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Searched refs:t6091 (Results 1 – 25 of 43) sorted by relevance

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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_c_hcth_a.c1651 double t6068, t6069, t6072, t6075, t6091, t6093, t6094, t6099; in func_pol() local
4823 …t6091 = -t2977 - t4501 / 0.9e1 + t5064 / 0.18e2 - t5081 / 0.6e1 + t5091 / 0.12e2 - 0.5e1 / 0.54e2 … in func_pol()
4824 …t409 * t6034 + t409 * t6069 / 0.2e1 - 0.6e1 * t3222 * t6072 + 0.6e1 * t1162 * t6075 - t412 * t6091; in func_pol()
4830 t6121 = t372 * t374 * t6091; in func_pol()
7021 t16469 = t6091 * t366; in func_pol()
7025 …0 * t1044 * t6054 * t387 / 0.2e1 - t14784 / 0.3e1 + t139 * t372 * t1061 * t6091 * t387 / 0.2e1 + 0… in func_pol()
7050 … * t1162 * t1774 * t2088 + 0.6e1 * t1162 * t663 * t5133 + 0.2e1 * t1162 * t6091 * t387 + t2516 * t… in func_pol()
7052 …- 0.3e1 * t9600 * t6072 * t382 * t384 - 0.18e2 * t3222 * t16378 - t1155 * t6091 * t382 * t384 / 0.… in func_pol()
7285 … t18421 / 0.2e1 - 0.36e2 * t3222 * t2060 * t2088 + 0.8e1 * t1162 * t663 * t6091 - t412 * t18454 + … in func_pol()
7301 …36012866278355149e-2 * t2135 * t2088 + 0.22478670955426118383e-2 * t680 * t6091 + 0.11707641122617… in func_pol()
[all …]
H A Dgga_xc_th2.c563 double t6091, t6121, t6123, t6126, t6146, t6153, t6154, t6173; in func_pol() local
2131 …t6091 = -0.25437037037037037037e0 * t1127 * t706 + 0.15262222222222222222e0 * t1127 * t710 + 0.476… in func_pol()
2142 v4rho3sigma[8] = t5952 + t5981 + t6030 + t6059 + t6091 + t6121 + t6153 + t6185; in func_pol()
H A Dgga_c_zvpbeint.c2555 double t6079, t6080, t6083, t6084, t6085, t6088, t6091, t6094; in func_pol() local
6881 t6091 = 0.67471172535210825684e-1 * t855 * t1809 * t264; in func_pol()
6902 …e2 * t2495 * t509 - 0.6e1 * t725 * t2498 + 0.8e1 * t306 * t6102 + t6088 + t6091 + t6094 - t6097 - … in func_pol()
7012 …t6509 = t6088 + t6091 + t6094 - t6097 - t6100 - t6108 - t6111 + t6116 + t6118 - t6125 - t6127 - t6… in func_pol()
7350 …1 * t3089 * t2318 + 0.9e1 * t7651 * t509 - 0.3e1 * t7550 * t960 + t6088 + t6091 + t6094 - t6097 - … in func_pol()
7550 …t8390 = t6088 + t6091 + t6094 - t6097 - t6100 + t7714 - t7718 - t6111 + t7721 - t7723 + t6116 + t7… in func_pol()
7847 …t9781 = t6088 + t6091 + t6094 - t6097 - t6100 - t6111 - t9216 + t9217 + t6116 + t9251 - t9261 - t9… in func_pol()
8048 … * t4055 + 0.3e1 * t9316 * t963 - 0.3e1 * t9496 * t960 + t11092 + t6088 + t6091 + t6094 - t6097 - … in func_pol()
8092 …t11482 = t6088 + t6091 + t6094 - t6097 - t6100 - t6111 + t11092 + t7723 + t6116 - t7728 - t7730 - … in func_pol()
