| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_gx.c | 2509 double t5995, t6000, t6008, t6009, t6011, t6023, t6027, t6029; in func_pol() local
5127 t6029 = t6027 * t153 * t156; in func_pol()
5133 …t6069 = -0.10e2 / 0.9e1 * t6023 * t150 + 0.475e3 / 0.2916e4 * t480 * t6029 - 0.25e2 / 0.486e3 * t1… in func_pol()
5142 …t6029 * t441 + 0.250e3 / 0.243e3 * t6132 * params->c1 * t169 - 0.125e3 / 0.1296e4 * t2471 * t471 -… in func_pol()
5150 …t6029 + 0.20e2 / 0.27e2 * t1943 * t709 + 0.125e3 / 0.3888e4 * t3418 * t2514 + 0.125e3 / 0.7776e4 *… in func_pol()
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| H A D | mgga_c_b88.c | 2837 double t6021, t6023, t6024, t6025, t6027, t6029, t6031, t6032; in func_pol() local
7265 t6029 = t215 * t1960 * t5937; in func_pol()
7266 t6031 = 0.89478485333333333340e-1 * t221 * t6029; in func_pol()
9647 …t6029 + t19840 - t19842 + t19844 + 0.35280000000000000000e-1 * t4740 * t6067 + 0.35280000000000000… in func_pol()
9658 …800000000000000000e0 * t4968 * t1522 + 0.89478485333333333340e-1 * t680 * t6029 + 0.89478485333333… in func_pol()
9786 …24053333333333338e-2 * t3668 * t6021 + 0.89478485333333333340e-1 * t742 * t6029 - t19836 - 0.16800… in func_pol()
10507 …8485333333333340e-1 * t475 * t6029 - 0.44739242666666666670e-1 * t5796 * t20005 + 0.11184810666666… in func_pol()
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| H A D | mgga_c_vsxc.c | 3379 double t6005, t6008, t6028, t6029, t6030, t6032, t6035, t6038; in func_pol() local
7288 t6029 = t6 * t6028; in func_pol()
7289 t6030 = t6029 * t46; in func_pol()
7353 t6132 = t6029 * t107; in func_pol()
11169 t15296 = t6029 * t309; in func_pol()
11345 …- 0.15545350000000000000e-1 * t16076 * t107 - 0.31090700000000000000e-1 * t6029 * t383 + 0.7500000… in func_pol()
11509 …40 - 0.10000000000000000000e1 * t5877 * t532 - 0.10000000000000000000e1 * t6029 * t532 - 0.1200000… in func_pol()
11780 …70 - 0.15000000000000000000e1 * t5877 * t703 - 0.15000000000000000000e1 * t6029 * t703 - 0.1500000… in func_pol()
12238 … - 0.15545350000000000000e-1 * t5877 * t763 - 0.15545350000000000000e-1 * t6029 * t763 - 0.1554535… in func_pol()
12575 … - 0.15545350000000000000e-1 * t5877 * t848 - 0.15545350000000000000e-1 * t6029 * t848 - 0.1554535… in func_pol()
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| H A D | mgga_x_rtpss.c | 3142 double t6018, t6019, t6020, t6024, t6028, t6029, t6033, t6034; in func_pol() local
6105 t6029 = t6028 * t229; in func_pol()
6108 …* t2249 * t6020 + 0.2e1 / 0.3e1 * t5712 * t2131 * t6024 + t2130 * t2131 * t6029 / 0.3e1 - 0.2e1 / … in func_pol()
6288 …+ t7041 * t2592 * t6024 / 0.3e1 + 0.2e1 / 0.3e1 * t7134 + t2792 * t2592 * t6029 / 0.6e1 + t458 * t… in func_pol()
6472 …- t7041 * t3175 * t6024 / 0.3e1 - 0.2e1 / 0.3e1 * t8113 - t2792 * t3175 * t6029 / 0.6e1 - t458 * t… in func_pol()
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| H A D | mgga_c_m05.c | 3269 double t6024, t6026, t6027, t6029, t6030, t6032, t6033, t6035; in func_pol() local
7334 t6029 = t432 * t2224; in func_pol()
7335 t6030 = t6029 * t142; in func_pol()
11260 …8 - 0.32163958997385070134e2 * t2216 * t1341 - 0.10000000000000000000e1 * t6029 * t577 - 0.1000000… in func_pol()
