| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_vt84.c | 240 double t5251, t5256, t5257, t5260, t5265, t5288, t5291, t5296; in func_unpol() local
2173 t5296 = t703 * t1850; in func_unpol()
2455 …t7372 = 0.22971420186933674284e1 * t707 * t535 * t997 - 0.22971420186933674284e1 * t994 * t5296 - … in func_unpol()
6770 double t5289, t5290, t5293, t5296, t5297, t5298, t5301, t5304; in func_pol() local
9631 t5296 = t1994 * t1998; in func_pol()
10201 …- 0.70904786327771977847e-3 * t1977 * t6847 + 0.29004318417845548338e-1 * t5296 * t6002 + 0.145021… in func_pol()
12130 … + 0.18108360000000000000e-1 * t1683 * t5064 - 0.23203454734276438670e0 * t5296 * t1224 * t40 * t4… in func_pol()
12862 … 0.87012955253536645014e-1 * t14949 * t17140 - 0.15468969822850959114e0 * t5296 * t17143 + 0.37260… in func_pol()
13777 … - 0.12529865556509276882e1 * t1960 * t25392 - 0.15468969822850959114e0 * t5296 * t649 * t417 * t7… in func_pol()
14668 … 0.38560218749999999997e-4 * t19828 * t2183 + 0.87012955253536645014e-1 * t5296 * t29618 + 0.70480… in func_pol()
[all …]
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| H A D | hyb_mgga_x_dldf.c | 1236 double t5272, t5296, t5309, t5310, t5312, t5314, t5333, t5334; in func_pol() local
3490 t5296 = t1820 * t1958; in func_pol()
3496 …480202060278e-1 * t584 * t338 * t593 * t120 + 0.28367843893403469905e-4 * t5296 + 0.21275882920052… in func_pol()
3517 …v4rho2sigma2[6] = t5309 + 0.26233600600252575348e-2 * t5310 + 0.14183921946701734953e-4 * t5296 - … in func_pol()
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| H A D | mgga_x_ms.c | 2923 double t5260, t5280, t5286, t5290, t5293, t5296, t5306, t5338; in func_pol() local
5638 t5296 = t418 * t192 * t167; in func_pol()
5640 …t5338 = -0.25e2 / 0.18e2 * t5296 * t696 + 0.10000e5 / 0.243e3 * t1891 * t690 * t156 * t413 - 0.110… in func_pol()
5812 …* t689 * t690 * t6207 + 0.50e2 / 0.9e1 * t5286 * t837 + 0.100e3 / 0.9e1 * t5296 * t837 + 0.50e2 / … in func_pol()
5896 …2612 + 0.625e3 / 0.972e3 * t1891 * t690 * t920 * t437 - 0.25e2 / 0.27e2 * t5296 * t929 - 0.25e2 / … in func_pol()
6074 …t7845 = 0.100e3 / 0.27e2 * t5296 * t1007 + 0.100e3 / 0.27e2 * t1218 * t2880 + 0.50e2 / 0.27e2 * t5… in func_pol()
6235 …t8636 = 0.100e3 / 0.27e2 * t5286 * t1077 + 0.200e3 / 0.27e2 * t5296 * t1077 + 0.200e3 / 0.27e2 * t… in func_pol()
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| H A D | mgga_c_scan.c | 3750 double t5296, t5297, t5300, t5301, t5304, t5305, t5308, t5309; in func_pol() local
8000 t5296 = t1670 * t551; in func_pol()
8001 t5297 = t2502 * t5296; in func_pol()
8025 t5360 = t2591 * t5296; in func_pol()
12391 …- 0.85333333333333333336e1 * t418 * t11172 * t5296 * t423 - 0.21333333333333333334e1 * t418 * t551… in func_pol()
12410 … t4505 + 0.10e2 / 0.3e1 * t415 * t5360 - 0.40e2 / 0.3e1 * t418 * t11171 * t5296 * t423 + 0.10e2 * … in func_pol()
