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Searched refs:t3798 (Results 1 – 25 of 59) sorted by relevance

123

/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_x_m08.c1465 double t3696, t3734, t3771, t3787, t3793, t3798, t3817, t3871; in func_ferr() local
2361 t3798 = t33 * t2; in func_ferr()
2365 …v4rho3sigma[0] = t3798 * t322 / 0.9e1 - t1824 * t805 / 0.2e1 - 0.3e1 / 0.2e1 * t777 * t1869 - 0.3e… in func_ferr()
2435 …v4rho3tau[0] = t3798 * t431 / 0.9e1 - t1824 * t1091 / 0.2e1 - 0.3e1 / 0.2e1 * t777 * t2371 - 0.3e1… in func_ferr()
2800 double t3769, t3776, t3779, t3784, t3790, t3791, t3798, t3807; in func_pol() local
4343 t3798 = t68 * t180; in func_pol()
5900 …e1 * t3798 * t10582 + 0.32500e5 / 0.3e1 * t1444 * t10586 + 0.16250e5 * t508 * t10590 - 0.5000e4 / … in func_pol()
6285 …t3798 * t12352 - 0.14000e5 / 0.3e1 * t1444 * t12355 + 0.242000e6 * t1514 * t12359 + 0.629200e6 / 0… in func_pol()
6860 …* t5997 + 0.1680e4 * t3728 * t6037 + 0.3600e4 * t3756 * t6053 + 0.300e3 * t3798 * t6023 + 0.2520e4… in func_pol()
6867 …3675 - 0.72600e5 * t3675 * t13675 - 0.200e3 * t9029 * t13679 - 0.2000e4 * t3798 * t13683 - 0.600e3… in func_pol()
[all …]
H A Dmgga_x_br89.c3181 t3798 = t3797 * t38; in func_unpol()
3183 t3800 = t3798 * t3799; in func_unpol()
3186 t3812 = t3798 * t3791; in func_unpol()
3534 t5103 = t3798 * t4937; in func_unpol()
4247 t7022 = t3798 * t7021; in func_unpol()
4264 t7065 = t3798 * t6962; in func_unpol()
5545 t11605 = t3798 * t3743; in func_unpol()
5590 t11864 = t3798 * t5201; in func_unpol()
6426 t16660 = t3798 * t1996; in func_unpol()
6428 t16667 = t3798 * t1990; in func_unpol()
[all …]
H A Dhyb_mgga_x_pjs18.c1864 double t3775, t3783, t3798, t3799, t3820, t3846, t3880, t3895; in func_ferr() local
2955 t3798 = t96 * t22; in func_ferr()
2957 …02 + 0.44233737333333333333e-1 * t563 * t816 * t819 - 0.392e3 / 0.225e3 * t3798 * t3799 * t1428 + … in func_ferr()
3607 double t3774, t3780, t3790, t3793, t3796, t3797, t3798, t3805; in func_pol() local
5783 t3798 = t3797 * t30; in func_pol()
5791 … - 0.57275491621318330108e-4 * t220 * t3727 + 0.26329605555555555556e-1 * t3798 * t256 + 0.5265921… in func_pol()
7960 …t3798 * t776 - 0.35386989866666666666e-1 * t3260 * t12040 + 0.29489158222222222222e-1 * t3260 * t1… in func_pol()
8283 …- 0.35386989866666666666e-1 * t255 * t12702 - 0.31595526666666666666e-1 * t3798 * t1006 + 0.442337… in func_pol()
11655 …1233965037037037037e0 * t255 * t9997 * t3138 + 0.25744503209876543210e0 * t3798 * t2320 + 0.112339… in func_pol()
12204 …- 0.17182647486395499033e-3 * t3248 * t3727 - 0.31595526666666666667e-1 * t3798 * t3266 - 0.631910… in func_pol()
[all …]
H A Dmgga_x_gx.c2474 double t3783, t3784, t3785, t3791, t3793, t3795, t3798, t3804; in func_pol() local
4750 t3798 = t8 * t571 * t215; in func_pol()
4754 …t3823 = -0.5e1 / 0.27e2 * t3795 - 0.5e1 / 0.27e2 * t3798 - t8 * t125 * t1401 * t209 / 0.2e1 + t8 *… in func_pol()
4783 …83 - 0.41e2 / 0.9e1 * t3791 - 0.10e2 / 0.27e2 * t3795 - 0.10e2 / 0.27e2 * t3798 + 0.4e1 / 0.9e1 * … in func_pol()
