk.c | 1460 double t4123, t4124, t4126, t4128, t4130, t4132, t4134, t4136; in func_pol() local
3817 t4130 = t2511 * t581; in func_pol()
3829 …0 * t4126 + 0.10000000000000000000e1 * t4128 + 0.50000000000000000001e0 * t4130 + 0.10000000000000… in func_pol()
5540 …1 * t4126 + 0.30000000000000000000e1 * t4128 + 0.15000000000000000000e1 * t4130 + 0.30000000000000… in func_pol()
5914 …1 * t4126 + 0.20000000000000000000e1 * t4128 + 0.10000000000000000000e1 * t4130 + 0.20000000000000… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_edmgga.c | 3471 double t4091, t4101, t4105, t4108, t4122, t4123, t4126, t4130; in func_pol() local
5539 t4130 = t1451 * t1987; in func_pol()
5540 …427901234238e2 * t659 * t994 * t4126 + 0.10488523547622316684e3 * t1984 * t4130 * t3098 - 0.762172… in func_pol()
5922 …427901234238e2 * t659 * t994 * t5053 + 0.10488523547622316684e3 * t1984 * t4130 * t4738 - 0.762172… in func_pol()
6056 …427901234238e2 * t659 * t994 * t5488 + 0.10488523547622316684e3 * t1984 * t4130 * t5492 - 0.762172… in func_pol()
7172 …661 * t106 + 0.31465570642866950052e3 * t1984 * t4130 * t9253 + 0.10488523547622316684e3 * t1984 *… in func_pol()
7818 …34238e2 * t659 * t994 * t106 * t3464 + 0.10488523547622316684e3 * t1984 * t4130 * t12423 - 0.15243… in func_pol()
8040 …34238e2 * t659 * t994 * t106 * t3869 + 0.10488523547622316684e3 * t1984 * t4130 * t15478 - 0.15243… in func_pol()
8568 …66 * t4437 + 0.20977047095244633367e3 * t6892 * t4130 * t4430 + 0.31465570642866950052e3 * t1984 *… in func_pol()
8767 …34238e2 * t659 * t994 * t106 * t4841 + 0.10488523547622316684e3 * t1984 * t4130 * t19156 - 0.15243… in func_pol()
[all …]
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| H A D | mgga_x_pkzb.c | 1179 double t4114, t4124, t4130, t4131, t4133, t4134, t4145, t4146; in func_pol() local
3194 t4130 = 0.21547200000000000000e0 * t3295 * t610; in func_pol()
3195 …000e1 * t498 * t3173 * t608 * t312 + 0.96962400000000000000e0 * t216 * t217 * t311 * t4124 + t4130; in func_pol()
3225 …v4rho2sigma2[6] = t4130 + 0.86188800000000000000e0 * t4110 - 0.19392480000000000000e1 * t4112 + 0.… in func_pol()
3255 …v4rho2sigma2[12] = t4130 + 0.17237760000000000000e1 * t4160 + 0.21547200000000000000e0 * t498 * t3… in func_pol()
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| H A D | mgga_x_rscan.c | 7269 double t4122, t4125, t4130, t4131, t4134, t4135, t4138, t4141; in func_ferr() local
9612 t4130 = t416 * t1139; in func_ferr()
11577 …t4130 * t11292 + 0.18e2 * t4138 * t11292 + 0.3e1 * t4150 * t11292 - 0.2e1 * t1496 * t11296 - t1504… in func_ferr()
11893 …t4130 * t13530 + 0.18e2 * t4138 * t13530 + 0.3e1 * t4150 * t13530 - 0.6e1 * t1496 * t13540 - 0.3e1… in func_ferr()
12481 …- 0.4e1 * t1496 * t15279 + 0.24e2 * t4130 * t15255 + 0.24e2 * t4138 * t15255 + 0.6e1 * t4138 * t15… in func_ferr()
12724 …- t1504 * t16766 + 0.6e1 * t4130 * t16769 + t4150 * t16769 + 0.12e2 * t4130 * t16773 + 0.12e2 * t4… in func_ferr()