14448 t21910 = t595 * t18255 * t160 * t5296; in func_pol()
14499 t22058 = t2591 * t182 * t5296; in func_pol()
15043 t26220 = t2591 * t176 * t5296; in func_pol()
15046 … t2006 * t640 * t5324 + 0.47407407407407407408e1 * t19419 * t640 * t147 * t5296 + 0.47407407407407… in func_pol()
[all …]
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| H A D | mgga_xc_b98.c | 5688 double t5291, t5292, t5295, t5296, t5297, t5299, t5301, t5303; in func_pol() local
10146 t5296 = t1743 * t1647; in func_pol()
10147 t5297 = t5295 * t5296; in func_pol()
11168 t7611 = t6128 * t5296; in func_pol()
16216 …t5374 * t4824 + 0.60308780958507558702e1 * t18357 * t5296 + 0.60308780958507558702e1 * t18360 * t5… in func_pol()
16340 …59 + 0.31037005317983947869e4 * t5015 * t5016 * t16808 - 0.12061756191701511740e2 * t19224 * t5296; in func_pol()
16569 …6722418785e3 * t657 * t5336 * t1149 + 0.40205853972338372468e1 * t20750 * t5296 + 0.64329366355741… in func_pol()
16609 …0000000000000000e0 * t21001 * t1156 + 0.40205853972338372468e1 * t21004 * t5296 + t16301 + 0.20691… in func_pol()
17042 …t6945 * t6144 + 0.60308780958507558702e1 * t20814 * t5296 + 0.60308780958507558702e1 * t22526 * t5… in func_pol()
17117 …00000000000000000e1 * t7599 * t6144 + 0.24123512383403023480e2 * t22683 * t5296 - 0.15000000000000… in func_pol()
[all …]
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| H A D | mgga_x_sa_tpss.c | 3979 double t5273, t5288, t5296, t5300, t5301, t5308, t5314, t5320; in func_ferr() local
5975 t5296 = t537 * t696; in func_ferr()
5980 …t5120 + 0.20e2 / 0.81e2 * t757 * t5117 - 0.10e2 / 0.27e2 * t1858 * t536 * t5296 - 0.20e2 / 0.243e3… in func_ferr()
6461 …t662 + t514 * t288 * t8609 / 0.324e3 - 0.5e1 / 0.5184e4 * t1858 * t1141 * t5296 + 0.5e1 / 0.72e2 *… in func_ferr()
6591 ….1944e4 * t5314 * t9623 - t6055 * t1287 * t1890 / 0.12e2 + 0.5e1 / 0.648e3 * t1858 * t1299 * t5296; in func_ferr()
6713 … / 0.9e1 * t2453 * t942 * t3787 * t470 - 0.5e1 / 0.81e2 * t1858 * t1434 * t5296 - 0.4e1 / 0.9e1 * … in func_ferr()
7640 double t5283, t5285, t5287, t5290, t5293, t5296, t5301, t5304; in func_pol() local
10489 t5296 = t453 * t2029; in func_pol()
10594 …t5610 = 0.2e1 / 0.9e1 * t422 * t5296 * t1887 - t5301 / 0.72e2 - 0.5e1 / 0.144e3 * t5304 + 0.4e1 / … in func_pol()
13521 …5112 - 0.25e2 / 0.216e3 * t5193 * t15226 + t422 * t5296 * t4103 / 0.3e1 - 0.5e1 / 0.6e1 * t1303 * … in func_pol()
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| H A D | mgga_x_tm.c | 4236 double t5293, t5296, t5299, t5304, t5306, t5307, t5310, t5312; in func_pol() local
6658 t5296 = t573 * t1412; in func_pol()
6660 …256 * t227 + 0.171e3 / 0.1000e4 * t2213 * t5293 - 0.9e1 / 0.50e2 * t757 * t5296 - 0.9e1 / 0.100e3 … in func_pol()