8245 …e1 * t414 * t12279 - t12354 - t12355 - t12362 - t12368 - t12372 + t6088 + t6091 + t6094 - t6097 - … in func_pol()
[all …]
H A Dgga_c_pbeloc.c2173 double t6076, t6077, t6078, t6081, t6085, t6086, t6091, t6092; in func_pol() local
5837 t6091 = t5671 * t420; in func_pol()
5838 t6092 = t4365 * t6091; in func_pol()
9331 t21171 = t4247 * t13501 * t6091; in func_pol()
9410 t21519 = t441 * t13483 * t6091; in func_pol()
9572 t22533 = t441 * t15734 * t6091; in func_pol()
10231 t24562 = t441 * t19389 * t6091; in func_pol()
10307 t24730 = t441 * t20151 * t6091; in func_pol()
H A Dgga_c_regtpss.c2570 double t6091, t6092, t6096, t6106, t6107, t6108, t6109, t6111; in func_pol() local
6230 t6091 = 0.40000000000000000000e1 * t1841; in func_pol()
6794 …2038 + 0.4e1 * t2589 + t6088 + 0.14035736694323150897e2 * t2255 + t6090 + t6091 + t6092 - 0.12e2 *… in func_pol()
6810 …t7953 = t6088 + 0.10526802520742363173e2 * t2255 + t6090 + t6091 + t6092 + 0.18e2 * t3351 - 0.9e1 … in func_pol()
7381 …0.70178683471615754484e1 * t2255 - 0.12e2 * t3439 + t6090 + 0.12e2 * t3442 + 0.4e1 * t3446 + t6091; in func_pol()
7831 …t2256 - 0.18e2 * t3439 + t6090 + 0.18e2 * t3442 + 0.6e1 * t3446 + t4310 + t6091 + t6092 - t4313 + … in func_pol()
8173 …t14313 = t6088 + t6090 + 0.8e1 * t4309 + t6091 + t6092 - 0.12e2 * t4312 + 0.36e2 * t4315 + 0.72e2 … in func_pol()
H A Dgga_c_zpbeint.c2116 double t6078, t6080, t6081, t6082, t6083, t6087, t6090, t6091; in func_pol() local
6106 t6091 = t1935 * t1637; in func_pol()
6107 t6092 = 0.86748650402413918736e-1 * t6091; in func_pol()
6513 t7604 = 0.65061487801810439052e-1 * t6091; in func_pol()
6771 t8621 = 0.43374325201206959367e-1 * t6091; in func_pol()
7090 t10432 = 0.21687162600603479684e-1 * t6091; in func_pol()
H A Dgga_c_zvpbeloc.c2292 double t6076, t6077, t6079, t6080, t6083, t6085, t6087, t6091; in func_pol() local
5874 t6091 = 0.7e1 / 0.576e3 * t5847; in func_pol()
5875 …7 - 0.32298204875312312682e-2 * t5833 + t5836 / 0.384e3 - t5843 / 0.384e3 - t6091 - t5849 / 0.96e2; in func_pol()
6039 …7 - 0.32298204875312312682e-2 * t6191 + t6194 / 0.384e3 - t6198 / 0.384e3 - t6091 - t6200 / 0.96e2; in func_pol()
H A Dgga_c_q2d.c1820 double t6015, t6028, t6052, t6065, t6072, t6091, t6093, t6098; in func_ferr() local
3497 …t6091 = -t2747 / 0.786432e6 + 0.77e2 / 0.2359296e7 * t2750 - 0.49e2 / 0.2304e4 * t2755 + t2757 / 0… in func_ferr()
3499 v4rho2sigma2[0] = t6072 + t6091; in func_ferr()
4045 double t6088, t6089, t6090, t6091, t6092, t6094, t6095, t6096; in func_pol() local
9267 t6091 = t1364 * t6090; in func_pol()
9268 t6092 = t1363 * t6091; in func_pol()
15201 t21289 = t4084 * t6091; in func_pol()
