/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_x_ev93.c | 978 double t5140, t5144, t5146, t5148, t5149, t5153, t5155, t5162; in func_pol() local 2801 t5153 = t127 * t686; in func_pol() 2802 t5155 = t170 * t5153 * t173; in func_pol() 2847 t5332 = t170 * t5153 * t190; in func_pol() 2848 t5335 = t217 * t5153 * t227; in func_pol() 2934 t5803 = 0.3e1 / 0.8e1 * t217 * t5153 * t280; in func_pol()
|
H A D | gga_x_n12.c | 1194 double t5119, t5140, t5141, t5149, t5153, t5154, t5155, t5157; in func_pol() local 2978 t5153 = t925 * t673 * t113 * t927; in func_pol() 2979 t5154 = t5153 / 0.9e1; in func_pol() 3144 …t6287 = t4922 / 0.3e1 - t4925 / 0.4e1 + 0.4e1 / 0.27e2 * t5140 + 0.4e1 / 0.27e2 * t5153 - 0.2e1 / … in func_pol()
|
H A D | gga_c_revtca.c | 1344 double t5140, t5141, t5146, t5152, t5153, t5157, t5161, t5162; in func_pol() local 4061 t5153 = 0.84424112434270181083e-2 * t5152; in func_pol() 4324 …5560 + 0.17340714588667575678e0 * t5138 + t5101 + t5481 + t5496 + t5500 - t5153 - 0.67749637688469… in func_pol() 4530 … - 0.44315159504372693399e0 * t5131 + 0.57802381962225252260e-1 * t5138 - t5153 - 0.39859834383863… in func_pol() 4788 … - 0.18793773902851780522e-2 * t6986 + 0.11271464482633924191e0 * t6989 - t5153 - 0.19929917191931… in func_pol() 4854 … - 0.56381321708555341564e-2 * t6986 + 0.33814393447901772571e0 * t6989 - t5153 + t5162 - t5170 - … in func_pol()
|
H A D | gga_c_pbeloc.c | 2122 double t5150, t5153, t5161, t5162, t5163, t5168, t5169, t5171; in func_pol() local 5394 t5153 = t358 * t1162; in func_pol() 5496 …v3rho2sigma[6] = 0.3e1 * t430 * t1304 * t5153 + 0.6e1 * t430 * t4595 * t1490 - 0.2e1 * t430 * t155… in func_pol() 5524 …v3rho2sigma[7] = 0.3e1 * t430 * t1438 * t5153 + 0.6e1 * t430 * t4957 * t1490 - 0.2e1 * t430 * t159… in func_pol() 8628 … t17666 * t4934 + 0.12e2 * t4580 * t4036 * t3331 + 0.3e1 * t430 * t4050 * t5153 + t14749 + 0.2e1 *… in func_pol() 8678 … * t6192 * t3134 + 0.6e1 * t4580 * t4405 * t3321 + 0.3e1 * t430 * t4419 * t5153 - 0.2e1 * t430 * t… in func_pol() 8690 …* t1556 * t3671 - 0.9e1 * t4055 * t1678 * t18359 + 0.9e1 * t430 * t4595 * t5153 + 0.3e1 * t16645 +… in func_pol() 8813 …+ 0.6e1 * t430 * t1597 * t3667 + 0.18e2 * t18322 + 0.9e1 * t430 * t4957 * t5153 + 0.18e2 * t18325 … in func_pol() 9487 … * t6323 * t5149 - 0.6e1 * t4055 * t6327 * t5149 + 0.3e1 * t430 * t5503 * t5153 - 0.2e1 * t21077 -… in func_pol() 9571 … * t1675 * t3671 - 0.6e1 * t4055 * t6192 * t6111 + 0.3e1 * t430 * t5658 * t5153 - 0.2e1 * t430 * t… in func_pol() [all …]
|