8490 …07 * t5299 + 0.171e3 / 0.500e3 * t6999 * t5293 - 0.9e1 / 0.25e2 * t2207 * t5296 - 0.9e1 / 0.25e2 *… in func_pol()
9154 …4 * t5299 + 0.171e3 / 0.1000e4 * t8493 * t5293 - 0.9e1 / 0.50e2 * t2914 * t5296 - 0.9e1 / 0.100e3 … in func_pol()
9395 … * t5213 + 0.513e3 / 0.1000e4 * t9853 * t5293 - 0.27e2 / 0.50e2 * t3711 * t5296 - 0.4959e4 / 0.100… in func_pol()
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| H A D | mgga_x_2d_prhg07.c | 2384 double t5296, t5297, t5298, t5299, t5300, t5325, t5337, t5338; in func_ferr() local
3935 t5296 = t182 * t5196; in func_ferr()
3936 t5297 = 0.3e1 * t5296; in func_ferr()
4013 t5528 = 0.2e1 * t5296; in func_ferr()
4029 …+ 0.3e1 * t5288 - 0.3e1 / 0.2e1 * t5291 + 0.3e1 / 0.2e1 * t5294 + 0.4e1 * t5296 - 0.3e1 * t5298 + … in func_ferr()
4095 …+ 0.3e1 / 0.4e1 * t5288 - 0.3e1 / 0.8e1 * t5291 + 0.3e1 / 0.8e1 * t5294 + t5296 - 0.3e1 / 0.4e1 * … in func_ferr()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th1.c | 622 double t5252, t5253, t5256, t5283, t5288, t5290, t5293, t5296; in func_pol() local
2162 t5296 = t586 * t175; in func_pol()
2173 …88e2 * t5290 + t5293 + 0.20e2 / 0.27e2 * t1498 * t120 + 0.160e3 / 0.9e1 * t5296 - 0.880e3 / 0.9e1 … in func_pol()
2243 …3 / 0.3e1 * t5290 + t5293 - 0.880e3 / 0.27e2 * t5799 + 0.160e3 / 0.27e2 * t5296 - 0.1760e4 / 0.27e… in func_pol()
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| H A D | gga_c_lyp.c | 618 double t5283, t5285, t5287, t5289, t5290, t5292, t5294, t5296; in func_pol() local
2484 t5296 = t263 * t1894; in func_pol()
2497 …- 0.640e3 / 0.27e2 * t5292 + 0.1280e4 / 0.9e1 * t5294 - 0.320e3 / 0.9e1 * t5296 - 0.64e2 / 0.3e1 *… in func_pol()
2527 ….7040e4 / 0.81e2 * t5287 - 0.2816e4 / 0.27e2 * t5290 - 0.640e3 / 0.27e2 * t5296 + 0.80e2 / 0.27e2 … in func_pol()
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| H A D | gga_c_zvpbeint.c | 2485 double t5295, t5296, t5297, t5298, t5299, t5300, t5301, t5302; in func_pol() local
6264 t5296 = t121 * t5295; in func_pol()
6265 t5297 = t306 * t5296; in func_pol()
6510 t5618 = t414 * t5296; in func_pol()
9939 …1 / 0.64e2 * t19224 - t19227 - t19230 + t19233 + t19237 - t19239 + t725 * t5296 - t19243 - 0.12e2 … in func_pol()
9958 …t19294 = t19263 + t19265 - t19267 + t586 * t5296 - 0.3e1 / 0.64e2 * t19269 - t19273 - 0.9e1 / 0.32… in func_pol()
10196 …t20188 = -t3101 * t5249 - t3089 * t5293 + t3101 * t5296 + 0.3e1 * t3089 * t5275 - t18795 - 0.6e1 *… in func_pol()
10321 …t20604 = t20585 + 0.3e1 * t2292 * t5704 + 0.3e1 / 0.16384e5 * t20590 + t1000 * t5296 + t414 * t193… in func_pol()
10634 …t21869 = 0.6e1 * t308 * t18851 * t3412 + t1252 * t5296 + t19173 - t21144 - t21145 + t21159 - t2185… in func_pol()
10837 t22928 = t1378 * t4285 * t5296; in func_pol()
[all …]
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| H A D | gga_x_n12.c | 1198 double t5296, t5298, t5316, t5324, t5326, t5347, t5348, t5350; in func_pol() local
