| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_lyp.c | 612 double t5006, t5012, t5016, t5018, t5024, t5028, t5030, t5033; in func_pol() local
2432 t5030 = t61 * t484 * t841; in func_pol()
2437 …t5122 = t5030 / 0.576e3 + t5033 / 0.288e3 + t61 * t82 * (t5071 + t5109) / 0.576e3 + t3452 / 0.32e2… in func_pol()
2536 …e3 + t5012 / 0.96e2 + t5016 / 0.96e2 + t5018 / 0.96e2 + t5024 / 0.192e3 + t5030 / 0.192e3 + t5033 … in func_pol()
2590 ….16e2 * t4939 + t4987 / 0.96e2 - 0.176e3 / 0.3e1 * t4989 + t5016 / 0.48e2 + t5030 / 0.96e2 + t3475; in func_pol()
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| H A D | gga_c_sogga11.c | 169 double t4990, t4995, t4999, t5022, t5027, t5030, t5034, t5042; in func_unpol() local
1353 t5030 = t1753 * t854; in func_unpol()
1356 …167770613872091998e1 * t2003 * t5027 - 0.19389256871290697333e1 * t2003 * t5030 - 0.48226045488659… in func_unpol()
1359 …267108245548836799e1 * t2006 * t5027 - 0.77557027485162789330e0 * t2006 * t5030 + 0.24113022744329… in func_unpol()
1366 …t5158 = 0.11633554122774418400e2 * t2000 * t5027 + 0.38778513742581394665e1 * t2000 * t5030 - 0.12… in func_unpol()
1386 …t5030 + 0.24113022744329507342e0 * t2000 * t5034 + 0.72339068232988522025e-1 * t1985 * t5034 + 0.2… in func_unpol()
1387 …801324736646510396e1 * t1994 * t5027 + 0.23267108245548836799e1 * t1994 * t5030 - 0.96452090977318… in func_unpol()
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| H A D | gga_x_wpbeh.c | 2527 t5030 = t1919 * t1840; in func_unpol()
8986 t5030 = t753 * t4652; in func_ferr()
18417 t5030 = t1630 * t56; in func_pol()
18418 t5031 = t5030 * t925; in func_pol()
19600 t8500 = t5030 * t2224; in func_pol()
22253 t16231 = t5030 * t2874; in func_pol()
22254 t16233 = t5030 * t2877; in func_pol()
25573 t27547 = t5030 * t7747; in func_pol()
25574 t27549 = t5030 * t7750; in func_pol()
25576 t27553 = t5030 * t7753; in func_pol()
[all …]
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| H A D | gga_xc_b97.c | 1876 double t5016, t5018, t5019, t5022, t5023, t5026, t5029, t5030; in func_pol() local
4904 t5030 = t3538 * t691; in func_pol()
4908 …t5057 = (-0.8e1 / 0.27e2 * t5030 * t1173 + 0.16e2 / 0.9e1 * t5033 * t1111 * t345 + 0.4e1 / 0.9e1 *… in func_pol()
7369 …* t263 * t409 + 0.40e2 / 0.81e2 * t10355 * t691 * t3201 - 0.8e1 / 0.9e1 * t5030 * t345 * t1184 - 0… in func_pol()
7678 …t15361 = 0.40e2 / 0.81e2 * t10355 * t2224 * t1173 - 0.64e2 / 0.27e2 * t5030 * t345 * t1 * t1111 - … in func_pol()
7869 … t10355 * t6495 * t345 - 0.16e2 / 0.9e1 * t5768 * t1112 - 0.8e1 / 0.9e1 * t5030 * t2146 * t345 + 0… in func_pol()
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| H A D | gga_c_op_b88.c | 871 double t4978, t4983, t4985, t4987, t4989, t5012, t5019, t5030; in func_pol() local
3013 t5030 = t1228 * t1442; in func_pol()
3019 …36011538000000000000e1 * t418 * t4534 * t531 + 0.72023076000000000000e1 * t5030 - 0.72023076000000… in func_pol()
3081 …4017307000000000000e1 * t370 * t1077 * t5445 + 0.10803461400000000000e2 * t5030 - 0.27008653500000… in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 2047 double t5025, t5028, t5029, t5030, t5033, t5034, t5037, t5038; in func_pol() local