11377 …2 + 0.20000000000000000000e1 * t6295 * t1071 + 0.10000000000000000000e1 * t6029 * t474 * t479 + 0.… in func_pol()
11596 t19711 = t6029 * t730; in func_pol()
11718 …7 - 0.48245938496077605201e2 * t1823 * t2187 - 0.15000000000000000000e1 * t6029 * t762 - 0.1500000… in func_pol()
11765 …15000000000000000000e1 * t655 * t5961 * t479 + 0.15000000000000000000e1 * t6029 * t679 * t479 + 0.… in func_pol()
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| H A D | mgga_x_tm.c | 4267 double t6026, t6029, t6035, t6040, t6042, t6043, t6050, t6051; in func_pol() local
7023 t6029 = t616 * t1691; in func_pol()
7025 …6 * t6023 + 0.171e3 / 0.1000e4 * t2774 * t6026 - 0.9e1 / 0.100e3 * t996 * t6029 + 0.50310579753086… in func_pol()
8950 … 0.171e3 / 0.500e3 * t2774 * t1845 * t1307 + 0.171e3 / 0.1000e4 * t2774 * t6029 * t413 + 0.171e3 /… in func_pol()
8954 …t1691 - 0.9e1 / 0.100e3 * t996 * t616 * t4434 - 0.9e1 / 0.100e3 * t2768 * t6029 - 0.9e1 / 0.50e2 *… in func_pol()
9691 …691 - 0.27e2 / 0.100e3 * t996 * t6002 * t530 - 0.27e2 / 0.100e3 * t3332 * t6029 - 0.9e1 / 0.100e3 … in func_pol()
9932 …2023 * t1691 - 0.9e1 / 0.25e2 * t13793 * t1845 - 0.9e1 / 0.50e2 * t3969 * t6029 - 0.9e1 / 0.25e2 *… in func_pol()
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| H A D | mgga_c_bc95.c | 2429 double t6020, t6022, t6023, t6025, t6027, t6029, t6030, t6031; in func_pol() local
6667 t6029 = t843 * sigma[2]; in func_pol()
6669 t6031 = t6029 * t6030; in func_pol()
10215 …5 * t1819 - 0.128e3 / 0.3e1 * t11279 * t6255 + 0.1408e4 / 0.9e1 * t3804 * t6029 * t20347 - 0.4096e… in func_pol()
10562 …e1 * t1281 * t23930 + 0.16e2 * t11279 * t7047 - 0.256e3 / 0.3e1 * t3804 * t6029 * t516 - 0.5181783… in func_pol()
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| H A D | mgga_x_edmgga.c | 161 double t6029, t6044, t6061, t6090, t6132, t6140, t6143, t6148; in func_unpol() local
1389 t6029 = t2523 * t2524 * t639; in func_unpol()
1391 …t6061 = 0.31465570642866950052e3 * t6025 * t5540 - 0.24056046973484009303e4 * t6029 * t5545 - 0.70… in func_unpol()
1455 …465570642866950052e3 * t6025 * t3650 * t1532 - 0.24056046973484009303e4 * t6029 * t3629 * t1532 + … in func_unpol()
1586 ….31465570642866950052e3 * t6025 * t3650 * t1248 - 0.24056046973484009303e4 * t6029 * t3629 * t1248; in func_unpol()
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| H A D | mgga_x_mbrxc_bg.c | 12024 double t6011, t6015, t6016, t6021, t6025, t6027, t6028, t6029; in func_ferr() local
15572 t6029 = t823 * t6028; in func_ferr()
15583 …t6016 + 0.3e1 / 0.2e1 * t606 * t884 - t6021 * t90 + t133 * t6025 + t433 * t6029 / 0.4e1 + t437 * t… in func_ferr()
15593 …t6082 = 0.3e1 / 0.4e1 * t402 * t6029 + t412 * t6029 / 0.2e1 - 0.3e1 / 0.4e1 * t416 * t6055 - 0.3e1… in func_ferr()
19857 … * t824 - 0.2e1 / 0.3e1 * t10796 * t837 + 0.2e1 / 0.3e1 * t1632 * t6029 + t1627 * t6029 + t1621 * … in func_ferr()
19878 …- 0.3e1 / 0.4e1 * t1887 * t6055 + t1871 * t6029 / 0.2e1 + t412 * t26198 / 0.2e1 + 0.3e1 / 0.4e1 * … in func_ferr()
22294 … - t6038 * t1236 * t198 * t6039 / 0.2e1 + 0.3e1 / 0.4e1 * t3378 * t6029 + t3382 * t6029 / 0.2e1 - … in func_ferr()
