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Searched refs:t5317 (Results 1 – 25 of 43) sorted by relevance

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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F365 t5311, t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, & local
2328 t5317 = 0.3333333336e0_dp*t165*t3861*t561
2339 t5343 = -t5308 - t5311 - t5314 - t5317 - t5320 + t5323 - t5326 - t5329 &
2741 t6380 = -t5317 - t5320 + t5323 - t5326 - t5329 - 0.3333333336e0_dp*t83 &
3144 t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, t5342, & local
5104 t5317 = 0.3333333336e0_dp*t165*t3861*t561
5115 t5343 = -t5308 - t5311 - t5314 - t5317 - t5320 + t5323 - t5326 - t5329 &
5517 t6380 = -t5317 - t5320 + t5323 - t5326 - t5329 - 0.3333333336e0_dp*t83 &
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F365 t5311, t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, & local
2328 t5317 = 0.3333333336e0_dp*t165*t3861*t561
2339 t5343 = -t5308 - t5311 - t5314 - t5317 - t5320 + t5323 - t5326 - t5329 &
2741 t6380 = -t5317 - t5320 + t5323 - t5326 - t5329 - 0.3333333336e0_dp*t83 &
3144 t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, t5342, & local
5104 t5317 = 0.3333333336e0_dp*t165*t3861*t561
5115 t5343 = -t5308 - t5311 - t5314 - t5317 - t5320 + t5323 - t5326 - t5329 &
5517 t6380 = -t5317 - t5320 + t5323 - t5326 - t5329 - 0.3333333336e0_dp*t83 &
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_x_ev93.c981 double t5301, t5302, t5304, t5308, t5311, t5314, t5317, t5321; in func_pol() local
2844 t5317 = t217 * t4216 * t280; in func_pol()
2861 …- t5173 + t5186 - t5200 + t5308 / 0.8e1 - t5311 / 0.4e1 + t5314 / 0.8e1 + t5317 / 0.4e1 + t5350 + … in func_pol()
2886 …t5612 = -t5311 / 0.2e1 + t5314 / 0.4e1 + t5317 / 0.2e1 + t5321 / 0.2e1 - t5332 / 0.3e1 + t5335 / 0… in func_pol()
H A Dgga_c_lyp.c620 double t5314, t5315, t5317, t5318, t5320, t5325, t5328, t5334; in func_pol() local
2495 t5317 = t161 * t5243; in func_pol()
2496 t5318 = t76 * t5317; in func_pol()
2515 …- 0.80e2 / 0.3e1 * t5398 + 0.40e2 / 0.3e1 * t5310 + 0.40e2 / 0.9e1 * t5314 + 0.8e1 / 0.3e1 * t5317; in func_pol()
H A Dgga_c_acgga.c2800 double t5289, t5290, t5291, t5297, t5298, t5302, t5304, t5317; in func_pol() local
6513 …t5317 = -0.22005000000000000000e1 * t5287 + 0.22005000000000000000e1 * t5291 + 0.73350000000000000… in func_pol()
6514 t5319 = t330 * t368 * t5317; in func_pol()
6552 t5460 = t281 * t313 * t5317; in func_pol()
9772 t17622 = t367 * t5317; in func_pol()
9845 … * t368 * t5317 * t267 - 0.85748036236139473944e-3 * t361 * t330 * t802 * t5317 * t305 + 0.1286220… in func_pol()
9892 t18853 = t151 * t5317; in func_pol()
10047 …t5317 * t428 + 0.17149607247227894789e-1 * t995 * t330 * t331 * t19827 - 0.68598428988911579156e-2… in func_pol()
12582 t29478 = t114 * t5317; in func_pol()
12606 t29551 = t1723 * t119 * t1666 * t5317; in func_pol()
[all …]
H A Dgga_k_dk.c948 double t5246, t5248, t5250, t5252, t5279, t5283, t5284, t5317; in func_pol() local
2888 …t5317 = t299 * t684 * t468 / 0.3e1 + 0.2e1 / 0.3e1 * t5089 + t116 * t684 * t474 / 0.2e1 - t4797 - … in func_pol()