5360 t5030 = t5029 * t5018; in func_pol()
5367 …t5030 + 0.66355200000000000000e-9 * t2050 * t5034 - 0.33177600000000000000e-11 * t892 * t5038 + 0.… in func_pol()
10004 …800000000000000e-6 * t2399 * t19341 - 0.98304000000000000000e-7 * t2377 * t5030 + 0.29491200000000… in func_pol()
12049 …000000000000000e-4 * t7768 * t35774 + 0.36864000000000000000e-7 * t1326 * t5030 - 0.11059200000000… in func_pol()
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| H A D | gga_c_pbeloc.c | 2118 double t5030, t5035, t5045, t5046, t5047, t5055, t5058, t5065; in func_pol() local
5355 t5030 = t5029 * t1028; in func_pol()
5357 …012 * t1477 + 0.82246703342411321825e-2 * t4249 + t4252 + 0.2e1 * t1105 * t5030 + 0.16449340668482… in func_pol()
8281 …5029 * t824 + t16165 + 0.25587863262083522346e0 * t13896 - t14395 + t16167 + 0.4e1 * t2985 * t5030; in func_pol()
8664 …4 * t317 + 0.4e1 * t1105 * t5029 * t3266 + t3482 * t480 + 0.4e1 * t3629 * t5030 - 0.2e1 * t1115 * … in func_pol()
9365 t21290 = t441 * t4240 * t5030; in func_pol()
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| H A D | gga_x_sfat.c | 3180 double t5030, t5035, t5036, t5038, t5039, t5040, t5044, t5045; in func_pol() local
5467 t5030 = t121 * t1929; in func_pol()
5547 …e1 * t399 * t5023 - 0.2e1 / 0.3e1 * t5027 * t401 + 0.4e1 / 0.9e1 * t137 * t5030 - 0.4e1 / 0.3e1 * … in func_pol()
6737 t13226 = t397 * t5030 * M_PI; in func_pol()
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| H A D | gga_c_pw91.c | 2065 double t5023, t5026, t5028, t5030, t5033, t5036, t5038, t5039; in func_pol() local
5280 t5030 = t1093 * t5028 * t395; in func_pol()
5289 …* t5023 + 0.77534644304710291488e-2 * t5026 - 0.25844881434903430496e-2 * t5030 + 0.15506928860942… in func_pol()
8156 t15069 = 0.51689762869806860992e-2 * t5030; in func_pol()
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| H A D | gga_x_ityh.c | 2640 double t4997, t5020, t5021, t5030, t5049, t5054, t5061, t5069; in func_pol() local
4824 t5030 = t603 * t603; in func_pol()
4828 …59 * t2799 * t582 * t603 + 0.55999999999999999998e-2 * t23 * t29 * t581 * t5030 + 0.74666666666666… in func_pol()
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| H A D | gga_c_acggap.c | 4156 double t5017, t5020, t5022, t5025, t5027, t5028, t5030, t5032; in func_pol() local
8705 t5030 = t490 * t1044; in func_pol()
8706 t5032 = t382 * t1400 * t5030; in func_pol()
13207 … t4352 * t4353 * t5107 * t356 / 0.8e1 - 0.3e1 / 0.16e2 * t16154 * t8851 * t5030 * t356 + 0.7e1 / 0… in func_pol()
13456 …6 * t1099 * t17255 * t906 - 0.455e3 / 0.1296e4 * t17260 - t4352 * t4353 * t5030 * t285 / 0.8e1 - 0… in func_pol()
14466 …9473944e-3 * t21912 + 0.51448821741683684367e-2 * t4974 * t1150 * t6299 * t5030 - 0.35e2 / 0.432e3… in func_pol()
14643 …099 * t6155 * t5134 - 0.10289764348336736873e-1 * t3506 * t1099 * t6155 * t5030 + 0.34299214494455… in func_pol()
16772 t33590 = t7548 * t1150 * t7323 * t5030; in func_pol()
17361 t34850 = t7548 * t1099 * t8693 * t5030; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_pkzb.c | 1190 double t4966, t4967, t5006, t5024, t5025, t5030, t5041, t5042; in func_pol() local
3669 t5030 = t4068 * t49; in func_pol()