H A D | gga_x_hjs_b88_v2.c | 6651 double t5141, t5145, t5149, t5150, t5152, t5153, t5159, t5168; in func_pol() local 10134 t5153 = t5152 * t1166; in func_pol() 10139 …172 * t5136 + 0.2e1 / 0.3e1 * t19 * t25 * t5145 + t1241 * t5150 - t1251 * t5153 + 0.2e1 * t5169 * … in func_pol() 13636 …t5290 * t16800 - 0.4e1 * t5172 * t1865 - t4015 * t5153 - t1251 * t16806 + t1241 * t16808 - t4021 *… in func_pol() 13826 …t17384 = -t16511 + 0.2e1 * t5121 * t3143 + 0.4e1 * t5172 * t3143 - t4442 * t5153 + 0.2e1 / 0.3e1 *… in func_pol() 14217 … t25 * t19310 - 0.2e1 * t5121 * t5153 - t1251 * t19316 + 0.47459599999999999998e0 * t130 * t19318 … in func_pol() 19878 …t49852 = -0.2e1 * t12519 * t5153 - t1251 * t5152 * t12431 - 0.4e1 * t16898 * t1782 + 0.4e1 * t1671… in func_pol() 19971 …6666666e0 * t130 * t5091 * t1716 - 0.4e1 / 0.3e1 * t172 * t16618 * t1716 + t50567 - t12533 * t5153; in func_pol() 20578 …922 * t878 * t855 - 0.6e1 * t51152 * t3917 * t867 * t855 + 0.8e1 * t5172 * t10733 - t14536 * t5153; in func_pol() 21115 … * t5090 + 0.18e2 * t60634 * t5291 * t628 - 0.3e1 * t16646 * t5153 - 0.2e1 * t16714 * t5153 + t124… in func_pol() [all …]
|
H A D | gga_c_sogga11.c | 3076 double t5150, t5152, t5153, t5154, t5156, t5157, t5158, t5159; in func_pol() local 6292 t5153 = t5150 * t5152; in func_pol() 6293 t5154 = t1464 * t5153; in func_pol() 6342 t5211 = t1458 * t5153; in func_pol() 6433 t5333 = t1476 * t5153; in func_pol() 6438 t5341 = t1470 * t5153; in func_pol() 11009 t18725 = t5266 * t5153; in func_pol() 11236 t19089 = t5263 * t5153; in func_pol() 11370 t19319 = t5255 * t5153; in func_pol() 11408 t19390 = t5169 * t5153; in func_pol()
|
H A D | gga_x_sfat_pbe.c | 3416 double t5130, t5133, t5135, t5139, t5148, t5149, t5150, t5153; in func_pol() local 5964 t5153 = t1884 * t1173; in func_pol() 6009 …68e-2 * t5148 * t5150 - 0.23809347344345958820e-2 * t5153 * t5154 - 0.29466284676550034431e-2 * t5… in func_pol() 7710 …06e-2 * t5148 * t5721 - 0.99999258846253027051e-2 * t5153 * t5725 - 0.11602349591391576057e-1 * t5… in func_pol()
|
H A D | gga_x_chachiyo.c | 1451 double t5144, t5153, t5162, t5174, t5177, t5179, t5181, t5198; in func_pol() local 4471 …t5153 = -t1839 - 0.2e1 / 0.3e1 * t1562 - 0.2e1 / 0.9e1 * t1566 + 0.4e1 / 0.3e1 * t1572 + 0.14e2 / … in func_pol() 4574 v4rho4[3] = t5117 + t5123 + t5128 + t5137 + t5144 + t5153 + t5162 + t5653; in func_pol()
|
H A D | gga_c_hcth_a.c | 1604 double t5152, t5153, t5156, t5159, t5162, t5164, t5167, t5168; in func_pol() local 4441 t5153 = t1044 * t5152; in func_pol() 4463 …/ 0.9e1 * t4782 + t4789 - t3086 / 0.27e2 + t840 * t5149 / 0.12e2 + t840 * t5153 / 0.12e2 + t840 * … in func_pol() 6678 t14341 = t2834 * t5153; in func_pol()
|
H A D | gga_c_zpbeint.c | 2053 double t5148, t5149, t5150, t5151, t5152, t5153, t5154, t5155; in func_pol() local 5557 t5153 = t289 * t5152; in func_pol() 5587 …t5209 = t5147 + t5148 + t5149 - t5150 + t5153 + t5157 + t5192 - t5194 - t5197 - t5201 - t5205 + t5… in func_pol() 8510 …t5042 + t17423 - t17424 + 0.3e1 / 0.4e1 * t5053 + 0.4e1 * t5207 + 0.2e1 * t5153 - 0.9e1 / 0.2048e4… in func_pol() 8855 t19096 = -t5420 + t5416 + t5418 + t17423 - t17424 + t5149 + t5208 + t5456 + t5153 - t5136 + t5137; in func_pol()