12952 … - 0.2e1 * t1496 * t18187 + 0.6e1 * t4130 * t18190 + 0.6e1 * t4138 * t18190 + 0.6e1 * t4138 * t182… in func_ferr()
13210 …t19344 - t1504 * t19352 + 0.18e2 * t4130 * t19331 + 0.18e2 * t4138 * t19331 + 0.3e1 * t4150 * t193… in func_ferr()
13459 …65 + 0.12e2 * t4130 * t20267 + 0.12e2 * t4138 * t20267 + 0.6e1 * t4130 * t20273 + 0.6e1 * t4138 * … in func_ferr()
13592 … 0.12e2 * t4130 * t21300 + 0.12e2 * t4138 * t21300 + 0.12e2 * t4138 * t21305 + 0.6e1 * t4130 * t21… in func_ferr()
[all …]
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| H A D | mgga_x_regtpss.c | 4520 double t4121, t4124, t4125, t4127, t4128, t4130, t4131, t4133; in func_ferr() local
6440 t4130 = t1356 * t560; in func_ferr()
6441 t4131 = t4130 * t171; in func_ferr()
6448 t4166 = t226 * t4130; in func_ferr()
6510 t4294 = t4130 * t1589; in func_ferr()
7804 t12940 = t540 * t4130; in func_ferr()
7807 t12953 = t534 * t4130; in func_ferr()
8117 …999999999998e-2 * t12582 * t287 * t74 * t70 + 0.13020833333333333333e-1 * t4130 * t1966 - 0.723379… in func_ferr()
8180 …t4339 * t7318 + 0.15513984e2 * t391 * t16061 + 0.12469444444444444445e0 * t4130 * t107 * t7497 - 0… in func_ferr()
8222 t16635 = t218 * t4130; in func_ferr()
[all …]
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| H A D | mgga_x_m06l.c | 2874 double t4115, t4118, t4122, t4123, t4126, t4127, t4130, t4131; in func_pol() local
4727 t4130 = t216 * t249; in func_pol()
4728 t4131 = t4130 * tau[1]; in func_pol()
6436 …t4130 + 0.1040e4 * t209 * t4063 - 0.280e3 / 0.3e1 * t4863 * t4245 + 0.1300e4 / 0.3e1 * t194 * t404… in func_pol()
6439 …3 / 0.3e1 * t1781 * t4245 + 0.200e3 * t1338 * t10440 + 0.1040e4 * t1232 * t4130 + 0.1300e4 * t1243… in func_pol()
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| H A D | mgga_c_m06l.c | 5662 double t4129, t4130, t4131, t4132, t4133, t4134, t4135, t4136; in func_pol() local
9552 t4130 = t4129 * t784; in func_pol()
9553 t4131 = t47 * t4130; in func_pol()
14367 t12798 = t438 * t4130; in func_pol()
14380 t12811 = t419 * t4130; in func_pol()
14641 t13250 = t848 * t4130; in func_pol()
14654 t13274 = t839 * t4130; in func_pol()
20575 …t4130 - 0.11659012500000000000e-1 * t1487 * t4130 + 0.30000000000000000000e1 * t1853 * t12784 - 0.… in func_pol()
20726 …t6345 * t4265 - 0.38863375000000000000e-2 * t2433 * t4130 - 0.38863375000000000000e-2 * t2442 * t4… in func_pol()
20901 …00000000000000001e0 * t9265 * t4126 - 0.19431687500000000000e-2 * t3131 * t4130 + 0.10000000000000… in func_pol()
[all …]
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| H A D | mgga_x_gx.c | 2480 double t4109, t4111, t4114, t4117, t4120, t4123, t4130, t4132; in func_pol() local
4801 t4130 = 0.1e1 / t135 / t3635; in func_pol()
4805 …t4130 * t72 * t4132 / 0.3e1 + 0.4e1 / 0.27e2 * t3895 + 0.4e1 / 0.27e2 * t3906 - 0.2e1 / 0.9e1 * t3… in func_pol()