2890 …v4rho2sigma2[12] = t8 * t5317 + t1835 - 0.2e1 * t1838 + 0.2e1 * t1841 - t1844 + t4777 - t4786 + t4… in func_pol()
H A Dgga_c_scan_e0.c1654 double t5317, t5318, t5320, t5321, t5322, t5323, t5324, t5325; in func_pol() local
4490 t5317 = t1981 * t1282; in func_pol()
4491 t5318 = 0.21687162600603479684e-1 * t5317; in func_pol()
4981 t7420 = 0.43374325201206959368e-1 * t5317; in func_pol()
5099 t7915 = 0.65061487801810439052e-1 * t5317; in func_pol()
5268 t8979 = 0.86748650402413918736e-1 * t5317; in func_pol()
H A Dgga_c_bmk.c1527 double t5315, t5316, t5317, t5318, t5319, t5320, t5321, t5322; in func_pol() local
4357 t5317 = t1571 * t5316; in func_pol()
4358 t5318 = t1392 * t5317; in func_pol()
6422 … t4433 * t2009 + 0.48247024766806046961e2 * t2840 * t5317 + 0.48247024766806046961e2 * t2831 * t53… in func_pol()
6554 …09906722418784e3 * t4136 * t5317 - 0.12000000000000000000e2 * t896 * t1984 * t16551 + 0.1929880990… in func_pol()
H A Dgga_c_zvpbeint.c2487 double t5311, t5312, t5313, t5314, t5315, t5316, t5317, t5318; in func_pol() local
6285 t5317 = t1596 * t483; in func_pol()
6288 t5320 = t5317 * t5319; in func_pol()
6294 t5332 = t5317 * t141 * t147 * t148; in func_pol()
9806 t18950 = t5317 * t18949; in func_pol()
9819 t18978 = t5317 * t18977; in func_pol()
9840 t19038 = t5317 * t5318 * t337; in func_pol()
9850 t19066 = t5317 * t5318 * t365; in func_pol()
9865 t19104 = t5317 * t141 * t354 * t148; in func_pol()
10229 t20291 = t5317 * t20287 * t155 * t20267 * t1044; in func_pol()
H A Dgga_c_op_pbe.c880 double t5313, t5316, t5317, t5320, t5321, t5324, t5325, t5328; in func_pol() local
3129 t5317 = t3894 * t5306; in func_pol()
3141 …t5317 - 0.42078207933240974708e0 * t495 * t5321 - 0.15148154855966750895e2 * t5325 * t497 + 0.2285… in func_pol()
H A Dgga_c_pw91.c2080 double t5317, t5320, t5323, t5329, t5330, t5334, t5342, t5353; in func_pol() local
5400 t5317 = t4961 * t5175; in func_pol()
5409 …636233534648050268e1 * t3335 * t1810 - 0.16690870060394415080e2 * t1261 * t5317 + 0.55636233534648… in func_pol()
8507 …77660320e2 * t1261 * t14910 * t15496 - 0.33381740120788830160e2 * t3335 * t5317 + 0.55636233534648… in func_pol()
8732 …127246706929610054e2 * t3977 * t5323 - 0.33381740120788830162e2 * t3977 * t5317 - 0.55636233534648… in func_pol()
9158 …636233534648050268e1 * t5159 * t5320 - 0.16690870060394415080e2 * t5159 * t5317 + 0.60456845350037… in func_pol()
9191 …127246706929610054e2 * t5301 * t5330 - 0.33381740120788830162e2 * t5301 * t5317 - 0.30672273446566… in func_pol()
H A Dgga_c_pbe_vwn.c2107 double t5314, t5316, t5317, t5318, t5319, t5320, t5321, t5323; in func_pol() local
4912 t5317 = t878 * t576; in func_pol()
4913 t5318 = 0.72e2 * t5317; in func_pol()
5238 t6695 = 0.36e2 * t5317; in func_pol()
5473 t7817 = 0.12e2 * t5317; in func_pol()
H A Dgga_c_sogga11.c3092 double t5309, t5311, t5312, t5314, t5315, t5317, t5318, t5320; in func_pol() local
6423 t5317 = t5150 * t5177; in func_pol()
6424 t5318 = t1461 * t5317; in func_pol()
6456 t5368 = t1467 * t5317; in func_pol()
6479 t5405 = t1473 * t5317; in func_pol()
10985 t18684 = t5172 * t5317; in func_pol()
11146 t18947 = t5260 * t5317; in func_pol()
