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Searched refs:t3842 (Results 1 – 25 of 68) sorted by relevance

123

/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_c_acgga.c5923 t3842 = t769 * t987; in func_pol()
5925 t3844 = t3842 * t3843; in func_pol()
6292 t4730 = t3842 * t4729; in func_pol()
6711 t5768 = t3842 * t5767; in func_pol()
7133 t6581 = t3842 * t6580; in func_pol()
7222 t6736 = t3842 * t6717; in func_pol()
7494 t7395 = t3842 * t7394; in func_pol()
10113 t20912 = t1665 * t3842 * t20910; in func_pol()
10161 t21031 = t1665 * t3842 * t21029; in func_pol()
10335 t21411 = t5948 * t3842 * t21045; in func_pol()
[all …]
H A Dgga_c_wl.c529 double t3836, t3837, t3838, t3839, t3841, t3842, t3843, t3844; in func_pol() local
2251 t3842 = 0.75012500000000000000e-2 * t3841; in func_pol()
2264 …t3872 = t3842 - t3844 - 0.12150000000000000000e1 * t3846 + 0.11250000000000000000e0 * t3849 - 0.45… in func_pol()
2319 …t4023 = t3842 - t3844 - 0.60010000000000000000e-2 * t4011 + 0.22503750000000000000e-2 * t3543 - 0.… in func_pol()
2351 …0000000000000e0 * t3732 - 0.45000000000000000000e0 * t3735 + t3738 + t3836 + t3838 + t3842 - t3844; in func_pol()
H A Dgga_c_ft97.c12482 t3842 = t992 * t505; in func_pol()
12483 t3843 = t3841 * t3842; in func_pol()
12487 t3849 = t3848 * t3842; in func_pol()
12656 t4279 = t4278 * t3842; in func_pol()
12660 t4285 = t4284 * t3842; in func_pol()
17013 t13987 = t3842 * t713; in func_pol()
17163 t14409 = t3842 * t904; in func_pol()
17305 t14791 = t3842 * t824; in func_pol()
22602 t27652 = t2446 * t3842; in func_pol()
22622 t27687 = t2441 * t3842; in func_pol()
[all …]
H A Dgga_x_pw91.c1042 double t3842, t3844, t3847, t3850, t3911, t3923, t3928, t3931; in func_pol() local
2483 t3842 = t95 * t1861 * t226 * t1759 / 0.6e1; in func_pol()
2487 … - 0.378e3 * t1682 * t1306 + 0.1620e4 * t1638 * t3095 * t2857 * t18 * t73 - t3842 + t3844 - t3847); in func_pol()
2489 …/ t75 / t2770 * t417 * t1640 / 0.497664e6 - t371 * t1682 * t82 / 0.96e2 + t3842 - t3844 + t3847) *… in func_pol()
H A Dgga_c_lyp.c586 double t3806, t3815, t3835, t3836, t3838, t3839, t3842, t3845; in func_pol() local
2221 t3842 = t1499 * t3308; in func_pol()
2233 …t3869 = -0.80e2 * t3836 + 0.80e2 * t3839 - 0.80e2 / 0.81e2 * t3691 + 0.80e2 / 0.9e1 * t3842 + 0.16… in func_pol()
2251 … * t1614 - 0.20e2 / 0.3e1 * t541 * t603 * t4007 - 0.20e2 / 0.9e1 * t666 * t3842 - 0.20e2 / 0.3e1 *… in func_pol()
H A Dgga_c_op_g96.c792 double t3841, t3842, t3843, t3848, t3849, t3850, t3853, t3854; in func_pol() local
2824 t3842 = t39 * t3841; in func_pol()
2825 t3843 = t195 * t3842; in func_pol()
2866 t3948 = t3842 * t63; in func_pol()
4761 t15741 = t195 * t3842 * t98; in func_pol()
4927 t17485 = t195 * t3842 * t138; in func_pol()
4937 t17569 = t133 * t3842; in func_pol()
5072 t18634 = t3842 * t157 * t768; in func_pol()
H A Dgga_c_lm.c904 double t3814, t3815, t3825, t3826, t3841, t3842, t3849, t3850; in func_pol() local