17773 t32249 = t7494 * t6091; in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_x_mn12.c3784 double t6091, t6092, t6095, t6096, t6099, t6106, t6109, t6112; in func_pol() local
6068 t6091 = t2186 * t599; in func_pol()
6069 t6092 = t1647 * t6091; in func_pol()
6074 t6109 = t1643 * t6091; in func_pol()
6075 t6112 = t615 * t6091; in func_pol()
6079 …t6091 + 0.4e1 * t5691 * t2164 + 0.4e1 * t1509 * t6091 + 0.2e1 * t1509 * t6095 + 0.12e2 * t1506 * t… in func_pol()
8247 t15379 = t5434 * t6091; in func_pol()
8252 t15415 = t5418 * t6091; in func_pol()
8267 …5447 + 0.6e1 * t1509 * t15453 + 0.12e2 * t5691 * t6091 + 0.6e1 * t5691 * t6095 + 0.36e2 * t5694 * … in func_pol()
8323 t16030 = t8382 * t6091; in func_pol()
[all …]
H A Dmgga_x_tm.c4269 double t6086, t6087, t6088, t6091, t6100, t6101, t6116, t6117; in func_pol() local
7041 t6091 = t3918 * t1615; in func_pol()
7048 … t587 + 0.12e2 * t5012 * t487 - 0.108e3 * t920 * t6073 - 0.324e3 * t920 * t6091 + t1668 - t5976 + … in func_pol()
7050 …71 - t6087 - 0.62888224691358024691e-1 * t6088 * t596 + 0.324e3 * t1209 * t6091 + t6124 * t187 - 0… in func_pol()
8940 …76 + 0.108e3 * t3394 * t6073 + 0.54e2 * t3394 * t6076 + 0.324e3 * t3394 * t6091 - 0.648e3 * t9347 … in func_pol()
8949 …691e-1 * t4337 * t150 * t596 - 0.24e2 * t4840 * t4325 + 0.324e3 * t3391 * t6091 - 0.24e2 * t4319 *… in func_pol()
8960 …88 - 0.108e3 * t2578 * t6073 - 0.54e2 * t2578 * t6076 - 0.324e3 * t2578 * t6091 - 0.108e3 * t3346 … in func_pol()
9688 …t20468 = -0.162e3 * t11998 * t1808 - 0.324e3 * t3346 * t6073 - 0.972e3 * t3346 * t6091 + 0.1944e4 … in func_pol()
9692 …6 + 0.324e3 * t15537 * t1808 - 0.36e2 * t4302 * t5973 + 0.972e3 * t4305 * t6091 + 0.162e3 * t4305 … in func_pol()
9694 …11 - 0.7776e4 * t3403 * t20401 + 0.162e3 * t3801 * t5682 + 0.972e3 * t4322 * t6091 - t6051 + t6078; in func_pol()
[all …]
H A Dmgga_x_gx.c2510 double t6034, t6041, t6046, t6051, t6066, t6069, t6091, t6094; in func_pol() local
5134 t6091 = t1371 * t437 * t43; in func_pol()
5150 …+ 0.250e3 / 0.243e3 * t2519 * t2522 + 0.625e3 / 0.2916e4 * t1008 * t454 * t6091 - 0.125e3 / 0.1296… in func_pol()
5307 … t2520 - 0.1625e4 / 0.243e3 * t2523 - 0.1250e4 / 0.729e3 * t1083 * t454 * t6091 + 0.125e3 / 0.162e… in func_pol()
5453 …1009 + 0.10000e5 / 0.243e3 * t2704 + 0.10000e5 / 0.729e3 * t1161 * t454 * t6091 - 0.500e3 / 0.81e2… in func_pol()
H A Dmgga_c_revtpss.c4899 double t6072, t6073, t6076, t6079, t6080, t6083, t6085, t6091; in func_pol() local
12216 t6091 = t1549 * t487; in func_pol()
12218 …t6097 = 0.3e1 * t1017 * t1558 + 0.3e1 * t1556 * t1019 + 0.6e1 * t392 * t6091 + 0.3e1 * t392 * t609… in func_pol()