3006 t5296 = t2306 * t348; in func_pol()
3010 … * t4134 + 0.88888888888888888887e-1 * t4129 - 0.18666666666666666666e1 * t5296 + t4177 - 0.240000… in func_pol()
3070 …9999999999999999998e0 * t1036 * t2588 * t900 - 0.17777777777777777777e0 * t5296 - 0.42666666666666… in func_pol()
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| H A D | gga_c_scan_e0.c | 1651 double t5291, t5293, t5294, t5295, t5296, t5297, t5298, t5299; in func_pol() local
4470 t5296 = 0.51947577317044391276e2 * t5295; in func_pol()
4479 …t5305 = t3879 - t5294 - t5296 - t5297 + t3885 - t3889 - t5298 + t5300 + t3893 - t3898 - t3903 + t3… in func_pol()
4717 …71 * t6152 * t582 - 0.3e1 * t771 * t1956 * t742 + t5307 + t6111 + t5029 - t5296 - t5297 - t5049 + … in func_pol()
5167 …t8306 = t3869 + t3876 + t3879 - t7881 - t5296 - t7882 + t3885 - t3889 - t7883 - t3898 - t3903 + t3… in func_pol()
5198 …741 + 0.6e1 * t771 * t2370 * t916 + 0.9e1 * t572 * t1902 * t971 - t4103 - t5296 - t5052 + t3753 + … in func_pol()
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| H A D | gga_c_zpbeint.c | 2064 double t5284, t5287, t5288, t5291, t5292, t5294, t5295, t5296; in func_pol() local
5656 t5296 = t141 * t5295; in func_pol()
5657 t5297 = t4991 * t5296; in func_pol()
8674 t18094 = t16623 * t5296; in func_pol()
8941 t19356 = t18023 * t5296; in func_pol()
9350 t20993 = t20233 * t5296; in func_pol()
9407 t21186 = t20450 * t5296; in func_pol()
9413 t21199 = t20503 * t5296; in func_pol()
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| H A D | gga_c_optc.c | 2478 double t5296, t5306, t5311, t5316, t5321, t5328, t5331, t5332; in func_pol() local
6705 …t5296 = 0.30228422675018518372e-1 * t5202 - 0.27818116767324025134e1 * t97 * t4810 * t1329 - 0.278… in func_pol()
6706 …t5306 = 0.25844881434903430496e-2 * t89 * t95 * t5296 * t609 - 0.25844881434903430496e-2 * t2753 *… in func_pol()
11532 t18175 = t5296 * t609; in func_pol()
11540 t18221 = t5296 * t1891; in func_pol()
11812 …-2 * t2753 * t18287 * t1333 - 0.51689762869806860992e-2 * t2753 * t4836 * t5296 + 0.51689762869806… in func_pol()
19866 t61337 = t5296 * t6197; in func_pol()
20756 t66396 = t5296 * t5296; in func_pol()
20758 t66404 = 0.20675905147922744396e-1 * t2753 * t16121 * t5296 * t1333; in func_pol()
20783 t66452 = 0.77534644304710291488e-2 * t2753 * t18287 * t5296; in func_pol()
[all …]
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| H A D | gga_c_gapc.c | 311 double t5277, t5284, t5289, t5290, t5291, t5292, t5295, t5296; in func_unpol() local
2772 t5296 = t5295 * t95; in func_unpol()
2777 …- 0.90519002930768337316e-7 * t5289 * t5292 + 0.11880619134663344273e-5 * t5296 * t5297 - 0.434491… in func_unpol()
4356 double t5282, t5283, t5286, t5289, t5290, t5295, t5296, t5299; in func_ferr() local