3675 …3e-2 * t1515 * t4039 * t5025 * t114 + 0.58257244444444444446e-2 * t1523 * t5030 * t5025 * t152 + 0… in func_pol()
3885 …5e-2 * t1515 * t4039 * t5163 * t114 - 0.13107880000000000000e-1 * t1523 * t5030 * t5163 * t152 - 0… in func_pol()
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| H A D | hyb_mgga_x_m05.c | 2306 double t5016, t5022, t5030, t5035, t5046, t5051, t5059, t5062; in func_pol() local
4822 t5030 = t85 * t4942 * t4945; in func_pol()
4825 …t5030 + 0.175000e6 / 0.27e2 * t65 * t4946 + 0.25000e5 / 0.27e2 * t5035 * t5016 + 0.250000e6 / 0.27… in func_pol()
4831 …74 * t5016 + 0.50000e5 / 0.9e1 * t246 * t5022 + 0.25000e5 / 0.9e1 * t59 * t5030 + 0.3575000e7 / 0.… in func_pol()
4838 …7 / 0.27e2 * t107 * t5102 * t4942 * t4945 + 0.175000e6 / 0.27e2 * t5107 * t5030 - 0.12320e5 / 0.27… in func_pol()
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| H A D | hyb_mgga_x_js18.c | 209 double t5010, t5011, t5026, t5028, t5030, t5033, t5034, t5039; in func_unpol() local
1984 t5030 = t3109 * t154; in func_unpol()
2422 …t6721 = -0.24e2 * t4525 * t2090 + 0.108e3 * t5030 * t2102 - 0.12e2 * t255 * t6700 + t683 * t1997 +… in func_unpol()
3240 … * t505 + 0.108e3 * t5030 * t3145 - 0.1296e4 * t13119 * t3152 - 0.48e2 * t4525 * t3091 - 0.1296e4 … in func_unpol()
3374 …t14476 = 0.324e3 * t5030 * t4050 + 0.54e2 * t9976 * t2102 + 0.108e3 * t9973 * t2102 + 0.108e3 * t5… in func_unpol()
4079 …t5030 * t6985 - 0.9e1 / 0.25e2 * t628 * t6926 - 0.9e1 / 0.50e2 * t628 * t7017 - 0.12e2 * t255 * t6… in func_unpol()
8676 double t5024, t5030, t5056, t5058, t5063, t5072, t5075, t5078; in func_pol() local
12008 …t5030 = -0.1105920e7 * t134 * t4919 + 0.1536e4 * t1401 * t954 - 0.11520e5 * t1403 * t954 + 0.16165… in func_pol()
14753 t14609 = t5030 * t525; in func_pol()
20010 t43235 = t5030 * t2006; in func_pol()
[all …]
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| H A D | hyb_mgga_x_dldf.c | 1233 double t4997, t4999, t5012, t5030, t5052, t5057, t5059, t5064; in func_pol() local
3456 t5030 = t1820 * t1873; in func_pol()
3458 …03333333333333e0 * t1835 * t1729 * t691 * t9 - 0.25705806666666666667e0 * t5030 - 0.64264516666666… in func_pol()
3477 …0 * t4935 - 0.25705806666666666667e0 * t5012 - 0.77117420000000000001e0 * t5030 + t4800 + 0.428430… in func_pol()
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| H A D | mgga_c_revtpss.c | 11732 t5030 = t274 * t5029; in func_pol()
17193 t19009 = t5030 * t1882; in func_pol()
18020 t21150 = t5030 * t3238; in func_pol()
28912 t74857 = t5030 * t8173; in func_pol()
28918 t74876 = t5030 * t8286; in func_pol()
28921 t74886 = t5030 * t8379; in func_pol()
28923 t74899 = t5030 * t8291; in func_pol()
29823 t79605 = t5030 * t10649; in func_pol()
29832 t79656 = t5030 * t10666; in func_pol()
31237 t87543 = t5030 * t14312; in func_pol()
[all …]
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| H A D | mgga_x_m08.c | 2833 double t5013, t5016, t5017, t5024, t5029, t5030, t5033, t5034; in func_pol() local
4669 t5030 = t5029 * tau[1]; in func_pol()
4684 … * t3728 * t5005 - 0.11200e5 / 0.3e1 * t1399 * t5009 + 0.1100e4 * t1514 * t5030 + 0.2420e4 * t551 … in func_pol()