2653 …t3842 = -t3174 + t3183 + t3185 - t3194 - t3198 - t3209 - t3211 - t3217 + t3223 + t3229 + t3238 - t… in func_pol()
2655 …t3324 + t3541 / 0.108e3 + t3703 / 0.36e2 + t256 * t257 * (t3825 + t3826 + t3841 + t3842) / 0.144e3; in func_pol()
H A Dgga_x_beefvdw.c1754 double t3832, t3834, t3836, t3838, t3840, t3842, t3844, t3846; in func_pol() local
3320 t3842 = t159 * t3815; in func_pol()
3326 …6 * t3838 + 0.50340687941345496970e7 * t3840 - 0.24664815444310469452e7 * t3842 - 0.64704806272098… in func_pol()
3861 …30 - 0.44396667799758845014e8 * t3840 * t330 - 0.12293913191698745090e9 * t3842 * t330 + 0.7592844… in func_pol()
3931 …87 - 0.17758667119903538005e9 * t3840 * t487 - 0.49175652766794980360e9 * t3842 * t487 + 0.3037137… in func_pol()
H A Dgga_c_pw91.c1997 double t3842, t3844, t3845, t3848, t3850, t3853, t3855, t3857; in func_pol() local
4718 …t3842 = -0.12897460341341234505e3 * t3810 * t112 * t115 + 0.38692381024023703515e3 * t3814 * t325 … in func_pol()
4719 t3844 = t6 * t3842 * t118; in func_pol()
4807 t4074 = t5 * t3842 * t118; in func_pol()
7180 t10523 = t3842 * t118; in func_pol()
7185 t10533 = t3842 * t328 * t118; in func_pol()
7232 t10654 = t3842 * t816 * t328; in func_pol()
7578 t12380 = t1164 * t3842; in func_pol()
7647 t12663 = t3842 * t475 * t118; in func_pol()
H A Dgga_x_gg99.c3626 double t3837, t3838, t3842, t3843, t3846, t3849, t3850, t3853; in func_pol() local
6217 t3842 = t685 * t75; in func_pol()
6218 t3843 = t2178 * t432 * t3842; in func_pol()
6226 t3861 = t3842 * t432; in func_pol()
7717 …t7400 = -0.5184e4 * t3860 * t3842 * t694 + 0.10368e5 * t3868 * t7321 * t249 - 0.432e3 * t689 * t71… in func_pol()
8408 …t1252 + 0.3e1 * t241 * t76 * t11707 + 0.11664e5 * t2142 * t2178 * t1251 * t3842 - 0.2592e4 * t1169… in func_pol()
8981 …3 * t689 * t248 * t15708 + 0.6e1 * t694 * t21 * t1644 - 0.864e3 * t3860 * t3842 * t1651 + 0.1296e4… in func_pol()
8985 …t3842 + 0.216e3 * t11781 * t1255 * t702 - 0.120e3 * t689 * t436 * t11781 + 0.1296e4 * t2142 * t165… in func_pol()
8988 …16e4 * t2166 * t2169 * t1651 * t3837 + 0.3888e4 * t2142 * t2178 * t1651 * t3842 - 0.288e3 * t689 *… in func_pol()
H A Dgga_x_sfat.c3131 double t3839, t3842, t3844, t3846, t3849, t3851, t3854, t3857; in func_pol() local
5031 t3842 = t325 * t3770 * t345; in func_pol()
5049 …t3887 = -t3839 / 0.6e1 - t3842 / 0.6e1 + t3846 / 0.2e1 - t3772 / 0.6e1 + t3779 - t3851 / 0.2e1 - t… in func_pol()
5207 t4368 = t3842 / 0.3e1; in func_pol()
6390 …t10206 = -t3914 - t3875 - t3882 - 0.2e1 / 0.3e1 * t3842 + t3846 - t3851 - t3857 - 0.2e1 / 0.3e1 * … in func_pol()
6421 …- 0.3e1 * t4359 - 0.3e1 / 0.2e1 * t4361 - 0.3e1 * t4364 - t4366 / 0.2e1 - t3842 - t3867 - 0.3e1 / … in func_pol()
H A Dgga_x_wpbeh.c208 double t3808, t3809, t3812, t3813, t3833, t3842, t3852, t3856; in func_unpol() local
2209 t3842 = t1193 * t47; in func_unpol()
5515 …* t3108 - 0.308861844e0 * t601 * t18230 - 0.154430922e0 * t3842 * t3216 - 0.308861844e0 * t3842 * … in func_unpol()