|
H A D | hyb_gga_xc_wb97.c | 2053 double t5149, t5152, t5153, t5158, t5163, t5164, t5171, t5175; in func_pol() local 5407 t5153 = t2076 * t744; in func_pol() 5411 …* t325 * t5149 - 0.15779062500000000000e0 * t5152 * t5153 + 0.26472937500000000000e1 * t5158 * t51… in func_pol() 9817 …1 - 0.66182343750000000000e1 * t15102 * t1092 * t5153 + 0.23668593750000000000e0 * t15051 * t1092 … in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_x_erf.c | 585 double t5129, t5135, t5139, t5146, t5153, t5158, t5176, t5177; in func_pol() local 2373 t5153 = t174 * t665 * t1940; in func_pol() 2409 …5146 + 0.3e1 * t4964 + 0.16e2 / 0.27e2 * t4967 - 0.4e1 / 0.27e2 * t5219 + t5153 / 0.9e1 + t5228 / … in func_pol() 2842 …29 - 0.4e1 / 0.81e2 * t5139 + 0.20e2 / 0.243e3 * t5146 + 0.2e1 / 0.27e2 * t5153 - 0.200e3 / 0.729e… in func_pol()
|
H A D | lda_c_pmgb06.c | 1613 double t5146, t5147, t5148, t5149, t5151, t5152, t5153, t5155; in func_pol() local 5157 t5153 = t30 * t5152; in func_pol() 5160 …* t5144 + 0.15113333333333333334e-1 * t5149 - 0.37783333333333333334e-2 * t5153 - 0.37783333333333… in func_pol() 5310 …* t5127 + 0.95977777777777777779e-1 * t5137 + 0.71983333333333333334e-1 * t5153 + 0.14396666666666… in func_pol()
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_xc_b98.c | 10081 t5153 = t108 * t6 * t5151; in func_pol() 10082 t5154 = t5153 * t1948; in func_pol() 10233 t5432 = t5153 * t1701; in func_pol() 16136 t17846 = t5153 * t5183; in func_pol() 16139 t17852 = t5153 * t5201; in func_pol() 16175 t18092 = t5153 * t5502; in func_pol() 16177 t18096 = t5153 * t5508; in func_pol() 16504 t20176 = t5153 * t6263; in func_pol() 16508 t20218 = t5153 * t6248; in func_pol() 16676 t21763 = t5153 * t6492; in func_pol() [all …]
|
H A D | mgga_x_2d_prhg07.c | 2374 double t5145, t5146, t5153, t5159, t5160, t5167, t5168, t5176; in func_ferr() local 3851 t5153 = t75 * t964; in func_ferr() 3854 …+ t5146 * t1281 / 0.2e1 - t5146 * t1284 / 0.2e1 - t5146 * t1287 / 0.2e1 - t5153 * t51 * t340 / 0.2… in func_ferr() 4058 …45 + t1151 * t213 / 0.2e1 - t1151 * t216 / 0.2e1 - t1151 * t219 / 0.2e1 - t5153 * t58 * t340 / 0.2… in func_ferr() 4113 …45 + t1257 * t213 / 0.2e1 - t1257 * t216 / 0.2e1 - t1257 * t219 / 0.2e1 - t5153 * t63 * t340 / 0.2… in func_ferr() 4520 double t5142, t5145, t5150, t5153, t5156, t5159, t5171, t5180; in func_pol() local 8025 t5153 = t62 * t72 * t1210; in func_pol() 8028 …+ 0.3e1 / 0.4e1 * t262 * t4790 + 0.3e1 / 0.16e2 * t5150 - 0.3e1 / 0.4e1 * t5153 - 0.3e1 / 0.4e1 * … in func_pol() 8124 …t5142 + 0.9e1 / 0.32e2 * t5145 + 0.9e1 / 0.16e2 * t5150 - 0.9e1 / 0.8e1 * t5153 - 0.9e1 / 0.8e1 * … in func_pol()
|