4696 …5095 + 0.900e3 * t216 * t5030 - 0.2750e4 * t216 * t5042 - 0.2000e4 * t3756 * t5017 - 0.1400e4 * t3… in func_pol()
4711 …8 - 0.2750e4 * t252 * t5042 + 0.900e3 * t1647 * t5095 + 0.2000e4 * t614 * t5030 - 0.2000e4 * t3901… in func_pol()
4713 …t5325 = 0.1100e4 * t1654 * t5030 + 0.2420e4 * t619 * t5034 - 0.2750e4 * t3910 * t5038 - 0.30250e5 … in func_pol()
4714 …t5350 = 0.1620e4 * t609 * t5095 + 0.900e3 * t252 * t5030 + 0.60e2 * t238 * t5081 - 0.200e3 / 0.3e1… in func_pol()
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| H A D | mgga_x_sa_tpss.c | 3969 double t4996, t5010, t5026, t5030, t5037, t5041, t5042, t5047; in func_ferr() local
5910 t5030 = t175 * t481; in func_ferr()
5911 … * t1840 * t5026 - 0.25e2 / 0.54e2 * t1784 * t1831 * t5030 - 0.25e2 / 0.81e2 * t1784 * t1840 * t50… in func_ferr()
5915 … * t1923 * t5026 + 0.25e2 / 0.54e2 * t1784 * t1931 * t5030 + 0.25e2 / 0.81e2 * t1784 * t1923 * t50… in func_ferr()
6994 t13313 = t5030 * t783; in func_ferr()
7045 … * t7924 * t3990 + 0.25e2 / 0.54e2 * t1784 * t5097 * t5030 + 0.25e2 / 0.81e2 * t1784 * t5101 * t50… in func_ferr()
7257 …25e2 / 0.81e2 * t1784 * t7091 * t5030 + 0.25e2 / 0.18e2 * t1779 * t7091 * t5026 + 0.25e2 / 0.54e2 … in func_ferr()
7349 …* t7848 * t5030 - 0.100e3 / 0.243e3 * t1792 * t7830 * t4992 + 0.50e2 / 0.9e1 * t1779 * t7848 * t50… in func_ferr()
7626 double t5021, t5024, t5027, t5030, t5033, t5036, t5038, t5039; in func_pol() local
10351 t5030 = t271 * t4525 * t273; in func_pol()
[all …]
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| H A D | mgga_x_m11_l.c | 159 double t5030, t5041, t5042, t5045, t5046, t5061, t5064, t5067; in func_unpol() local
1364 t5030 = t5029 * tau[0]; in func_unpol()
1371 …1087 * t5030 + 0.3600e4 * t1099 * t4991 + 0.1400e4 * t110 * t4995 + 0.12960e5 * t1129 * t5009 + 0.… in func_unpol()
1384 …00e4 / 0.3e1 * t355 * t5073 - 0.200e3 * t110 * t5105 + 0.22000e5 * t391 * t5030 + 0.8800e4 * t140 … in func_unpol()
1387 … 0.200e3 * t1304 * t5073 + 0.6600e4 * t3215 * t5019 + 0.24200e5 * t1280 * t5030 + 0.40e2 * t158 * … in func_unpol()
1391 …t472 * t5019 + 0.6600e4 * t182 * t5030 + 0.4800e4 * t3204 * t5009 + 0.18000e5 * t1270 * t5019 + 0.… in func_unpol()
1396 … 0.12960e5 * t1505 * t5009 + 0.16200e5 * t565 * t5019 + 0.6600e4 * t220 * t5030 - 0.200e3 * t208 *… in func_unpol()
1399 …t5030 + 0.40e2 * t196 * t5140 + 0.160e3 * t199 * t4983 + 0.800e3 * t205 * t4991 + 0.1400e4 * t208 … in func_unpol()
1402 …t649 * t5019 + 0.6600e4 * t256 * t5030 + 0.4800e4 * t3749 * t5009 + 0.18000e5 * t1701 * t5019 + 0.… in func_unpol()
1403 …0.3600e4 * t1631 * t4991 + 0.6600e4 * t3758 * t5019 + 0.24200e5 * t1599 * t5030 + 0.29040e5 * t663… in func_unpol()
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| H A D | mgga_x_rtpss.c | 1593 double t4949, t4972, t5030, t5057, t5103, t5145, t5148, t5156; in func_ferr() local
2811 …t5030 = -0.135e3 / 0.32e2 * t1497 * t4172 - 0.675e3 / 0.32e2 * t1927 * t4711 + 0.225e3 / 0.4e1 * t… in func_ferr()
2812 …292e3 / 0.675e3 * t750 * t813 - 0.73e2 / 0.97200e5 * t5030 * t78 + 0.292e3 / 0.2025e4 * t62 * t503… in func_ferr()
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| H A D | mgga_x_mbrxc_bg.c | 303 double t5030, t5031, t5033, t5034, t5036, t5039, t5043, t5045; in func_unpol() local