20794 …t28704 = 0.3e1 * t6774 * t1019 + 0.6e1 * t1432 * t6091 + 0.3e1 * t1432 * t6094 + 0.3e1 * t5232 * t… in func_pol()
21001 …t29326 = 0.3e1 * t6937 * t1019 + 0.6e1 * t1538 * t6091 + 0.3e1 * t1538 * t6094 + 0.3e1 * t5551 * t… in func_pol()
38549 … t1019 + 0.3e1 * t29316 * t1334 + 0.3e1 * t6937 * t4117 + 0.6e1 * t6026 * t6091 + t125029 + t12503… in func_pol()
42937 …t29059 + 0.6e1 * t1432 * t29062 + 0.3e1 * t6774 * t5405 + 0.6e1 * t6505 * t6091 + 0.3e1 * t6505 * … in func_pol()
43287 …t146880 = 0.3e1 * t26265 * t1558 + 0.6e1 * t6557 * t6091 + 0.3e1 * t6557 * t6094 + 0.6e1 * t144768… in func_pol()
43525 … t1485 + 0.6e1 * t1538 * t29056 + 0.6e1 * t5551 * t6873 + 0.6e1 * t6665 * t6091 + t144810 + t14590… in func_pol()
45108 …t30418 + 0.3e1 * t28669 * t1579 + 0.6e1 * t5232 * t7025 + 0.6e1 * t6822 * t6091 + t153755 + t15375… in func_pol()
[all …]
H A Dmgga_c_b88.c2842 double t6085, t6086, t6087, t6089, t6090, t6091, t6093, t6095; in func_pol() local
7311 t6091 = t6090 * t439; in func_pol()
7312 t6093 = 0.11760000000000000000e-1 * t1621 * t6091; in func_pol()
9672 …t20066 = 0.19600000000000000000e-2 * t5023 * t6087 + 0.39200000000000000000e-2 * t5023 * t6091 - 0… in func_pol()
9678 …00e-2 * t1621 * t1561 * t197 * t439 - 0.11760000000000000000e-1 * t5016 * t6091 - 0.11760000000000… in func_pol()
9683 t20160 = 0.11760000000000000000e-1 * t5019 * t6091; in func_pol()
9807 …00000000e-2 * t1621 * t6086 * t1386 - 0.11760000000000000000e-1 * t5324 * t6091 - 0.11760000000000… in func_pol()
H A Dmgga_x_mvs.c2095 double t6055, t6060, t6062, t6064, t6073, t6091, t6093, t6095; in func_pol() local
5026 t6091 = t4465 * t831; in func_pol()
5031 … 0.4608e4 - t1660 * t2173 / 0.432e3 + 0.19e2 / 0.5184e4 * t2140 * t1656 + t6091 / 0.6912e4 + t6093… in func_pol()
5084 …736e5 - t5870 * t1755 / 0.1728e4 - t559 * t261 * t313 * t4921 / 0.288e3 + t6091 / 0.2304e4 + t6093… in func_pol()
H A Dmgga_c_m05.c3274 double t6085, t6086, t6088, t6090, t6091, t6092, t6093, t6094; in func_pol() local
7375 t6091 = t3702 * t2133; in func_pol()
7376 t6092 = t24 * t6091; in func_pol()
11366 t17495 = t24 * t6091 * t3706; in func_pol()
11451 …t2129 * t361 + 0.20690405167709360120e4 * t309 * t6091 * t6093 + 0.20690405167709360120e4 * t328 *… in func_pol()
11481 …6491876992155210402e2 * t6132 * t6157 + 0.31035607751564040180e4 * t626 * t6091 * t6093 + 0.150000… in func_pol()
11756 …0000e1 * t128 * t1049 * t7093 * t1816 + 0.31035607751564040180e4 * t635 * t6091 * t6093 + 0.482459… in func_pol()
H A Dmgga_x_scanl.c15208 t6091 = t573 * t249; in func_pol()
15209 t6092 = t6091 * t580; in func_pol()
16081 t8315 = t6091 * t786; in func_pol()
16477 t9501 = t6091 * t933; in func_pol()