H A D | hyb_mgga_x_m05.c | 2308 double t5121, t5129, t5147, t5148, t5153, t5158, t5163, t5171; in func_pol() local 4840 t5153 = t285 * t1799; in func_pol() 4847 …0e5 / 0.81e2 * t282 * t5148 - 0.49280e5 / 0.81e2 * t89 * t5153 - 0.6160e4 / 0.9e1 * t289 * t5153 -… in func_pol()
|
H A D | mgga_x_rtpss.c | 3121 double t5142, t5152, t5153, t5157, t5160, t5163, t5166, t5167; in func_pol() local 5928 t5153 = t5152 * t2003; in func_pol() 5937 …1 * t756 * t1993 - 0.9e1 / 0.4e1 * t756 * t1996 - 0.45e2 / 0.8e1 * t274 * t5153 + 0.27e2 / 0.4e1 *… in func_pol() 6225 …t1116 * t780 + 0.9e1 / 0.16e2 * t1108 * t1993 + 0.45e2 / 0.256e3 * t476 * t5153 - 0.27e2 / 0.128e3… in func_pol() 6407 … * t612 * t2014 - 0.11000e5 / 0.243e3 * t2643) - 0.45e2 / 0.32e2 * t609 * t5153 + 0.27e2 / 0.16e2 … in func_pol()
|
H A D | mgga_x_m06l.c | 2906 double t5153, t5154, t5156, t5158, t5161, t5163, t5165, t5166; in func_pol() local 5247 t5153 = t139 * t4050; in func_pol() 5248 t5154 = t5153 * t569; in func_pol() 6685 …148 * t10800 + 0.1562520138975642240e-5 * t7374 * t10915 + 0.8962848e-1 * t5153 * t10800 - 0.20919… in func_pol()
|
H A D | mgga_x_ms.c | 2921 double t5149, t5151, t5153, t5171, t5173, t5181, t5188, t5194; in func_pol() local 5619 t5153 = t670 * t1787; in func_pol() 5667 …/ 0.3e1 * t5145 + t5148 - 0.2e1 / 0.3e1 * t5149 - 0.4e1 * t5151 - 0.2e1 * t5153 - t274 * t504 * t7… in func_pol() 5688 …+ t5148 - 0.4e1 / 0.9e1 * t5149 - 0.4e1 / 0.3e1 * t5151 - 0.2e1 / 0.3e1 * t5153 - t5171 / 0.3e1 - … in func_pol()
|
H A D | mgga_x_scan.c | 3283 double t5150, t5151, t5153, t5154, t5156, t5158, t5160, t5161; in func_pol() local 6393 t5153 = 0.31310929687500000000e2 * t1316 * t5151; in func_pol() 6411 t5182 = -t5137 + t5139 - t5141 - t5143 + t5148 + t5153 + t5158 - t5165 + t5170 - t5175 + t5181; in func_pol() 8335 …v4rhosigma3[9] = -t5137 + t5139 - t5141 - t5143 + t5148 + t5153 + t5158 - t5165 + t5170 - t5175 + … in func_pol() 8384 …v4rhosigma3[19] = -t5137 + t5139 - t5141 - t5143 + t5148 + t5153 + t5158 - t5165 + t5170 - t5175 +… in func_pol()
|
H A D | mgga_c_m06l.c | 300 double t5145, t5152, t5153, t5154, t5158, t5159, t5160, t5165; in func_unpol() local 2633 t5153 = t163 * t5152; in func_unpol() 2643 …8 - 0.8136949760e10 / 0.27e2 * t2344 * t5145 + 0.9395240960e10 / 0.27e2 * t5153 * t5154 * t5158 * … in func_unpol() 2893 … * t1582 * t1123 - 0.37355520e8 * t3418 * t2598 + 0.146800640e9 / 0.3e1 * t5153 * t865 * t7440 * t… in func_unpol() 2978 …t8741 = -0.18350080e8 * t11 * t336 * t5153 * t5160 * t8661 - 0.30720e5 * t1110 * t327 * t8698 + 0.… in func_unpol() 3059 …t9580 = 0.6881280e7 * t11 * t5153 * t5160 * t81 * t9530 + 0.110592e6 * t1120 * t580 * sigma[0] - 0… in func_unpol() 5729 double t5149, t5151, t5152, t5153, t5155, t5157, t5158, t5159; in func_pol() local 10174 t5153 = t204 * t5152; in func_pol() 10190 …0 * t5143 + 0.20659000000000000000e1 * t5149 - 0.30988500000000000000e1 * t5153 - 0.51647500000000… in func_pol() 10206 … 0.27e2 * t5143 + 0.4e1 / 0.3e1 * t5149 - 0.2e1 / 0.3e1 * t5199 - 0.2e1 * t5153 + 0.2e1 * t5204 - … in func_pol() [all …]