3573 t5030 = t275 * t4956; in func_unpol()
3574 t5031 = t2948 * t5030; in func_unpol()
8962 t30518 = t20490 * t5030; in func_unpol()
9523 …e2 * t24765 * t5074 - 0.15e2 / 0.2e1 * t5619 * t5027 - 0.240e3 * t24577 * t5030 + 0.720e3 * t24471… in func_unpol()
11982 double t5022, t5029, t5030, t5033, t5035, t5037, t5040, t5041; in func_ferr() local
15219 t5030 = t1725 * t5029; in func_ferr()
20315 …- 0.2e1 * t28439 - t1685 * t6552 - t450 * t28442 + 0.112e3 * t5030 * t28325 + 0.28e2 * t5030 * t28… in func_ferr()
21113 t33282 = t5030 * t32025; in func_ferr()
22314 … t450 * t40615 - 0.4e1 * t424 * t40615 - 0.40e2 / 0.3e1 * t4648 * t39244 + 0.56e2 * t5030 * t38941; in func_ferr()
[all …]
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| H A D | mgga_c_bc95.c | 2348 double t5021, t5022, t5024, t5025, t5026, t5028, t5029, t5030; in func_pol() local
6006 t5030 = t5029 * t1269; in func_pol()
6033 …2 * t5022 - 0.55555555555555555556e0 * t5026 + 0.89344330548291861484e1 * t5030 + 0.17868866109658… in func_pol()
9438 …2 * t5022 - 0.11111111111111111111e1 * t5026 + 0.17868866109658372297e2 * t5030 + 0.35737732219316… in func_pol()
9833 …2 * t5022 - 0.16666666666666666667e1 * t5026 + 0.26803299164487558445e2 * t5030 + 0.53606598328975… in func_pol()
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| H A D | mgga_xc_b98.c | 258 double t5024, t5026, t5028, t5030, t5032, t5034, t5037, t5039; in func_unpol() local
2293 t5030 = t783 * t5018; in func_unpol()
2298 …* t5026 - 0.84845470888888888890e-3 * t5028 + 0.28444439506172839506e-3 * t5030 - 0.56888879012345… in func_unpol()
2385 …* t5026 + 0.33938188355555555556e-2 * t5028 - 0.11377775802469135803e-2 * t5030 + 0.22755551604938… in func_unpol()
5672 double t5030, t5032, t5034, t5036, t5038, t5040, t5043, t5044; in func_pol() local
10015 t5030 = t1779 * t1780 * t5028; in func_pol()
10028 …9327982623e4 * t5019 - 0.20000000000000000000e1 * t5022 - t5026 / 0.6e1 - t5030 / 0.6e1 + 0.388625… in func_pol()
15889 …7983947869e4 * t5019 - 0.60000000000000000000e1 * t5022 - t5026 / 0.2e1 - t5030 / 0.2e1 + 0.116587… in func_pol()
16353 …8655965246e4 * t5019 - 0.40000000000000000000e1 * t5022 - t5026 / 0.3e1 - t5030 / 0.3e1 + 0.777250… in func_pol()
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| H A D | mgga_c_b88.c | 2756 double t5030, t5031, t5032, t5033, t5034, t5035, t5036, t5037; in func_pol() local
6450 t5030 = t1621 * t5029; in func_pol()
6451 t5031 = 0.11760000000000000000e-1 * t5030; in func_pol()
9002 …t15574) + 0.39200000000000000000e-2 * t5024 + 0.23520000000000000000e-1 * t5030 + 0.56000000000000… in func_pol()
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| H A D | mgga_x_edmgga.c | 150 double t5002, t5013, t5020, t5030, t5040, t5053, t5063, t5076; in func_unpol() local
1292 t5030 = t1757 * t272; in func_unpol()
1293 …7139506171188e1 * t270 * t987 * t1819 - 0.76217237139506171188e1 * t270 * t5030 * t334 + 0.5311460… in func_unpol()
1504 …0642866950052e3 * t772 * t991 * t7138 - 0.22865171141851851357e2 * t270 * t5030 * t506 + 0.1661549… in func_unpol()
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