11164 t18975 = t5269 * t5317; in func_pol()
H A Dgga_x_wpbeh.c9110 t5317 = t653 * t5316; in func_ferr()
18540 t5317 = t398 * t1737; in func_pol()
18541 t5318 = t5317 * t1178; in func_pol()
21825 t14835 = t5317 * t3862; in func_pol()
21827 t14839 = t5317 * t3886; in func_pol()
22003 t15570 = t5317 * t3884; in func_pol()
23410 t20126 = t5317 * t5275; in func_pol()
24245 t22967 = t5317 * t6640; in func_pol()
24292 t23189 = t5317 * t6618; in func_pol()
31427 t52894 = t5317 * t11236; in func_pol()
[all …]
H A Dgga_x_sfat_pbe.c3427 double t5316, t5317, t5318, t5319, t5321, t5322, t5326, t5330; in func_pol() local
6046 t5317 = t455 * t5316; in func_pol()
6047 t5318 = 0.21631064964918420532e-3 * t5317; in func_pol()
7488 …* t5298 + 0.10815532482459210266e-3 * t5305 - 0.43262129929836841064e-3 * t5317 + 0.11824832552879… in func_pol()
H A Dgga_c_zpbeint.c2067 double t5317, t5318, t5319, t5320, t5321, t5322, t5323, t5326; in func_pol() local
5673 t5317 = t291 * t5316; in func_pol()
5674 t5318 = 0.2e1 * t5317; in func_pol()
8966 …221 + t19249 + t19269 + t19469) + 0.2e1 * t5308 + 0.4e1 * t5321 - 0.4e1 * t5317 - 0.6e1 * t5313 - … in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_vwn_3.c969 double t5285, t5297, t5312, t5315, t5317, t5319, t5330, t5332; in func_pol() local
3012 t5317 = t238 * t2523; in func_pol()
3022 …t5352 = -t4819 / 0.3e1 - t5312 / 0.24e2 - t4821 / 0.4e1 - t5315 / 0.24e2 - t5317 / 0.12e2 - t5319 … in func_pol()
3087 …t5808 = -t4820 - t5312 / 0.8e1 - 0.3e1 / 0.8e1 * t4821 - t5315 / 0.8e1 - t5317 / 0.8e1 - t5319 / 0… in func_pol()
H A Dlda_c_pmgb06.c1626 double t5308, t5310, t5311, t5312, t5314, t5316, t5317, t5319; in func_pol() local
5261 t5317 = t146 * t4685; in func_pol()
5262 t5319 = 0.8e1 / 0.81e2 * t5316 * t5317; in func_pol()
7654 t11044 = t11043 * t5317; in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_x_mggac.c3676 t5317 = t5316 * t5298; in func_unpol()
31628 t5317 = t5316 * t1225; in func_pol()
31630 t5319 = t5317 * t5318; in func_pol()
31648 t5337 = t5317 * t138; in func_pol()
31878 t5611 = t5610 * t5317; in func_pol()
31945 t5736 = t5317 * t1259; in func_pol()
33399 t7745 = t5317 * t7744; in func_pol()
33661 t8019 = t5317 * t145; in func_pol()
33946 t8430 = t5317 * t8334; in func_pol()
34079 t8644 = t5317 * t139; in func_pol()
[all …]
H A Dmgga_x_m11.c1592 double t5302, t5309, t5317, t5322, t5326, t5337, t5368, t5398; in func_ferr() local
2680 t5317 = t738 * t5217 * t625; in func_ferr()
2683 … * t321 * t5259 + 0.165000e6 * t719 * t5265 + 0.440000e6 / 0.3e1 * t321 * t5317 + 0.14000e5 / 0.3e… in func_ferr()
2690 …t5317 + 0.629200e6 / 0.3e1 * t328 * t5403 - 0.80080e5 / 0.3e1 * t149 * t5412 + 0.200200e6 / 0.3e1 … in func_ferr()
2692 …* t5249 + 0.143000e6 / 0.3e1 * t188 * t5403 - 0.67760e5 * t396 * t5398 + 0.242000e6 * t858 * t5317; in func_ferr()
2693 … 0.15400e5 * t185 * t5259 + 0.99000e5 * t386 * t5265 + 0.33000e5 * t185 * t5317 - 0.154000e6 / 0.3… in func_ferr()
2694 …t5581 = 0.440000e6 / 0.3e1 * t391 * t5317 - 0.61600e5 / 0.3e1 * t188 * t5398 + 0.10000e5 / 0.3e1 *… in func_ferr()
3078 double t5315, t5317, t5319, t5320, t5324, t5328, t5335, t5336; in func_pol() local