19116 t20086 = t6091 * t1562; in func_pol()
19119 t20093 = t6091 * t1565; in func_pol()
19222 t20531 = t6091 * t1557; in func_pol()
20241 t26385 = t6091 * t2079; in func_pol()
20887 t30594 = t6091 * t2488; in func_pol()
21984 t36929 = t6091 * t2843; in func_pol()
[all …]
H A Dmgga_x_edmgga.c1805 double t6052, t6071, t6079, t6082, t6087, t6091, t6093, t6118; in func_ferr() local
3008 t6091 = t2109 * t82; in func_ferr()
3009 …114238683127572e-1 * t1868 + 0.20268187404037972270e-3 * t1871 + 0.22520208226708858078e-4 * t6091; in func_ferr()
3032 …4445695473251028e0 * t1868 - 0.81072749616151889080e-3 * t1871 - 0.90080832906835432311e-4 * t6091; in func_ferr()
3055 …7782781893004115e0 * t1868 + 0.32429099846460755632e-2 * t1871 + 0.36032333162734172925e-3 * t6091; in func_ferr()
3069 …1113112757201646e1 * t1868 - 0.12971639938584302253e-1 * t1871 - 0.14412933265093669170e-2 * t6091; in func_ferr()
H A Dmgga_k_pc07.c8156 double t6065, t6069, t6073, t6079, t6084, t6091, t6092, t6093; in func_pol() local
11459 t6091 = t2496 * t141; in func_pol()
11478 … t1328 - 0.2e1 * t1315 * t1332 + 0.3e1 * t2488 * t1834 - 0.15e2 / 0.2e1 * t6091 * t6093 + 0.6e1 * … in func_pol()
11986 …084 * t1675 + t7546 / 0.2592e4 + 0.3e1 * t3207 * t1834 - 0.15e2 / 0.2e1 * t6091 * t7550 + 0.6e1 * … in func_pol()
14772 …t20942 = 0.3e1 / 0.2e1 * t812 * t1837 * t837 - 0.15e2 / 0.2e1 * t6091 * t6092 * t837 + 0.3e1 * t60… in func_pol()
14775 …279 * t38 * t121 * t813 - 0.30e2 * t3963 * t6092 * t330 * t319 - 0.30e2 * t6091 * t6106 * t330 * t… in func_pol()
16096 …e5 * t5366 * t7584 + 0.5e1 / 0.17496e5 * t5369 * t7584 - 0.15e2 / 0.2e1 * t6091 * t6092 * t1107 + … in func_pol()
16115 … t20931 * t6092 * t1084 - 0.15e2 * t3963 * t6092 * t429 * t319 - 0.15e2 * t6091 * t6106 * t25292 -… in func_pol()
16575 …e1 * t30467 * t6093 + 0.105e3 / 0.2e1 * t30470 * t30471 * t330 - 0.45e2 * t6091 * t30471 * t319 - … in func_pol()
17329 …8e4 * t7024 * t7584 + 0.5e1 / 0.8748e4 * t7034 * t7584 - 0.15e2 / 0.2e1 * t6091 * t6092 * t1510 - … in func_pol()
[all …]
H A Dmgga_x_sa_tpss.c7666 double t6081, t6085, t6089, t6091, t6092, t6096, t6099, t6102; in func_pol() local
10725 t6091 = t1205 * t904; in func_pol()
10726 t6092 = t6091 * t1253; in func_pol()
13670 …- 0.2e1 * t17049 + t17053 + t565 * t3848 * t904 * t3226 / 0.9e1 - t5064 * t6091 * t3235 / 0.2e1 - … in func_pol()
13687 …17110 / 0.6e1 + t5064 * t17112 * t3850 / 0.9e1 + t14813 * t6091 * t3863 / 0.3e1 - t5064 * t6091 * … in func_pol()
13699 …t6091 * t3909 / 0.3e1 - 0.4e1 / 0.3e1 * t17178 - t5064 * t1205 * t2369 * t1253 / 0.3e1 + t5074 * t… in func_pol()