6866 t5296 = t565 * t293; in func_ferr()
8612 double t5278, t5281, t5284, t5285, t5288, t5290, t5291, t5296; in func_pol() local
12809 t5296 = t554 * t1717; in func_pol()
12810 t5297 = t93 * t5296; in func_pol()
13596 t7455 = t238 * t5296; in func_pol()
17157 t16751 = t375 * t5296; in func_pol()
[all …]
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| H A D | gga_x_hjs_b88_v2.c | 6655 double t5290, t5291, t5292, t5295, t5296, t5297, t5300, t5301; in func_pol() local
10165 t5296 = t192 * t610; in func_pol()
10166 t5297 = t5296 * t1205; in func_pol()
13625 t16780 = t5296 * t3905; in func_pol()
13671 t16959 = t5296 * t16958; in func_pol()
13859 t17528 = t5296 * t17527; in func_pol()
14259 t19495 = t5296 * t5101; in func_pol()
19878 …2431 - 0.4e1 * t16898 * t1782 + 0.4e1 * t16714 * t1455 - 0.6e1 * t13925 * t5296 * t1205 * t1737 - … in func_pol()
20109 …t51678 = 0.3e1 * t5295 * t5296 * t12546 + 0.6e1 * t16770 * t16780 + 0.3e1 * t5295 * t1758 * t610 *… in func_pol()
20363 …t5296 * t1205 * t2523 + 0.6e1 * t41448 * t17520 + 0.6e1 * t40802 * t17520 + 0.6e1 * t13529 * t1679… in func_pol()
[all …]
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| H A D | gga_x_sfat.c | 3192 double t5287, t5288, t5289, t5291, t5292, t5293, t5295, t5296; in func_pol() local
5570 t5296 = 0.3e1 / 0.8e1 * t5295; in func_pol()
5571 …7 = -t4876 - t4848 - t5270 - t5274 - t5276 - t4853 - t5280 - t5284 - t5288 - t4860 - t5292 - t5296; in func_pol()
6693 … t12726 - t4876 - t5270 - t5274 - t5276 - t5280 - t5284 - t5288 - t5292 - t5296 + t9 * (t12860 + t… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 3424 double t5291, t5292, t5293, t5294, t5295, t5296, t5297, t5298; in func_pol() local
6026 t5296 = 0.44343122073296276788e-2 * t5295; in func_pol()
6048 …t5319 = -t4912 - t4883 - t5285 + t5290 - t5293 - t4888 - t5296 - t5299 + t5302 + t5306 + t4895 + t… in func_pol()
7358 …12520 - t4886 - t12522 + t4893 + t12524 - t4912 - t5285 + t5290 - t5293 - t5296 - t5299 + t5302 + … in func_pol()
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| H A D | gga_c_regtpss.c | 2523 double t5274, t5277, t5278, t5291, t5292, t5296, t5297, t5300; in func_pol() local
5795 t5296 = t452 * t1322 * t122; in func_pol()
5796 t5297 = t1445 * t5296; in func_pol()
9043 t17143 = t5296 * t171; in func_pol()
10082 ….22847895066040941046e1 * t5623 * t5103 * t5291 - 0.11423947533020470523e1 * t5623 * t5103 * t5296; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_ml1.c | 473 double t5259, t5261, t5263, t5267, t5277, t5293, t5294, t5296; in func_pol() local
2554 t5296 = t270 * t60; in func_pol()
2560 …1 / 0.4e1 * t271 * t552 + t5293 + 0.3e1 / 0.2e1 * t5294 + 0.3e1 / 0.2e1 * t5296 + 0.3e1 * t5298 + … in func_pol()
3195 …t7939 = t5307 + 0.3e1 / 0.2e1 * t5298 + 0.3e1 / 0.4e1 * t5296 + t1068 * t253 / 0.8e1 + t5313 + 0.3… in func_pol()