4810 …/ 0.3e1 + t3784 + t3791 / 0.3e1 - 0.5e1 / 0.9e1 * t3795 - 0.5e1 / 0.9e1 * t3798 + t3814 + t3996 / … in func_pol()
4867 … t562 * t563 * t214 * t1777 - 0.20e2 / 0.27e2 * t3795 - 0.20e2 / 0.27e2 * t3798 + t3575 + t3579 - … in func_pol()
H A Dmgga_x_revtm.c169 double t3795, t3798, t3799, t3805, t3816, t3826, t3831, t3838; in func_unpol() local
1489 t3798 = t71 / t72 / t3795; in func_unpol()
1494 … t3790 * t1161 + 0.392e3 / 0.75e2 * t1195 * t1205 + 0.6664e4 / 0.1875e4 * t3798 * t3799 - 0.784e3 … in func_unpol()
1579 …* t573 * t415 - 0.392e3 / 0.125e3 * t3790 * t1459 + 0.6664e4 / 0.1875e4 * t3798 * t244 * t1161 - 0… in func_unpol()
1709 … * t415 + 0.196e3 / 0.225e3 * t434 * t244 * t1436 + 0.6664e4 / 0.1875e4 * t3798 * t823 * t401 - 0.… in func_unpol()
2120 … t2816 + 0.39732524933540983400e-3 * t7553 * t244 + 0.6664e4 / 0.1875e4 * t3798 * t10007 - 0.67485… in func_unpol()
4746 double t3755, t3759, t3773, t3798, t3801, t3804, t3808, t3811; in func_pol() local
6731 t3798 = t3759 * t129; in func_pol()
8720 ….59049e5 * t10456 + 0.146e3 / 0.135e3 * t3112 * t540 + 0.146e3 / 0.45e2 * t3798 * t362 + 0.292e3 /… in func_pol()
9080 …62 * t201 - 0.292e3 / 0.135e3 * t3759 * t540 * t201 + 0.292e3 / 0.135e3 * t3798 * t540 - 0.146e3 /… in func_pol()
[all …]
H A Dmgga_c_m05.c3123 double t3798, t3799, t3800, t3801, t3803, t3805, t3808, t3809; in func_pol() local
6157 t3798 = t3757 + t3797; in func_pol()
6158 t3799 = t454 * t3798; in func_pol()
10318 …00000000000e2 * t1349 * t4084 + 0.64327917994770140268e2 * t128 * t1157 * t3798 * t1806 + 0.829085… in func_pol()
10447 …* t11390 + 0.240e3 * t11392 - t11397 - 0.64327917994770140268e2 * t1963 * t3798 * t1161 * t473 + 0… in func_pol()
10465 …63 * t3481 * t955 - 0.384e3 * t11505 + 0.40000000000000000000e1 * t1943 * t3798 * t476 * t473 - 0.… in func_pol()
10581 …t12168 = -0.40000000000000000000e1 * t128 * t1049 * t3798 * t1816 + 0.20000000000000000000e1 * t43… in func_pol()
10771 t13341 = t478 * t3798; in func_pol()
10848 …01e2 * t1963 * t4362 * t1145 - 0.16081979498692535067e2 * t1963 * t1964 * t3798 - t13638 - 0.15000… in func_pol()
10857 …t13695 = -t13648 + 0.10000000000000000000e1 * t1943 * t1944 * t3798 + 0.30000000000000000000e1 * t… in func_pol()
H A Dmgga_x_br89_explicit.c2160 t3798 = t113 * t792; in func_unpol()
9164 t3798 = t51 * t101; in func_ferr()
9165 t3799 = t3798 * t568; in func_ferr()
9319 t4306 = t3798 * t4256; in func_ferr()
9495 t4985 = t3798 * t4940; in func_ferr()
9699 t5788 = t3796 * t3798; in func_ferr()
9823 t6208 = t3798 * t1076; in func_ferr()
10008 t6847 = t3798 * t6729; in func_ferr()
10072 t7108 = t3798 * t207; in func_ferr()
10739 t10373 = t3798 * t9011; in func_ferr()
[all …]
H A Dmgga_x_pbe_gx.c2618 double t3785, t3787, t3788, t3790, t3792, t3796, t3798, t3800; in func_pol() local
5083 …t3798 = 0.65009081429064777297e-4 * t3785 - 0.82443123872288192129e-4 * t3788 + 0.2947616488847210… in func_pol()
5094 …t3819 = t3798 * t102 + 0.5e1 / 0.24e2 * t3800 + 0.25e2 / 0.1728e4 * t3802 + 0.125e3 / 0.62208e5 * … in func_pol()