13794 … * t3974 / 0.2e1 - 0.3e1 / 0.2e1 * t565 * t1801 * t2369 * t1296 - t5064 * t6091 * t3997 / 0.2e1 + … in func_pol()
H A Dmgga_x_m11.c3111 double t6073, t6075, t6078, t6081, t6083, t6087, t6091, t6095; in func_pol() local
5692 t6091 = t671 * t2597; in func_pol()
5755 … 0.16e2 / 0.243e3 * t375 * t1247 * t6087 + 0.4e1 / 0.81e2 * t375 * t622 * t6091 + 0.4e1 / 0.81e2 *… in func_pol()
8082 t16208 = t375 * t1237 * t6091; in func_pol()
8089 …0.243e3 * t375 * t1247 * t6083 * t623 - 0.32e2 / 0.243e3 * t375 * t1247 * t6091 * t623 + 0.128e3 /… in func_pol()
H A Dmgga_x_mvsb.c2533 double t6077, t6081, t6082, t6091, t6104, t6106, t6107, t6115; in func_pol() local
5656 …t6091 = -t6061 * t94 - 0.20e2 / 0.3e1 * t2217 * t239 - 0.100e3 / 0.3e1 * t6065 * t708 + 0.80e2 / 0… in func_pol()
5681 …t6247 = params->k0 * t6091 * t112 - t2180 * t281 + 0.15e2 / 0.8e1 * t714 * t722 - 0.3e1 / 0.2e1 * … in func_pol()
H A Dmgga_c_bc95.c2434 double t6086, t6088, t6090, t6091, t6093, t6095, t6097, t6100; in func_pol() local
6705 t6091 = t3898 * t6090; in func_pol()
6722 … - t6086 + 0.17272611111111111111e-1 * t6088 - 0.11168041318536482685e1 * t6091 + 0.69444444444444… in func_pol()
10139 t19992 = 0.22336082637072965370e1 * t6091; in func_pol()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F389 t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & local
2631 t6091 = 0.3333333334e0_dp*t5745 - t5749 - t5752 - t5756 + t5760 + 0.1666666667e0_dp &
2667 *t144*t46*(t5423 + t5742 + t6091 + t6162) - t6170 &
3168 t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & local
5407 t6091 = 0.3333333334e0_dp*t5745 - t5749 - t5752 - t5756 + t5760 + 0.1666666667e0_dp &
5443 *t144*t46*(t5423 + t5742 + t6091 + t6162) - t6170 &
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F389 t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & local
2631 t6091 = 0.3333333334e0_dp*t5745 - t5749 - t5752 - t5756 + t5760 + 0.1666666667e0_dp &
2667 *t144*t46*(t5423 + t5742 + t6091 + t6162) - t6170 &
3168 t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & local
5407 t6091 = 0.3333333334e0_dp*t5745 - t5749 - t5752 - t5756 + t5760 + 0.1666666667e0_dp &
5443 *t144*t46*(t5423 + t5742 + t6091 + t6162) - t6170 &
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_pmgb06.c1674 double t6090, t6091, t6093, t6094, t6097, t6098, t6102, t6103; in func_pol() local
5643 t6091 = t30 * t6090; in func_pol()
5644 …444444444444445e-2 * t6082 - 0.37783333333333333334e-2 * t6087 + 0.18891666666666666667e-2 * t6091; in func_pol()
5763 …* t5116 + 0.11997222222222222222e-1 * t6077 - 0.35991666666666666667e-1 * t6091 + 0.79981481481481… in func_pol()

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