23876 double t6016, t6017, t6018, t6022, t6025, t6026, t6029, t6032; in func_pol() local
32342 t6029 = t626 * t6008; in func_pol()
49425 ….2e1 / 0.3e1 * t10412 * t6064 + 0.8e1 * t50292 * t1226 + 0.8e1 * t10412 * t6029 + 0.4e1 * t10412 *… in func_pol()
[all …]
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| H A D | mgga_x_vt84.c | 252 double t6029, t6037, t6040, t6043, t6056, t6060, t6065, t6066; in func_unpol() local
2268 t6029 = t4180 * t4465; in func_unpol()
2274 …65136718e-4 * t1302 * t2079 + 0.48045292496681213378e-6 * t4460 * t5377 * t6029) * t34 * t39 * t45… in func_unpol()
2526 …89941406e-4 * t1748 * t2079 - 0.48045292496681213378e-6 * t5376 * t4456 * t6029) * t34 * t39 * t45… in func_unpol()
2857 …2670555114746094e-4 * t1295 * t2079 + 0.48045292496681213378e-6 * t1302 * t6029) * t34 * t39 * t45… in func_unpol()
3137 …2873115539550781e-4 * t1745 * t2079 - 0.48045292496681213378e-6 * t1748 * t6029) * t34 * t39 * t45… in func_unpol()
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| H A D | mgga_x_revtm.c | 4817 double t6029, t6034, t6037, t6040, t6041, t6044, t6047, t6048; in func_pol() local
7494 t6029 = t1175 * t2233 * t348; in func_pol()
7496 v3rhotau2[3] = -t468 * t6029 / 0.2e1 - t5782 / 0.2e1; in func_pol()
9530 t16281 = t3530 * t6029; in func_pol()
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| H A D | mgga_x_mbeef.c | 217 double t6029, t6032, t6033, t6042, t6045, t6052, t6057, t6064; in func_unpol() local
3155 t6029 = t6028 * t86; in func_unpol()
6629 …28 * t1438 - 0.4014263826e-7 * t1422 * t1419 - 0.15484374436213991769e1 * t6029 * t5640 - 0.975831… in func_unpol()
11574 …t46619 + 0.12905841171796875000e-1 * t46621 - 0.24194335056584362140e-1 * t6029 * t16748 - 0.24194… in func_unpol()
14491 double t5992, t6001, t6020, t6021, t6024, t6025, t6028, t6029; in func_ferr() local
17345 t6029 = t6028 * t89; in func_ferr()
17754 t7506 = t6029 * t839; in func_ferr()
20628 …7 * t19745 - 0.96587435555555555556e0 * t20240 * t19745 + 0.11148800888888888889e1 * t6029 * t1249; in func_ferr()
20676 …1 - 0.16516742057613168724e2 * t6416 * t5816 + 0.11148800888888888889e1 * t6029 * t1753 + 0.743253… in func_ferr()
21486 … t780 * t5509 + 0.301017624e0 * t602 * t6582 + 0.18581334814814814814e0 * t6029 * t2746 + 0.371626… in func_ferr()
[all …]
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 387 t6009, t6017, t6019, t6021, t6023, t6025, t6029, t6031, t6033, t6036, t6040, t6042, & local
2600 t6029 = 0.5999999993e1_dp*t4946*t722*t4701*t4940 - t5985 - 0.5555555558e-1_dp &
2634 *t5797 + 0.3333333334e0_dp*t55*t57*(t5926 + t5978 + t6029 &
3166 t6009, t6017, t6019, t6021, t6023, t6025, t6029, t6031, t6033, t6036, t6040, t6042, & local
5376 t6029 = 0.5999999993e1_dp*t4946*t722*t4701*t4940 - t5985 - 0.5555555558e-1_dp &
5410 *t5797 + 0.3333333334e0_dp*t55*t57*(t5926 + t5978 + t6029 &
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| /dports/science/cp2k-data/cp2k-7.1.0/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 387 t6009, t6017, t6019, t6021, t6023, t6025, t6029, t6031, t6033, t6036, t6040, t6042, & local
2600 t6029 = 0.5999999993e1_dp*t4946*t722*t4701*t4940 - t5985 - 0.5555555558e-1_dp &