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| H A D | mgga_x_task.c | 3221 double t4124, t4126, t4128, t4130, t4132, t4136, t4145, t4146; in func_pol() local
5345 t4130 = t524 * t1068; in func_pol()
5361 … t4106 - 0.20e2 * t88 * t4110 - t4124 * t92 - t4126 * t92 - t4128 * t92 - t4130 * t92 - t4132 * t9… in func_pol()
6963 …e1 * t4124 * t280 + 0.8e1 * t4126 * t280 + 0.8e1 * t4128 * t280 + 0.8e1 * t4130 * t280 + 0.8e1 * t… in func_pol()
7413 … + 0.40e2 * t4124 * t278 * t442 + 0.40e2 * t4128 * t278 * t442 + 0.40e2 * t4130 * t278 * t442 + 0.… in func_pol()
7648 …5287 + 0.8e1 * t1271 * t1647 + 0.8e1 * t1600 * t1322 + 0.8e1 * t4128 * t546 + 0.8e1 * t4130 * t546; in func_pol()
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| H A D | hyb_mgga_x_m05.c | 2282 double t4114, t4118, t4121, t4123, t4124, t4125, t4128, t4130; in func_pol() local
4387 t4130 = t1399 * t1763 * t320; in func_pol()
4389 v3rhotau2[2] = -t466 * t4130 / 0.2e1 - t4128 / 0.2e1; in func_pol()
5771 t9720 = t3475 * t4130; in func_pol()
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| H A D | mgga_c_scanl.c | 5735 double t4113, t4119, t4129, t4130, t4134, t4135, t4138, t4142; in func_ferr() local
7858 t4130 = t93 * t3467; in func_ferr()
10319 …t4130 - 0.13125000000000000000e1 * t4529 * t956 * t337 + 0.87500000000000000000e0 * t4523 * t956 *… in func_ferr()
11182 double t4113, t4116, t4121, t4124, t4125, t4127, t4130, t4131; in func_pol() local
15873 t4130 = t770 * t260; in func_pol()
15877 t4134 = t4130 * t4133; in func_pol()
15993 …0.2916e4 - 0.2e1 * t3366 * t1078 + 0.3e1 * t2277 * t4365 - t770 * t4368 - t4130 * t4371 / 0.2916e4; in func_pol()
20458 t15166 = t4130 * t15165; in func_pol()
20467 t15178 = t4130 * t15177; in func_pol()
20877 …5102 * t16422 / 0.1944e4 - t15171 * t4371 / 0.2916e4 - 0.5e1 / 0.6561e4 * t4130 * t16429 + 0.5e1 /… in func_pol()
[all …]
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| H A D | mgga_c_scan.c | 1930 double t4112, t4117, t4127, t4130, t4157, t4196, t4205, t4241; in func_ferr() local
3262 t4130 = t1631 * t1699; in func_ferr()
3263 …- 0.13316731344013704334e-2 * t4127 * t4018 - 0.22194552240022840557e-3 * t4130 * t4005 - 0.739818… in func_ferr()
3265 … t3156 * t1619 * t1699 * t4004 * t50 * t174 - 0.44389104480045681114e-3 * t4130 * t1700 * t3468 - … in func_ferr()
3692 double t4123, t4126, t4130, t4138, t4145, t4146, t4149, t4150; in func_pol() local
7532 t4130 = t677 * t35; in func_pol()
7534 …t4145 = -0.10e2 / 0.27e2 * t4065 + 0.20e2 / 0.9e1 * t4130 * t682 * t405 + 0.10e2 / 0.9e1 * t4072 +… in func_pol()
11735 …t4130 * t40 * t405 + 0.10e2 / 0.9e1 * t13054 - 0.10e2 * t13122 + 0.10e2 / 0.9e1 * t13059 + 0.10e2 … in func_pol()
12408 …0.9e1 * t4392 * t683 - 0.10e2 / 0.9e1 * t4064 * t16783 + 0.10e2 / 0.3e1 * t4130 * t682 * t1510 + 0… in func_pol()
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