13105 double t3842, t3843, t3844, t3849, t3850, t3854, t3855, t3856; in func_pol() local
17975 t3842 = t1155 * t1155; in func_pol()
18122 …6 + 0.50805720000000000000e0 * t3842 * t3844 + 0.50805720000000000000e0 * t3839 * t1159 - 0.508057… in func_pol()
20475 t11132 = t3842 * t1155; in func_pol()
25407 …1144000000000000e1 * t26659 * t3842 + 0.50805720000000000000e0 * t8111 * t3839 + 0.101611440000000… in func_pol()
29876 t44645 = t3842 * t3842; in func_pol()
32063 …t3842 - 0.40644576000000000000e1 * t14706 * t56789 + 0.30483432000000000000e1 * t6607 * t44647 * t… in func_pol()
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_c_cs.c795 double t3840, t3842, t3844, t3846, t3848, t3849, t3851, t3855; in func_pol() local
2771 t3842 = 0.97443721955555555556e-3 * t3740 * t188; in func_pol()
2787 …t3875 = -0.30208323199999999999e-2 * t3836 + t3840 + t3842 + t3844 + t3846 + t3848 - 0.17311360000… in func_pol()
2899 …t4203 = -0.1298352e-1 * t3967 * t188 - t4193 - 0.20138882133333333334e-2 * t3836 + t3840 + t3842 +… in func_pol()
2955 …33333333e-2 * t4185 - t4193 - 0.10069441066666666667e-2 * t3836 + t3840 + t3842 + t3844 + t3846 + … in func_pol()
2973 …t4601 = -0.30208323199999999999e-2 * t4183 - 0.21924837440000000000e-2 * t4185 + t3840 + t3842 + t… in func_pol()
H A Dmgga_x_scan.c3217 double t3839, t3842, t3843, t3846, t3849, t3853, t3866, t3873; in func_pol() local
5666 t3842 = t568 * t399; in func_pol()
5667 t3843 = t3842 * t379; in func_pol()
6117 t4589 = t3842 * t499; in func_pol()
8082 …* t1423 * t10753 * t499 - 0.8e1 * t1423 * t3838 * t1259 + 0.8e1 * t1423 * t3842 * t1259 + 0.24e2 *… in func_pol()
8090 …e1 * t910 * t1731 * t974 - 0.2e1 * t339 * t3877 * t513 - 0.24e2 * t3831 * t3842 * t4580 - 0.8e1 * … in func_pol()
8229 t13578 = t3842 * t1440; in func_pol()
8552 … t339 * t1600 * t1473 + 0.12e2 * t3831 * t3838 * t1569 - 0.12e2 * t3831 * t3842 * t1569 - t339 * t… in func_pol()
8556 …* t1423 * t15014 * t379 - 0.4e1 * t1423 * t3838 * t1600 + 0.4e1 * t1423 * t3842 * t1600 - 0.4e1 * … in func_pol()
8772 t15599 = t3842 * t1723; in func_pol()
[all …]
H A Dmgga_x_2d_prhg07.c2345 double t3819, t3828, t3839, t3840, t3841, t3842, t3843, t3844; in func_ferr() local
3598 t3842 = t3841 / 0.4e1; in func_ferr()
3601 …978 - 0.3e1 / 0.4e1 * t549 * t970 - 0.3e1 / 0.4e1 * t545 * t973 - t3840 + t3842 + t3844 + 0.3e1 / … in func_ferr()
3697 …8e1 - t1105 * t579 / 0.8e1 - 0.3e1 / 0.16e2 * t3 * t1104 * t172 - t3840 + t3842 + t3844 - t3860 - … in func_ferr()
3783 …t579 / 0.8e1 - t549 * t1187 / 0.4e1 - 0.3e1 / 0.8e1 * t2858 * t562 - t3840 + t3842 + t3844 - t3860; in func_ferr()
4470 double t3829, t3831, t3837, t3840, t3841, t3842, t3845, t3846; in func_pol() local
7577 t3842 = t3841 * t918; in func_pol()
7598 …v3lapl3[0] = 0.3e1 / 0.4e1 * t141 * t3842 - 0.3e1 / 0.4e1 * t141 * t3846 - t141 * t3849 / 0.2e1 + … in func_pol()
11834 t17846 = 0.9e1 / 0.8e1 * t77 * t3842; in func_pol()
H A Dmgga_x_mvsb.c2469 double t3811, t3816, t3827, t3835, t3841, t3842, t3845, t3847; in func_pol() local