6701 t10555 = t3798 * t254; in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_pk09.c2484 double t3776, t3788, t3789, t3791, t3798, t3799, t3801, t3818; in func_pol() local
4663 t3798 = t116 * t91 * t2940; in func_pol()
4664 t3799 = t115 * t3798; in func_pol()
4706 …86566395222e-1 * t3941 * t117 * t3933 + 0.18635258017632964667e2 * t175 * t3798 - 0.41150663529849… in func_pol()
4718 …t3798 - 0.62684570322917723888e0 * t3957 * t130 + 0.18805371096875317167e1 * t147 * t3798 + 0.1948… in func_pol()
H A Dlda_c_ml1.c421 double t3793, t3794, t3797, t3798, t3816, t3817, t3821, t3827; in func_pol() local
2145 t3798 = t1147 * t3797; in func_pol()
2146 …t3816 = 0.40275311379722222222e1 * t1133 * t3794 - 0.65246004435150000000e2 * t94 * t3798 + 0.1087… in func_pol()
3857 …0275311379722222222e1 * t4739 * t3794 - 0.65246004435150000000e2 * t440 * t3798 + 0.10874334072525… in func_pol()
4252 …4435150000000e2 * t94 * t461 * t13975 - 0.26098401774060000000e3 * t591 * t3798 + 0.96660747311333… in func_pol()
H A Dlda_xc_bn05.c941 double t3798, t3801, t3804, t3807, t3810, t3811, t3814, t3815; in func_pol() local
2733 t3798 = t1366 * t3758; in func_pol()
2749 …3791 / 0.18e2 - 0.5e1 / 0.81e2 * t661 * t3795 + 0.20e2 / 0.81e2 * t2818 * t3798 + 0.2e1 / 0.27e2 *… in func_pol()
3914 t8708 = t6761 * t3798; in func_pol()
H A Dlda_c_pmgb06.c1530 double t3798, t3800, t3802, t3803, t3805, t3806, t3807, t3808; in func_pol() local
4484 t3798 = t49 * t390 * t177; in func_pol()
4485 t3800 = 0.96187034332131941129e-1 * t521 * t3798; in func_pol()
7338 t10322 = t1528 * t3798; in func_pol()
7339 t10325 = 0.38474813732852776452e0 * t1531 * t3798; in func_pol()
8251 t12315 = t1815 * t3798; in func_pol()
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_c_zvpbeloc.c2163 double t3793, t3794, t3798, t3801, t3808, t3812, t3820, t3825; in func_pol() local
4795 t3798 = t1383 * t582; in func_pol()
5635 t5596 = t1393 * t3798; in func_pol()
5643 t5611 = t1532 * t3798; in func_pol()
7072 …t10035 = 0.8e1 * t978 * t2671 * t1203 * t389 - t978 * t3798 * t943 + 0.2e1 * t978 * t3812 * t943 +… in func_pol()
7302 …e1 * t107 * t291 * t10206 - 0.6e1 * t978 * t11570 * t579 - 0.6e1 * t952 * t3798 * t2643 + t10854 +… in func_pol()
8641 …t17390 = -t1398 * t17372 * t1529 - t1398 * t4549 * t3798 + 0.4e1 * t1398 * t5139 * t5159 - 0.12e2 … in func_pol()
8910 t18434 = t3798 * t297; in func_pol()
8938 …* t5124 * t107 * t5371 + 0.3e1 * t1398 * t1536 * t18440 - t1398 * t4604 * t3798 - 0.2e1 * t1396 * … in func_pol()
9003 …t1393 * t11693 + 0.9e1 * t1398 * t18376 * t1590 - 0.3e1 * t1398 * t5139 * t3798 + 0.6e1 * t1398 * … in func_pol()
[all …]
H A Dgga_c_lyp.c585 double t3792, t3794, t3796, t3797, t3798, t3802, t3804, t3805; in func_pol() local
2211 t3798 = t720 * t452; in func_pol()
2216 …3788 / 0.32e2 + t3792 + 0.3e1 / 0.32e2 * t3794 + t3797 + 0.3e1 / 0.16e2 * t3798 + 0.3e1 / 0.32e2 *… in func_pol()
2323 …0.8e1 + t3788 / 0.16e2 + t3791 / 0.8e1 + t3794 / 0.16e2 + t3796 / 0.8e1 + t3798 / 0.8e1 + t3802 / … in func_pol()
