| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_op_b88.c | 1061 double t16531, t16533, t16535, t16538, t16544, t16551, t16563, t16570; in func_pol() local
4659 t16544 = t3791 * t190; in func_pol()
4661 …t16544 - 0.50000000000000000000e0 * t434 * t15436 * t201 + t15174 - t15202 - 0.2667521333333333333… in func_pol()
4675 …0e1 * t370 * t4739 * t3872 + 0.10670085333333333333e1 * t15293 * t3789 * t16544 + 0.26675213333333… in func_pol()
|
| H A D | gga_c_pw91.c | 2472 double t16538, t16540, t16542, t16544, t16547, t16550, t16552, t16555; in func_pol() local
8637 t16544 = t4823 * t1488; in func_pol()
8644 … t16540 + 0.28213194496683950481e0 * t16542 - 0.14106597248341975240e1 * t16544 - 0.20863587575493… in func_pol()
8738 … t16540 + 0.56426388993367900962e0 * t16542 - 0.28213194496683950481e1 * t16544 - 0.41727175150986… in func_pol()
8810 … t16540 + 0.84639583490051851442e0 * t16542 - 0.42319791745025925720e1 * t16544 + 0.60852130428521… in func_pol()
8843 … t16540 + 0.16927916698010370288e1 * t16542 - 0.84639583490051851441e1 * t16544 + 0.12170426085704… in func_pol()
|
| H A D | gga_c_op_pw91.c | 1124 double t16544, t16557, t16561, t16575, t16580, t16581, t16592, t16596; in func_pol() local
4762 t16544 = t3432 * t783; in func_pol()
4763 …000000e-1 * t963 * t3423 * t16544 - 0.20036838000000000000e0 * t670 * t4219 - 0.200368380000000000… in func_pol()
|
| H A D | gga_c_optc.c | 3018 double t16521, t16528, t16531, t16535, t16536, t16541, t16544, t16545; in func_pol() local
11054 t16544 = t167 * t1084 * t101; in func_pol()
11055 t16545 = t16544 * t4638; in func_pol()
11262 t17290 = t16544 * t4987; in func_pol()
18608 t54019 = t16544 * t15494; in func_pol()
18620 t54059 = t16544 * t15485; in func_pol()
19311 t57163 = t16544 * t16342; in func_pol()
19318 t57185 = t16544 * t3026; in func_pol()
19548 t59193 = t16544 * t17271; in func_pol()
19550 t59203 = t16544 * t17287; in func_pol()
|
| H A D | gga_c_zpbeint.c | 2374 double t16542, t16543, t16544, t16547, t16548, t16556, t16561, t16565; in func_pol() local
8216 t16544 = 0.3e1 / 0.64e2 * t16543; in func_pol()
8221 …5014 - 0.6e1 * t2364 * t5020 + 0.4e1 * t2364 * t5027 - t16537 + t16542 + t16544 + t16548 + t16556 … in func_pol()
8734 …8301 - t18302 - 0.3e1 * t2942 * t5651 * t3411 - t2565 * t5055 + t16542 + t16544 + t17083 - 0.3e1 /… in func_pol()
|
| H A D | gga_c_regtpss.c | 2902 double t16542, t16544, t16546, t16562, t16565, t16568, t16573, t16577; in func_pol() local
8914 t16544 = 0.25702851531048074406e-1 * t15943 * t4754; in func_pol()
8915 …025e-1 * t16534 + t15047 - 0.73171657588172351096e-2 * t16536 - t16542 + t16544 - 0.25702851531048… in func_pol()
9215 … t4686 * t17408 + t15047 - 0.14634331517634470219e-1 * t16536 - t16542 + t16544 + 0.17347256376410… in func_pol()
|
| H A D | gga_x_hjs.c | 5089 double t16526, t16529, t16536, t16539, t16544, t16550, t16553, t16556; in func_pol() local
11582 t16544 = 0.10e2 / 0.27e2 * t7 * t15 * t1921 * t278; in func_pol()
11868 …t485 * t2038 * t1553 - 0.5e1 / 0.9e1 * t16536 + 0.2e1 / 0.3e1 * t16539 + t16544 - 0.2e1 * t7 * t48… in func_pol()
12248 …775 * t6359 * t1004 / 0.2e1 - 0.5e1 / 0.12e2 * t16536 + t16539 / 0.3e1 + t16544 - 0.5e1 / 0.36e2 *… in func_pol()
13494 …- t7 * t775 * t7126 * t1004 - 0.5e1 / 0.18e2 * t16536 + t16539 / 0.9e1 + t16544 - 0.4e1 / 0.9e1 * … in func_pol()