4880 t3842 = t167 * t3841; in func_pol()
4881 … / 0.8e1 * t41 * t3783 - t164 * t1377 / 0.4e1 + 0.5e1 / 0.16e2 * t41 * t3789 - t41 * t3842 / 0.4e1; in func_pol()
6512 …e1 - t1346 * t540 / 0.4e1 - t2888 * t378 / 0.2e1 - t1020 * t1074 - t164 * t3842 / 0.2e1 - t41 * t1… in func_pol()
7143 …t12063 = -0.3e1 / 0.4e1 * t361 * t3842 - 0.45e2 / 0.64e2 * t164 * t4286 + 0.585e3 / 0.256e3 * t41 … in func_pol()
H A Dhyb_mgga_x_m05.c2274 double t3833, t3835, t3838, t3839, t3842, t3845, t3847, t3851; in func_pol() local
4164 t3842 = t1838 * t3839 * t111 * sigma[0]; in func_pol()
4169 …77662412296051331e-4 * t1164 * t3835 + 0.18279900467596258573e-6 * t449 * t3842 - 0.21631064964918… in func_pol()
5479 t9035 = t1159 * t3842; in func_pol()
H A Dmgga_x_mvs.c2051 double t3831, t3832, t3838, t3839, t3842, t3843, t3849, t3850; in func_pol() local
4637 t3842 = t213 * params->b * t42; in func_pol()
4651 …t3903 = -t3839 / 0.2592e4 + 0.19e2 / 0.5184e4 * t1389 * t3842 * t65 * t3843 + t3849 * t3850 * para… in func_pol()
4724 …t4232 = t4173 * t1545 * t1485 / 0.3888e4 - t4179 / 0.3888e4 - t3857 * t3842 * t65 * t4181 / 0.1296… in func_pol()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F342 t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 local
1889 t3842 = t3278*t46
1897 *t3842*t897*t3306 - 0.3333333336e0_dp*t83*t384* &
2331 t5326 = 0.1250000001e0_dp*t3842*t897*t4790
3121 t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 local
4665 t3842 = t3278*t46
4673 *t3842*t897*t3306 - 0.3333333336e0_dp*t83*t384* &
5107 t5326 = 0.1250000001e0_dp*t3842*t897*t4790
/dports/science/cp2k-data/cp2k-7.1.0/src/xc/
H A Dxc_xbecke88_lr_adiabatic.F342 t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 local
1889 t3842 = t3278*t46
1897 *t3842*t897*t3306 - 0.3333333336e0_dp*t83*t384* &
2331 t5326 = 0.1250000001e0_dp*t3842*t897*t4790
3121 t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 local
4665 t3842 = t3278*t46
4673 *t3842*t897*t3306 - 0.3333333336e0_dp*t83*t384* &
5107 t5326 = 0.1250000001e0_dp*t3842*t897*t4790
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_xc_bn05.c942 double t3818, t3825, t3834, t3842, t3843, t3845, t3848, t3851; in func_pol() local
2744 …t3842 = -t2331 + 0.4e1 / 0.81e2 * t2333 + 0.8e1 / 0.81e2 * t3044 + t3048 + 0.16e2 / 0.27e2 * t3050… in func_pol()
2745 t3843 = t3842 * t84; in func_pol()
3919 t8728 = t85 * t3842; in func_pol()
3921 t8739 = t305 * t3842; in func_pol()
3929 …3e3 * t6834 - 0.368e3 / 0.243e3 * t6840 + 0.4e1 * t1359 * t1358 + 0.2e1 * t3842 * t298 * t84 + t14… in func_pol()
4189 … * t8669 + 0.8e1 / 0.27e2 * t8671 + t10852 + t4358 * t298 * t84 + 0.3e1 * t3842 * t494 * t84 + 0.3… in func_pol()
H A Dlda_x_erf.c552 double t3830, t3831, t3833, t3834, t3837, t3839, t3842, t3845; in func_pol() local
2108 t3842 = t44 * t131 * t646; in func_pol()
2120 …t3883 = t3837 - 0.64e2 / 0.243e3 * t3839 - 0.8e1 / 0.81e2 * t3842 + 0.8e1 / 0.27e2 * t3845 - 0.64e… in func_pol()