2634 *t5797 + 0.3333333334e0_dp*t55*t57*(t5926 + t5978 + t6029 &
3166 t6009, t6017, t6019, t6021, t6023, t6025, t6029, t6031, t6033, t6036, t6040, t6042, & local
5376 t6029 = 0.5999999993e1_dp*t4946*t722*t4701*t4940 - t5985 - 0.5555555558e-1_dp &
5410 *t5797 + 0.3333333334e0_dp*t55*t57*(t5926 + t5978 + t6029 &
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_beefvdw.c | 1787 double t6016, t6029, t6039, t6042, t6043, t6045, t6058, t6061; in func_pol() local
3596 t6029 = 0.4e1 / 0.3e1 * t2645 * t2655; in func_pol()
3598 …762 / 0.3e1 - t2649 * t2650 * t1941 / 0.6e1 - t2659 * t988 * t1128 * t8 - t6029 - 0.2e1 / 0.9e1 * … in func_pol()
3615 …v4rho3sigma[6] = -0.4e1 / 0.9e1 * t6009 - t6013 - t6029 - 0.4e1 / 0.3e1 * t6016 - 0.2e1 / 0.9e1 * … in func_pol()
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| H A D | gga_xc_b97.c | 1919 double t6029, t6032, t6033, t6040, t6041, t6045, t6050, t6051; in func_pol() local
5244 t6029 = t763 * t157; in func_pol()
5252 …t6055 = 0.62180000000000000000e-1 * t1112 * t6029 - t4123 - 0.16082341588935348987e2 * t1067 * t60… in func_pol()
5296 t6188 = t6029 * t188; in func_pol()
7626 …0000000000e0 * t1112 * t14799 * t188 - 0.12436000000000000000e0 * t1112 * t6029 * t503 + t418 * t1… in func_pol()
7692 …654000000000000000e0 * t3322 * t6024 - 0.18654000000000000000e0 * t3322 * t6029 - 0.8e1 * t10483 +… in func_pol()
8451 …00000000000000001e0 * t1300 * t7919 - 0.62180000000000000000e-1 * t1112 * t6029 * t946 + 0.1034566… in func_pol()
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| H A D | gga_c_pw91.c | 2123 double t6002, t6005, t6006, t6028, t6029, t6032, t6035, t6042; in func_pol() local
5784 t6029 = t4961 * t6028; in func_pol()
5787 …636233534648050268e1 * t3977 * t1886 - 0.16690870060394415080e2 * t1261 * t6029 + 0.55636233534648… in func_pol()
9164 …690870060394415080e2 * t3977 * t5817 - 0.16690870060394415080e2 * t3335 * t6029 - 0.27818116767324… in func_pol()
9261 … - 0.47712425361325595373e0 * t18887 - 0.33381740120788830160e2 * t3977 * t6029 + 0.55636233534648… in func_pol()
9525 … - 0.20448182297710969446e0 * t20655 - 0.33381740120788830162e2 * t5159 * t6029 + 0.10224091148855… in func_pol()
9581 … + 0.10224091148855484722e0 * t20631 - 0.33381740120788830162e2 * t5301 * t6029 + t20780 + t20781 … in func_pol()
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| H A D | gga_x_hjs.c | 4686 double t6024, t6027, t6029, t6033, t6037, t6039, t6041, t6043; in func_pol() local
8265 t6029 = t20 * t5892; in func_pol()
8281 …- 0.20e2 * t6024 - 0.25e2 / 0.9e1 * t6027 + 0.5e1 / 0.9e1 * t845 * t846 * t6029 - 0.35e2 / 0.4e1 *… in func_pol()
8308 t6135 = t787 * t788 * t6029; in func_pol()
11723 t16889 = t787 * t2077 * t6029; in func_pol()
11734 t16927 = t787 * t2230 * t6029; in func_pol()
11840 t17346 = t845 * t2196 * t6029; in func_pol()
12331 t19303 = t2082 * t2705 * t6029; in func_pol()
12645 …4 - 0.2e1 / 0.3e1 * t787 * t6765 * t2089 - 0.2e1 / 0.9e1 * t787 * t2740 * t6029 - 0.44e2 / 0.9e1 *… in func_pol()
15109 t33079 = t2082 * t3890 * t6029; in func_pol()
[all …]