5420 t5317 = t45 * t3895 * t2118; in func_pol()
5425 …4e1 / 0.27e2 * t4016 + 0.4e1 / 0.81e2 * t5311 + t5315 - 0.20e2 / 0.27e2 * t5317 - 0.8e1 / 0.81e2 *… in func_pol()
[all …]
H A Dmgga_x_scanl.c7868 t5317 = t2836 * t1226; in func_ferr()
14854 t5317 = t390 * t100; in func_pol()
14855 t5318 = t1780 * t5317; in func_pol()
15441 t6720 = t2269 * t5317; in func_pol()
16327 t9122 = t5317 * t1773; in func_pol()
18137 t14708 = t3779 * t5317; in func_pol()
18794 t18181 = t5343 * t5317; in func_pol()
18820 t18377 = t5317 * t397; in func_pol()
19350 t21419 = t6610 * t5317; in func_pol()
19887 t24365 = t7741 * t5317; in func_pol()
[all …]
H A Dmgga_x_mvsb.c2520 double t5307, t5317, t5325, t5343, t5353, t5362, t5383, t5390; in func_pol() local
5544 t5317 = t8 * t579 * t618 * t1259; in func_pol()
5547 …985 * t4997 * t63 * t5307 / 0.1296e4 - t1909 * t1911 * t1799 / 0.2592e4 + t5317 * t9 * params->b *… in func_pol()
5608 …31 * t651 / 0.1728e4 + t5299 * t674 * params->b * t31 * t651 / 0.2592e4 + t5317 * t1911 * t116 * t… in func_pol()
5845 …2 / 0.20736e5 + t7261 + t1909 * t2549 * t2606 * t234 * t591 / 0.13824e5 - t5317 * t2549 * t2606 * … in func_pol()
5893 …89 * t217 / 0.13824e5 - t5299 * t2549 * t2606 * t674 * t217 / 0.20736e5 - t5317 * t2549 * t2606 * … in func_pol()
H A Dhyb_mgga_x_js18.c4421 double t5299, t5302, t5314, t5317, t5323, t5328, t5349, t5350; in func_ferr() local
6262 t5317 = t37 * t640 * t1618; in func_ferr()
7663 … 0.146e3 / 0.81e2 * t5294 - 0.292e3 / 0.81e2 * t5297 - 0.146e3 / 0.81e2 * t5317 + 0.292e3 / 0.135e… in func_ferr()
8685 double t5308, t5309, t5310, t5313, t5314, t5317, t5320, t5323; in func_pol() local
12090 t5317 = t1587 * t41; in func_pol()
12106 …310 * t373 - 0.10531842222222222222e-1 * t372 * t5314 - 0.14e2 / 0.81e2 * t5317 * t1192 - 0.731046… in func_pol()
15155 … * t16143 - 0.10531842222222222222e-1 * t372 * t16149 - 0.14e2 / 0.81e2 * t5317 * t4005 + 0.389891… in func_pol()
16018 …8e2 / 0.81e2 * t16599 * t1593 - 0.28e2 / 0.81e2 * t16602 * t1593 - 0.28e2 / 0.81e2 * t5317 * t5236; in func_pol()
16826 …* t22894 + 0.54828508950617283951e-1 * t22897 * t340 + 0.98e2 / 0.135e3 * t5317 * t6296 + 0.307039… in func_pol()
22037 …392e3 / 0.405e3 * t16602 * t5333 + 0.392e3 / 0.405e3 * t5317 * t16819 + 0.196e3 / 0.405e3 * t5317 … in func_pol()
[all …]
H A Dmgga_x_task.c3272 double t5311, t5314, t5317, t5320, t5323, t5330, t5337, t5338; in func_pol() local
6013 t5317 = t63 * t425; in func_pol()
6017 …0.26430889041115642572e5 * t77 * t5314 + 0.52861778082231285144e5 * t77 * t5317 + 0.1349998650e5 *… in func_pol()
7663 …* t250 + 0.8099991900e5 * t73 * t1063 + 0.88102963470385475240e5 * t264 * t5317 + 0.72466118845849… in func_pol()
H A Dmgga_c_b88.c2781 double t5306, t5310, t5314, t5315, t5316, t5317, t5318, t5319; in func_pol() local
6667 t5317 = 0.20000000000000000000e0 * t5316; in func_pol()
6670 …53 + t5255 + t5257 + t5259 - t5261 + t5263 + t5265 - t5268 - t5270 - t5274 - t5277 - t5317 + t5319; in func_pol()
9105 t16282 = -t5261 + t5263 + t5265 - t5008 - t5268 - t5270 - t5274 - t5277 - t5010 - t5317 + t5319; in func_pol()

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