14210 …49 / 0.9e1 - t24152 / 0.3e1 + t24163 / 0.9e1 - 0.5e1 / 0.36e2 * t16536 + t16544 - 0.5e1 / 0.12e2 *… in func_pol()
14707 …0.2e1 / 0.9e1 * t24163 + 0.2e1 / 0.3e1 * t7160 * t2340 * t2933 * t2942 + t16544 - 0.5e1 / 0.9e1 * … in func_pol()
|
| H A D | gga_c_q2d.c | 4665 double t16534, t16535, t16544, t16549, t16553, t16555, t16557, t16567; in func_pol() local
14315 t16544 = t725 * t1107; in func_pol()
14318 …t14142 - 0.119e3 / 0.2304e4 * t14144 - 0.5e1 / 0.256e3 * t1662 * t1364 * t16544 * t321 + t1363 * t… in func_pol()
16604 t28302 = t7431 * t786 * t16544; in func_pol()
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_b88.c | 3026 double t16510, t16521, t16534, t16535, t16537, t16539, t16540, t16544; in func_pol() local
9143 t16544 = t734 * t1628; in func_pol()
9146 … 0.28000000000000000000e-1 * t4968 * t1387 + 0.28000000000000000000e-1 * t16544 * t387 + 0.2800000… in func_pol()
9196 … 0.56000000000000000000e-1 * t16317 * t440 + 0.56000000000000000000e-1 * t16544 * t440 + 0.5600000… in func_pol()
|
| H A D | mgga_c_bc95.c | 2747 double t16529, t16537, t16539, t16544, t16549, t16566, t16570, t16575; in func_pol() local
9681 t16544 = t1221 * t1688; in func_pol()
9685 …00000000000000e1 * t15440 + 0.60e2 * t12611 - 0.15000000000000000000e1 * t16544 - 0.36e2 * t12613 … in func_pol()
9785 …5 - 0.13888888888888888889e1 * t5535 * t645 + 0.83333333333333333334e0 * t16544 * t338 + 0.8333333… in func_pol()
|
| H A D | mgga_x_m11.c | 3355 double t16540, t16544, t16549, t16551, t16557, t16562, t16580, t16624; in func_pol() local
8124 t16544 = t737 * t6105; in func_pol()
8128 …0.4e1 / 0.9e1 * t1936 * t4048 * t16540 - 0.2e1 / 0.9e1 * t1936 * t2074 * t16544 + t16549 / 0.27e2 … in func_pol()
8133 …0.4e1 / 0.9e1 * t1978 * t3899 * t16540 + 0.2e1 / 0.9e1 * t1978 * t2114 * t16544 - 0.4e1 / 0.27e2 *… in func_pol()
|
| H A D | mgga_xc_b97mv.c | 4357 double t16513, t16533, t16536, t16542, t16544, t16557, t16558, t16559; in func_pol() local
12004 t16544 = t16542 * t5330 * tau[0]; in func_pol()
12020 …t16544 - 0.13878777173333333333e3 * t460 * t4138 * t16544 + 0.11492174506666666667e4 * t5381 * t16… in func_pol()
|
| H A D | hyb_mgga_x_pjs18.c | 3962 double t16468, t16484, t16503, t16513, t16518, t16537, t16538, t16544; in func_pol() local
9167 t16544 = 0.10e2 * t5005 * t4811; in func_pol()
9169 …960 - 0.9e1 / 0.4e1 * t4001 * t16538 - 0.9e1 / 0.4e1 * t13425 * t16513 - t16544 + 0.80e2 * t16545 … in func_pol()
9247 …t16972 = t5018 * t4811 / 0.2e1 - t16544 + 0.30e2 * t16545 - t1319 * t2114 - 0.2e1 * t413 * t5957 +… in func_pol()
|
| H A D | mgga_x_mn12.c | 4012 double t16522, t16544, t16550, t16567, t16577, t16585, t16592, t16597; in func_pol() local
8375 …t16544 = t14566 + t15693 / 0.3e1 + 0.2e1 / 0.9e1 * t16504 + t16507 / 0.9e1 + t16510 / 0.27e2 + t8 … in func_pol()
8429 …1 * t6883 + t10 * (t15841 + t15892 + t15920 + t15958 + t15981 + t16500 + t16544 + t17048) - t12771… in func_pol()
|
| H A D | mgga_x_br89_explicit.c | 507 double t16495, t16511, t16532, t16533, t16544, t16550, t16551, t16554; in func_unpol() local
4748 t16544 = t432 * t4846; in func_unpol()
4773 …543539376485192436e1 * t260 * t13929 - 0.43630618129455577308e1 * t431 * t16544 - 0.2e1 * t2607 * … in func_unpol()
6155 …2119616147070993697e1 * t189 * t5260 - 0.21815309064727788654e1 * t919 * t16544 + 0.31727180639306… in func_unpol()