3212 …t7982 = t5306 + t5298 / 0.2e1 + t5296 / 0.4e1 + t561 * t851 / 0.2e1 + t7970 / 0.2e1 + t7972 / 0.4e… in func_pol()
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| H A D | lda_xc_bn05.c | 996 double t5291, t5294, t5296, t5298, t5299, t5301, t5323, t5327; in func_pol() local
3164 t5296 = t360 * t1655; in func_pol()
3165 …- t5282 - t5285 - 0.48e2 * t5286 + 0.48e2 * t5288 + 0.6e1 * t5291 + 0.4e1 * t5294 - 0.48e2 * t5296; in func_pol()
3762 …t5282 - t5285 - 0.36e2 * t5286 + t7924 + 0.3e1 * t5291 + t5294 - 0.24e2 * t5296 - 0.4e1 * t5299 - … in func_pol()
4076 … t5279 - t5282 - t5285 - 0.24e2 * t5286 - 0.8e1 * t5288 + t5291 - 0.8e1 * t5296 - 0.8e1 * t5330 + … in func_pol()
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| H A D | lda_xc_ksdt.c | 2486 double t5296, t5297, t5298, t5299, t5303, t5304, t5305, t5308; in func_pol() local
6595 t5296 = t1678 * t4752 * t2003; in func_pol()
6671 …t5447 = t5296 * t5299 / 0.36e2 - t5303 * t5305 / 0.24e2 + t2303 * t5308 / 0.24e2 - t5313 * t5316 /… in func_pol()
7195 …t6594 = -0.3e1 / 0.4e1 * t2275 * t1990 + t5296 * t6521 / 0.36e2 - t5313 * t6524 / 0.24e2 + 0.3e1 /… in func_pol()
11687 … t6527 * t2177 - 0.3e1 / 0.2e1 * t19413 + 0.6e1 * t2294 * t9042 * t6918 + t5296 * t19419 / 0.9e1 -… in func_pol()
11792 ….36e2 * t19718 * t9099 + t5500 * t6483 / 0.9e1 - t18622 * t6524 / 0.6e1 + t5296 * t19726 / 0.36e2 … in func_pol()
11978 …t20460 = t5296 * t20431 / 0.36e2 - t19730 * t2676 / 0.18e2 + t19714 * t5299 / 0.9e1 - 0.5e1 / 0.36… in func_pol()
12046 …t20702 = 0.9e1 * t2024 * t5399 - t20668 + 0.2e1 * t2446 * t18671 + t5296 * t20672 / 0.9e1 - t5303 … in func_pol()
12885 …t23767 = t5296 * t23734 / 0.36e2 - t1190 * t19709 * t1997 / 0.2e1 - 0.3e1 / 0.4e1 * t6730 * t3548 … in func_pol()
14192 ….9e1 / 0.8e1 * t29078 - 0.3e1 / 0.4e1 * t29081 - 0.9e1 / 0.8e1 * t29084 + t5296 * t29087 / 0.36e2 … in func_pol()
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| H A D | lda_c_pmgb06.c | 1624 double t5287, t5288, t5289, t5291, t5292, t5293, t5295, t5296; in func_pol() local
5246 t5296 = t1519 * t4947; in func_pol()
5247 t5298 = t1518 * t5296 / 0.15e2; in func_pol()
7669 t11064 = t3563 * t5296; in func_pol()
7952 t11681 = t5352 * t5296 / 0.5e1; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 2233 double t5272, t5281, t5282, t5285, t5286, t5295, t5296, t5299; in func_ferr() local
3743 t5296 = 0.2e1 * t5295; in func_ferr()
3744 …1 * t1657 * t833 + 0.8e1 * t1660 * t842 + 0.16e2 / 0.3e1 * t563 * t4997 + t5296 + 0.2e1 * t2478 * … in func_ferr()
3876 …t5809 = t5264 - t5272 - t5282 + t5286 + t5296 - t5304 + t4963 - t4967 + t5566 - t5567 - t5321 + t5… in func_ferr()
3990 …t6620 = t5286 + t5296 - t5304 + t5564 - t5565 - t5321 + t5327 - t5332 + t5568 + t5569 - t5570 - t5… in func_ferr()
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