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| H A D | gga_c_bmk.c | 1564 double t6028, t6029, t6030, t6031, t6032, t6037, t6043, t6051; in func_pol() local
4655 t6029 = t1297 * t763; in func_pol()
4682 …64 - t5966 - t5968 + t5970 - t5972 - t5975 + t5978 + t5981 + t5984 - t6028 + t6029 + t6031 + t6123; in func_pol()
6629 …17189 + t17411) + 0.3e1 * t6123 + 0.6e1 * t6030 - 0.30000000000000000000e1 * t5974 + 0.3e1 * t6029; in func_pol()
6680 …6031 + t6123 + t5964 + t17586 + t2 * (t17706 + t17739 + t17775 + t17807) + t6029 + t17811 + t17812; in func_pol()
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| H A D | gga_c_scan_e0.c | 1679 double t6019, t6029, t6035, t6036, t6037, t6040, t6044, t6047; in func_pol() local
4691 …t6029 = -t5986 + 0.98171973930797904389e-1 * t5987 + t5991 - 0.52690178912667028300e0 * t4773 + 0.… in func_pol()
4709 …+ t5650 + t5689 + t5724 + t5773 + t5812 + t5834 + t5886 + t5950 + t5983 + t6029 + t6088) * t110 + … in func_pol()
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| H A D | gga_c_zvpbeint.c | 2549 double t6023, t6024, t6025, t6026, t6027, t6028, t6029, t6031; in func_pol() local
6835 t6029 = 0.9e1 / 0.16e2 * t6013; in func_pol()
6851 …v3sigma3[6] = t7 * (t6023 + t6024 - t6025 - t6026 + t6027 - t6028 + t6029 + t6044 - t6047 + t6052); in func_pol()
11136 …v4rhosigma3[6] = t6023 + t6024 - t6025 - t6026 + t6027 - t6028 + t6029 + t6044 - t6047 + t6052 + t… in func_pol()
11306 …v4rhosigma3[16] = t6023 + t6024 - t6025 - t6026 + t6027 - t6028 + t6029 + t6044 - t6047 + t6052 + … in func_pol()
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| H A D | gga_c_regtpss.c | 2563 double t6018, t6019, t6024, t6025, t6026, t6029, t6030, t6031; in func_pol() local
6181 t6029 = -t5983 - t5949 + t5987 - t5991 + t5963 + t5992; in func_pol()
6182 t6030 = t96 * t6029; in func_pol()
10325 t22631 = t95 * t6029; in func_pol()
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| H A D | gga_c_sogga11.c | 3142 double t6020, t6021, t6022, t6024, t6025, t6026, t6027, t6029; in func_pol() local
6870 t6029 = 0.54688084430879438413e-5 * t5937; in func_pol()
6874 …t6039 = -t6027 + 0.10937616886175887683e-4 * t5935 - t6029 - 0.72917445907839251218e-5 * t5939 + t… in func_pol()
6898 …t6100 = -t6027 + 0.10937616886175887682e-4 * t5935 - t6029 - 0.72917445907839251215e-5 * t5939 + t… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_ksdt.c | 2530 double t6018, t6019, t6021, t6022, t6025, t6027, t6029, t6030; in func_pol() local
6953 t6029 = t1906 * t513; in func_pol()
6954 t6030 = t108 * t6029; in func_pol()
7617 t7539 = t6029 * t1017; in func_pol()
11043 t17401 = t108 * t6029 * t1928 * t1877; in func_pol()
11111 t17635 = t493 * t6029; in func_pol()
13614 t26570 = t108 * t6029 * t3263 * t1877; in func_pol()
13623 t26590 = t1010 * t6029; in func_pol()
16150 t39420 = t108 * t6029 * t3940; in func_pol()
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| H A D | lda_c_pmgb06.c | 1668 double t6022, t6024, t6025, t6026, t6027, t6028, t6029, t6030; in func_pol() local
5600 t6029 = t1354 * t2507; in func_pol()
5601 t6030 = 0.2e1 / 0.135e3 * t6029; in func_pol()
6251 t7490 = 0.2e1 / 0.45e2 * t6029; in func_pol()
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