7578 double t16518, t16529, t16541, t16544, t16547, t16557, t16562, t16566; in func_ferr() local
11563 t16544 = t2712 * t822; in func_ferr()
11564 …t275 * t2766 - 0.13410834675382986737e1 * t137 * t16541 - 0.13410834675382986737e1 * t137 * t16544; in func_ferr()
12301 …8477814095778070e-1 * t630 * t16541 - 0.55878477814095778070e-1 * t630 * t16544 + 0.10468511906653… in func_ferr()
12662 …527086688457466842e0 * t266 * t16541 - 0.33527086688457466842e0 * t266 * t16544 - 0.6e1 * t147 * t… in func_ferr()
12773 …054173376914933686e0 * t137 * t28139 - 0.67054173376914933686e0 * t331 * t16544 - 0.33527086688457… in func_ferr()
|
| H A D | mgga_x_sa_tpss.c | 7967 double t16544, t16545, t16548, t16558, t16570, t16571, t16585, t16590; in func_pol() local
13617 t16544 = t1069 * t2147; in func_pol()
13618 t16545 = t16544 * t331; in func_pol()
14244 t20818 = t16544 * t610; in func_pol()
|
| H A D | mgga_x_mbeef.c | 528 double t16525, t16532, t16534, t16536, t16540, t16542, t16544, t16546; in func_unpol() local
5685 t16544 = t2155 * t16238; in func_unpol()
5690 …0.9e1 * t16540 - 0.21896875e8 / 0.243e3 * t16542 - 0.175175e6 / 0.72e2 * t16544 + 0.175175e6 / 0.2… in func_unpol()
28773 double t16540, t16541, t16543, t16544, t16546, t16547, t16550, t16553; in func_pol() local
35870 t16544 = t16543 * t16006; in func_pol()
35878 … 0.16e2 * t16538 - 0.21896875e8 / 0.486e3 * t16541 - 0.21875e5 / 0.9e1 * t16544 + 0.8421875e7 / 0.… in func_pol()
35907 …/ 0.6561e4 * t16530 - 0.3125e4 / 0.486e3 * t16534 + 0.87500e5 / 0.81e2 * t16544 - 0.765625e6 / 0.1… in func_pol()
35965 …/ 0.6561e4 * t16530 + 0.1250e4 / 0.243e3 * t16534 - 0.25000e5 / 0.81e2 * t16544 + 0.1000e4 / 0.3e1… in func_pol()
36086 …t17653 - 0.75295636574074074074e-2 * t17656 - 0.57359294096875000000e0 * t16544 + 0.554588743e-7 *… in func_pol()
44757 …7e4 * t57800 + 0.50e2 / 0.3e1 * t57804 - 0.2500e4 / 0.3e1 * t57806 - 0.1000000e7 / 0.81e2 * t16544; in func_pol()
[all …]
|
| H A D | mgga_x_rscan.c | 15047 double t16544, t16548, t16549, t16551, t16556, t16558, t16559, t16569; in func_pol() local
23514 t16544 = t634 * t5860 * t624; in func_pol()
23527 …6666666667e2 * t5862 * t640 * t1868 * t5863 - 0.13194400000000000000e2 * t16544 * t5865 - 0.263888… in func_pol()
24007 …* t6053 - 0.21990666666666666666e1 * t19260 - 0.21990666666666666666e1 * t16544 * t6204 - 0.395832… in func_pol()
24946 …6 * t16556 * t4762 * t203 * sigma[0] * t193 + 0.12369750000000000000e1 * t16544 * t7448 + 0.123697… in func_pol()
25065 … - 0.32986000000000000000e1 * t7444 * t6209 + 0.41232500000000000000e0 * t16544 * t8508 + 0.123697… in func_pol()
|
| H A D | mgga_c_pkzb.c | 3416 double t16530, t16531, t16533, t16536, t16537, t16539, t16543, t16544; in func_pol() local
13009 t16544 = t16543 * t16530; in func_pol()
13010 t16546 = t55 * t5371 * t16544; in func_pol()
13042 …570666666666666668e0 * t16637 + 0.55570666666666666666e0 * t69 * t5453 * t16544 + 0.12349037037037… in func_pol()
|
| H A D | mgga_x_scanl.c | 11446 double t16532, t16539, t16542, t16544, t16547, t16548, t16549, t16556; in func_pol() local
18477 t16544 = t4785 * t2066 * t1560; in func_pol()
18493 …t16595 = -0.33758233860356468336e1 * t4784 * t16544 - 0.51005109676670195860e1 * t16547 * t16549 +… in func_pol()
19104 …1714526792369101e0 * t16495 * t8315 - 0.84395584650891170841e0 * t6225 * t16544 + 0.38253832257502… in func_pol()