2346 …854 + 0.64e2 / 0.27e2 * t4973 - 0.16e2 / 0.9e1 * t4976 - 0.4e1 / 0.81e2 * t3842 - 0.16e2 / 0.243e3… in func_pol()
2806 …t7763 = 0.16e2 / 0.27e2 * t4976 - 0.32e2 / 0.243e3 * t3839 - 0.4e1 / 0.243e3 * t3842 + 0.4e1 / 0.8… in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/
H A Dmgga_x_tb09.c2196 double t3809, t3813, t3820, t3830, t3838, t3842, t3847, t3848; in func_ferr() local
3431 t3842 = t1214 * t850 * t1335; in func_ferr()
3438 …t3842 * t2791 + 0.6e1 * t3842 * t2794 + t504 * t3848 + t672 - t500 * t3850 - t161 * t3853 - 0.2e1 … in func_ferr()
3454 … - 0.3e1 * t3842 * t2885 + 0.6e1 * t3838 * t424 + t161 * t3908 / 0.2e1 - 0.2e1 * t504 * t3912 + 0.… in func_ferr()
3457 …e1 / 0.3e1 * t881 * t1340 + 0.2e1 * t500 * t3925 - 0.4e1 * t3838 * t414 + t3842 * t2879 / 0.18e2 +… in func_ferr()
3844 …t3842 * t5620 / 0.9e1 - t5623 - t161 * t5625 - 0.2e1 / 0.3e1 * t504 * t5628 + 0.6e1 * t3879 * t752… in func_ferr()
3852 …695 - 0.4e1 * t3838 * t763 + t3842 * t5666 / 0.18e2 + 0.10e2 / 0.3e1 * t3842 * t5669 + 0.6e1 * t38… in func_ferr()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/
H A Dmpfr_yukawa.f90810 TYPE(mpfr_type) :: t3823,t3827,t3829,t3838,t3842,t3846,t3849,t3852,t3856,& local
2797 t3842 = t472 * t811 * t1282
2802 …+ .CONVERT."0.206288775D9" * t3842 + .CONVERT."0.17463600D8" * t2747 + .CONVERT."0.411642000D9" * …
3226 * t1258 - .CONVERT."0.2681754075D10" * t3842
3756 …- .CONVERT."0.9459450D7" * t1258 + .CONVERT."0.18772278525D11" * t3842 + .CONVERT."0.529729200D9" …
4413 … * t3842 + .CONVERT."0.1622461215375D13" / .CONVERT."0.4D1" * t7391 - .CONVERT."0.1986484500D10" &
6007 …+ .CONVERT."0.76576500D8" * t1258 - .CONVERT."0.1276514939700D13" * t3842 + .CONVERT."0.5516368132…
6707 * t1258 + .CONVERT."0.3829544819100D13" * t3842 - .CONVERT."0.330982087936500D15" * t7391 &
8122 - .CONVERT."0.2544568408942560000D19" * t15374 - .CONVERT."0.10394478794700D14" * t3842 &
9217 t3842 - .CONVERT."0.6288659670793500D16" * t7391 - .CONVERT."0.1040487327349470000D19" &
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/
H A Dmpfr_yukawa.f90810 TYPE(mpfr_type) :: t3823,t3827,t3829,t3838,t3842,t3846,t3849,t3852,t3856,& local
2797 t3842 = t472 * t811 * t1282
2802 …+ .CONVERT."0.206288775D9" * t3842 + .CONVERT."0.17463600D8" * t2747 + .CONVERT."0.411642000D9" * …
3226 * t1258 - .CONVERT."0.2681754075D10" * t3842
3756 …- .CONVERT."0.9459450D7" * t1258 + .CONVERT."0.18772278525D11" * t3842 + .CONVERT."0.529729200D9" …
4413 … * t3842 + .CONVERT."0.1622461215375D13" / .CONVERT."0.4D1" * t7391 - .CONVERT."0.1986484500D10" &
6007 …+ .CONVERT."0.76576500D8" * t1258 - .CONVERT."0.1276514939700D13" * t3842 + .CONVERT."0.5516368132…
6707 * t1258 + .CONVERT."0.3829544819100D13" * t3842 - .CONVERT."0.330982087936500D15" * t7391 &
8122 - .CONVERT."0.2544568408942560000D19" * t15374 - .CONVERT."0.10394478794700D14" * t3842 &
9217 t3842 - .CONVERT."0.6288659670793500D16" * t7391 - .CONVERT."0.1040487327349470000D19" &
[all …]

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