H A Dgga_c_op_g96.c789 double t3788, t3791, t3792, t3793, t3794, t3797, t3798, t3801; in func_pol() local
2793 t3798 = t3797 * t768; in func_pol()
2800 …t3798 + 0.28622563886445168538e-5 * t3801 * t3783 - 0.85867691659335505616e-6 * t3804 * t3788 + 0.… in func_pol()
4879 …t3798 + 0.22201622955616203840e-6 * t2007 * t3786 * t3788 - 0.49016140655537351122e-4 * t11857 * t… in func_pol()
H A Dgga_c_optc.c2410 double t3790, t3793, t3798, t3803, t3807, t3810, t3813, t3816; in func_pol() local
6139 t3798 = t1079 * t1079; in func_pol()
9100 t11010 = t3798 * t1891; in func_pol()
9335 t11612 = t3798 * t6197; in func_pol()
10223 t14103 = t3798 * t1079; in func_pol()
17777 t49023 = t3798 * t3798; in func_pol()
19294 t57109 = t3798 * t607; in func_pol()
19295 t57119 = t3798 * t512; in func_pol()
19401 … / 0.9e1 * t53949 + t53225 + 0.51689762869806860992e-2 * t2753 * t53395 * t3798 - 0.25e2 / 0.3e1 *… in func_pol()
19555 t59226 = t1032 * t3798; in func_pol()
[all …]
H A Dgga_x_beefvdw.c1752 double t3798, t3800, t3802, t3805, t3807, t3809, t3811, t3815; in func_pol() local
3299 t3798 = t147 * t3689; in func_pol()
3337 …t3880 = t3877 - 0.48223721498554824908e7 * t3796 + 0.15398191944197027795e9 * t3798 - 0.2805464463… in func_pol()
3857 …0 + 0.46194575832591083385e9 * t1449 * t1221 - 0.33665573567361888725e9 * t3798 * t330 - 0.8416393… in func_pol()
H A Dgga_xc_b97.c1796 double t3784, t3786, t3789, t3792, t3794, t3795, t3797, t3798; in func_pol() local
4261 t3798 = t590 * t128; in func_pol()
4262 t3799 = t3798 * t1522; in func_pol()
6838 t10629 = t3798 * t3471; in func_pol()
6866 t10702 = t3798 * t3795; in func_pol()
6867 t10704 = t3798 * t3792; in func_pol()
6870 t10712 = t3798 * t4121; in func_pol()
H A Dgga_c_pbe.c1563 double t3797, t3798, t3801, t3802, t3803, t3807, t3810, t3811; in func_pol() local
3804 t3798 = t3797 * t318; in func_pol()
3806 …e1 * t1078 * t3791 - t1124 * t3787 - 0.2e1 * t1124 * t3794 + 0.2e1 * t1124 * t3798 + t3699 - t3790; in func_pol()
5549 t11834 = t92 * t3798; in func_pol()
H A Dgga_c_scan_e0.c1596 double t3791, t3796, t3797, t3798, t3800, t3801, t3806, t3807; in func_pol() local
4026 t3798 = 0.14035736694323150897e2 * t3797; in func_pol()
4039 …2 * t786 * t1838 * t383 + t3778 - t3780 - t3782 - t3787 + t3791 - t3796 + t3798 - t3801 + t3807 + … in func_pol()
4228 …t4483 = -t3775 + t3778 - t3780 - t3782 - t3787 + t3791 - t3796 + t3798 - t3801 + t3807 + t3809 - t… in func_pol()
H A Dgga_c_zvpbeint.c2369 double t3769, t3772, t3782, t3792, t3794, t3795, t3798, t3800; in func_pol() local
5311 t3798 = t1232 * t406; in func_pol()
5312 t3800 = t2410 * t3798 * t2370; in func_pol()
5314 t3805 = params->omega * t3798 * t2370; in func_pol()
5316 t3810 = t698 * t3798 * t2370; in func_pol()
8221 t12211 = t3798 * t7359 * t297; in func_pol()
9617 t17881 = t3798 * t2370 * t109 * t1167; in func_pol()
H A Dgga_x_sfat_pbe.c3350 double t3794, t3795, t3797, t3798, t3800, t3801, t3802, t3804; in func_pol() local
5372 t3798 = t3797 / 0.12e2; in func_pol()