|
H A D | mgga_c_bc95.c | 2358 double t5151, t5153, t5155, t5157, t5159, t5161, t5163, t5170; in func_pol() local 6080 t5153 = t1647 * t867; in func_pol() 6085 …* t5149 + 0.69444444444444444443e-1 * t5151 + 0.34722222222222222222e-1 * t5153 + 0.69444444444444… in func_pol() 9443 … * t5149 + 0.13888888888888888889e0 * t5151 + 0.69444444444444444444e-1 * t5153 + 0.13888888888888… in func_pol() 9838 …t17729 = 0.20833333333333333333e0 * t5151 + 0.10416666666666666667e0 * t5153 + 0.20833333333333333… in func_pol()
|
H A D | mgga_x_edmgga.c | 1795 double t5098, t5105, t5109, t5119, t5120, t5130, t5153, t5164; in func_ferr() local 2917 …t5153 = -0.82976344349436704324e-4 * t4837 + 0.20090475936879367331e-3 * t4840 + 0.421899994674466… in func_ferr() 2918 …* t1145 + 0.70819478890314631335e-1 * t44 * t94 * t5153 + 0.16615495624729559964e1 * t99 * t51 * t… in func_ferr() 2924 …7) + 0.24e2 * t3670 * t178 * t423 * t115 - 0.12e2 * t4987 * t1295 + t16 * t5153 * t61 - t89 * t185… in func_ferr()
|
H A D | mgga_x_rscan.c | 286 double t5116, t5127, t5130, t5132, t5135, t5153, t5156, t5171; in func_unpol() local 2920 t5153 = t1855 * t434; in func_unpol() 3272 …t5809 = 0.6e1 * t2370 * t1856 * t290 - 0.4e1 * t690 * t499 * t1289 + 0.2e1 * t690 * t5153 - 0.2e1 … in func_unpol() 7305 double t5130, t5131, t5142, t5143, t5148, t5149, t5152, t5153; in func_ferr() local 9914 t5153 = 0.348311290677600e3 * t5152; in func_ferr() 9917 …000e4 * t3763 * t1885 + t5149 - 0.68961006509096000000e3 * t905 * t1894 + t5153 - 0.67727195409533… in func_ferr() 10214 … t5660 - 0.18676e2 * t5663 - 0.26680e2 * t5666 + 0.16008e2 * t5669 - t5143 + t5149 + t5153 - t5157; in func_ferr() 10333 …27118400e3 * t2097 * t6249 + t5127 - t5128 - t5130 + t5131 - t5143 + t5149 + t5153 - t5157 - t5163; in func_ferr() 13035 …000000000000e2 * t18561 + t5127 - t5128 - t5130 + t5131 - t5143 + t5149 + t5153 - t5157 - t5163 - … in func_ferr() 13242 …0000000e2 * t18561 + t5127 - t5128 - t5130 + t5131 - t6954 + t6956 - t6960 - t5143 + t5149 + t5153; in func_ferr() [all …]
|
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_tb09.c | 194 double t5152, t5153, t5158, t5159, t5160, t5163, t5167, t5170; in func_unpol() local 1660 t5153 = 0.2e1 / 0.3e1 * t5152; in func_unpol() 1716 …549 * t740 + 0.4e1 / 0.3e1 * t675 * t518 + t5149 + 0.2e1 * t2528 * t186 - t5153 - 0.4e1 * t1943 * … in func_unpol() 1868 …t5907 = -0.2e1 / 0.3e1 * t140 * t4025 - t5393 + t5401 + t5149 - t5153 - t5653 - 0.8e1 * t2239 * t1… in func_unpol() 1997 …t6930 = -t6263 + t6264 + t5149 - t5153 - 0.4e1 / 0.3e1 * t1027 * t901 + 0.4e1 * t4460 * t960 + 0.4… in func_unpol()
|