19630 …14469352008581120e0 * t4770 * t7246 - 0.84395584650891170841e0 * t7287 * t16544 + 0.11378729917768… in func_pol()
|
| H A D | mgga_x_vt84.c | 7045 double t16530, t16531, t16544, t16547, t16562, t16567, t16568, t16571; in func_pol() local
12386 …t16544 = t6049 * t1267 + 0.23493497918454894154e0 * t4261 * t4517 + 0.99349999999999999993e0 * t45… in func_pol()
12499 …1124 / 0.2e1 - 0.3e1 / 0.8e1 * t522 * t604 * (t16426 + t16457 + t16497 + t16544 + t16805 + t16847 … in func_pol()
|
| H A D | mgga_x_br89.c | 29269 double t16535, t16536, t16537, t16538, t16541, t16542, t16543, t16544; in func_pol() local
46036 t16544 = 0.2e1 * t16543; in func_pol()
46057 …t16582 = t16438 - t16439 - t13 * t16531 + t16537 - t207 * t16538 - t16544 - t16547 - 0.4e1 * t1242… in func_pol()
47076 …t18145 = -t18123 - t18127 + t18129 + t16537 - t16544 - t16547 + t16560 - t16564 - t18131 + t18132 … in func_pol()
48283 …t20370 = t16537 - t16544 - t16547 + t16560 - t16564 + t20335 + t20357 - t20359 - t20361 + t20363 -… in func_pol()
68235 …t30418 * t108200 * t10920 + 0.6e1 * t30422 * t108200 * t10908 + t16537 - t16544 - t16547 + t16560 … in func_pol()
68390 …t109779 = t18120 - t18123 - t18127 + t18129 + t16537 - t16544 - t16547 + t16560 - t16564 - t18131 … in func_pol()
71211 …t126839 = 0.6e1 * t36337 * t15219 - 0.2e1 * t14885 * t93556 + t16537 - t16544 - t16547 + t16560 - … in func_pol()
72674 …2e1 * t1973 * t56778 - 0.22e2 / 0.9e1 * t15955 * t36314 + 0.4e1 * t1973 * t56805 + t16537 - t16544; in func_pol()
74678 …t94293 * t461 - t142365 + t142366 + t142368 + t16438 - t16439 + t16537 - t16544 - t16547 + t16560 … in func_pol()
[all …]
|
| H A D | hyb_mgga_xc_wb97mv.c | 4765 double t16541, t16543, t16544, t16546, t16547, t16549, t16551, t16553; in func_pol() local
13137 t16544 = t3154 * t16543; in func_pol()
13239 …2 - 0.3e1 / 0.32e2 * t16539 - 0.3e1 / 0.32e2 * t16541 + 0.3e1 / 0.16e2 * t16544 - t16547 / 0.32e2 … in func_pol()
20402 t55745 = 0.3e1 / 0.8e1 * t16544; in func_pol()
|
| H A D | mgga_c_tpssloc.c | 4763 double t16533, t16540, t16541, t16544, t16547, t16548, t16549, t16551; in func_pol() local
15815 t16544 = t4896 * t4900; in func_pol()
15835 …t4897 / 0.3e1 - t4893 * t4901 / 0.3e1 - t1378 * t16541 / 0.6e1 - t1378 * t16544 / 0.3e1 + 0.10e2 /… in func_pol()
27456 …2e1 - t16524 * t4897 - t16524 * t4901 - t4878 * t16541 / 0.2e1 - t4878 * t16544 - t65303 * t1381 /… in func_pol()
27464 …1379 * t65323 / 0.6e1 - t65327 * t1381 + t65331 + t65334 - t4893 * t16541 / 0.2e1 - t4893 * t16544; in func_pol()
27998 …t68507 = -t19576 * t4901 / 0.3e1 - t5520 * t16541 / 0.6e1 - t5520 * t16544 / 0.3e1 - t5520 * t1651… in func_pol()
28016 …4897 / 0.3e1 - t19567 * t4901 / 0.3e1 - t5508 * t16541 / 0.6e1 - t5508 * t16544 / 0.3e1 - t5508 * … in func_pol()
|
| H A D | mgga_c_scanl.c | 517 double t16531, t16534, t16541, t16544, t16560, t16590, t16593, t16599; in func_unpol() local
4659 t16544 = t506 * t1343; in func_unpol()
4660 …099374677576130e-1 * t768 * t16541 + 0.72665723658879309975e-1 * t2282 * t16544 + 0.23815645066952… in func_unpol()
5201 …0e1 * t4009 * t4889 + 0.461000314880e0 * t329 * t20816 + 0.21799717097663792992e0 * t2689 * t16544; in func_unpol()
5313 …9019874935515226e0 * t1177 * t16541 + 0.14533144731775861995e0 * t3028 * t16544 - 0.19594476351194… in func_unpol()
|