5377 …108509596690478e-2 * t3375 - t3379 - t3381 - t3785 - t3788 - t3791 - t3795 + t3798 - t3801 - t3804; in func_pol()
5434 …2e1 + 0.78832217019193380955e-2 * t3851 - t3855 / 0.2e1 - t3794 / 0.6e1 + t3798 - t3787 / 0.8e1 + … in func_pol()
5490 ….59124162764395035718e-2 * t1488 - t3299 + t9 * (-t3953 - t3954 - t3957 + t3798 - t3961 - t3962 - … in func_pol()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/
H A Dmpfr_yukawa.f90809 t3781,t3785,t3790,t3794,t3798,t3800,t3806,t3811,t3817,t3818,t3819,t3821 local
2777 t3798 = t21 * t22 * t984
2782 ….CONVERT."0.149688000D9" * t3794 + .CONVERT."0.1247400D7" * t2344 + .CONVERT."0.59875200D8" * t3798
3213 …* t4771 - .CONVERT."0.5405400D7" * t2344 - .CONVERT."0.778377600D9" * t3798 + .CONVERT."0.1621620D…
3739 * t4771 + .CONVERT."0.18918900D8" * t2344 + .CONVERT."0.5448643200D10" * t3798 &
4389 * t3798 - .CONVERT."0.1365D4" / .CONVERT."0.4D1" * t7342
5119 * t3798 + .CONVERT."0.2270268000D10" * t8891 + .CONVERT."0.5460D4" * t7342 &
5977 * t7338 - .CONVERT."0.370507737600D12" * t3798 + .CONVERT."0.33424574007825D14" &
6672 * t7338 + .CONVERT."0.1111523212800D13" * t3798 - .CONVERT."0.300821166070425D15" &
8542 * t3798 - .CONVERT."0.1200562300787850D16" * t11186 - .CONVERT."0.10999448460D11" * t11859 &
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/
H A Dmpfr_yukawa.f90809 t3781,t3785,t3790,t3794,t3798,t3800,t3806,t3811,t3817,t3818,t3819,t3821 local
2777 t3798 = t21 * t22 * t984
2782 ….CONVERT."0.149688000D9" * t3794 + .CONVERT."0.1247400D7" * t2344 + .CONVERT."0.59875200D8" * t3798
3213 …* t4771 - .CONVERT."0.5405400D7" * t2344 - .CONVERT."0.778377600D9" * t3798 + .CONVERT."0.1621620D…
3739 * t4771 + .CONVERT."0.18918900D8" * t2344 + .CONVERT."0.5448643200D10" * t3798 &
4389 * t3798 - .CONVERT."0.1365D4" / .CONVERT."0.4D1" * t7342
5119 * t3798 + .CONVERT."0.2270268000D10" * t8891 + .CONVERT."0.5460D4" * t7342 &
5977 * t7338 - .CONVERT."0.370507737600D12" * t3798 + .CONVERT."0.33424574007825D14" &
6672 * t7338 + .CONVERT."0.1111523212800D13" * t3798 - .CONVERT."0.300821166070425D15" &
8542 * t3798 - .CONVERT."0.1200562300787850D16" * t11186 - .CONVERT."0.10999448460D11" * t11859 &
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/
H A Dmgga_x_tb09.c163 double t3782, t3785, t3786, t3791, t3792, t3798, t3801, t3804; in func_unpol() local
1404 t3798 = t263 * t500; in func_unpol()
1409 …t3819 = 0.2e1 / 0.3e1 * t2727 * t3792 + 0.2e1 * t263 * t494 * t265 - 0.4e1 * t3798 * t2736 + 0.4e1… in func_unpol()
1767 …t5510 = 0.2e1 / 0.3e1 * t2757 * t3792 + t4798 - 0.4e1 * t3798 * t5494 + 0.4e1 / 0.3e1 * t3801 * t2… in func_unpol()
2195 double t3763, t3765, t3768, t3771, t3772, t3786, t3798, t3805; in func_ferr() local
3424 t3798 = t376 * t388 * t470; in func_ferr()
3425 …1 * t157 * t1968 - 0.4e1 / 0.3e1 * t483 * t2989 + 0.16e2 / 0.3e1 * t483 * t3798 + 0.4e1 * t3704 * … in func_ferr()
3481 …t4132 = 0.8e1 / 0.3e1 * t563 * t376 * t1584 * t154 + 0.8e1 / 0.3e1 * t563 * t3798 + 0.4e1 / 0.3e1 … in func_ferr()

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