| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_bn05.c | 976 double t4648, t4653, t4659, t4661, t4667, t4669, t4678, t4680; in func_pol() local
3002 t4648 = t578 * t578; in func_pol()
3029 … - 0.16e2 / 0.27e2 * t220 * t2046 * t4705 + 0.2e1 / 0.9e1 * t220 * t630 * t4648 + 0.8e1 / 0.27e2 *… in func_pol()
3051 …0.729e3 * t48 * t4804 * t52 * t4653 - 0.5e1 / 0.27e2 * t48 * t656 * t52 * t4648 - 0.100e3 / 0.243e… in func_pol()
3096 … + 0.20e2 / 0.27e2 * t202 * t1989 * t4705 - 0.2e1 / 0.9e1 * t202 * t592 * t4648 - 0.8e1 / 0.27e2 *… in func_pol()
3097 …0.729e3 * t23 * t4964 * t56 * t4653 + 0.4e1 / 0.27e2 * t23 * t564 * t56 * t4648 + 0.32e2 / 0.243e3… in func_pol()
3112 …* t5082 + 0.32e2 / 0.243e3 * t5085 - 0.16e2 / 0.81e2 * t23 * t564 * t60 * t4648 - 0.448e3 / 0.2187… in func_pol()
3113 … t1672 / 0.9e1 + t174 * t592 * t251 * t1661 / 0.9e1 - t174 * t203 * t64 * t4648 / 0.8e1 - 0.5e1 / … in func_pol()
3169 …655 * t4653 - 0.16e2 / 0.9e1 * t234 * t565 * t578 + 0.4e1 / 0.3e1 * t50 * t4648 + 0.16e2 / 0.9e1 *… in func_pol()
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| H A D | lda_c_pk09.c | 2513 double t4635, t4637, t4639, t4640, t4643, t4648, t4651, t4653; in func_pol() local
4896 t4648 = t649 * t115; in func_pol()
4906 …t4648 * t670 + 0.12536914064583544778e1 * t4651 + 0.12992782516386767778e2 * t4653 - 0.38978347549… in func_pol()
6213 …1e-1 * t9323 + 0.83579427097223631853e0 * t9325 * t7830 - 0.62684570322917723890e0 * t4648 * t2101; in func_pol()
6219 …44 * t657 - 0.62684570322917723890e0 * t9349 + 0.62684570322917723890e0 * t4648 * t2097 + 0.835794… in func_pol()
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| H A D | lda_c_pmgb06.c | 1575 double t4648, t4649, t4650, t4652, t4657, t4659, t4661, t4662; in func_pol() local
4847 t4648 = t507 * t484; in func_pol()
4848 t4649 = t4648 * t320; in func_pol()
8102 t12019 = t1794 * t4647 * t4648 * t1011 / 0.9e1; in func_pol()
9463 t15747 = 0.8e1 / 0.27e2 * t5356 * t4647 * t4648 * t1; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_zvpbeint.c | 2433 double t4647, t4648, t4649, t4653, t4654, t4657, t4658, t4660; in func_pol() local
5830 t4648 = t2835 * t347; in func_pol()
5831 t4649 = t4647 * t4648; in func_pol()
5964 t4874 = t4873 * t4648; in func_pol()
9071 …* t4198 * t15067 * t4201 + t4615 * t4229 - 0.4e1 * t4646 * t752 * t1417 * t4648 - 0.4e1 * t4646 * … in func_pol()
9481 …t4648 - 0.2e1 * t4198 * t4199 * t16645 + 0.2e1 * t4646 * t4199 * t16649 + 0.4e1 * t4198 * t4647 * … in func_pol()
9595 …5877 * t16629 - 0.6e1 * t4646 * t4873 * t16633 - 0.4e1 * t4646 * t17703 * t4648 - 0.12e2 * t4615 *… in func_pol()
10227 …627 + 0.12e2 * t19046 * t19047 * t4641 + 0.12e2 * t5456 * t2144 * t1604 * t4648 + 0.2e1 * t20264 *… in func_pol()
10265 t20465 = t4213 * t4648; in func_pol()
10460 … t1645 * t5359 * t5763 * t383 + t19565 + 0.12e2 * t5456 * t15877 * t475 * t4648 + 0.2e1 * t1645 * … in func_pol()
[all …]
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| H A D | gga_c_zpbeint.c | 2009 double t4627, t4634, t4635, t4643, t4644, t4648, t4649, t4652; in func_pol() local
5187 t4648 = t427 * t410 * t128; in func_pol()
5188 t4649 = t3917 * t4648; in func_pol()
5261 t4774 = t4157 * t4648; in func_pol()
8084 …2625 * t4157 * t14603 - 0.4e1 * t12635 * t4774 - 0.4e1 * t3916 * t12877 * t4648 - 0.4e1 * t3916 * … in func_pol()
8141 …931 * t793 + 0.18e2 * t12625 * t15935 * t3917 - 0.12e2 * t13265 * t3916 * t4648 + 0.12e2 * t15925 … in func_pol()
8197 …461 * t463 + 0.18e2 * t12625 * t15935 * t4157 - 0.12e2 * t14413 * t3916 * t4648 - 0.6e1 * t15912 *… in func_pol()
8951 …768e3 + 0.4e1 * t1573 * t1574 * t454 * t4626 + 0.24e2 * t16714 * t16715 * t4648 - 0.16e2 * t5105 *… in func_pol()
8952 t19413 = t1574 * t4648; in func_pol()
8976 …t19560 = t19345 / 0.96e2 - t18925 + 0.24e2 * t16714 * t17311 * t4648 - 0.6e1 * t1573 * t4972 * t15… in func_pol()
[all …]
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| H A D | gga_x_bpccac.c | 1490 double t4540, t4557, t4565, t4574, t4583, t4616, t4637, t4648; in func_pol() local
3089 t4648 = t245 * t2131; in func_pol()
3092 … * t628 * t1526 * t836 - 0.476e3 / 0.27e2 * t245 * t1526 * t842 - 0.4e1 * t4648 * t265 + 0.32e2 / … in func_pol()
3194 …632 + t3951 * t1002 / 0.2e1 - 0.19e2 / 0.9e1 * t350 * t650 * t95 * t109 + t4648 * t359 - 0.32e2 / … in func_pol()
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| H A D | gga_x_hjs.c | 202 double t4646, t4648, t4656, t4672, t4685, t4699, t4700, t4706; in func_unpol() local
1682 …t4648 = 0.8e1 * t4607 + 0.12e2 * t4611 - 0.6e1 * t4614 + 0.2e1 * t4617 - t4620 / 0.2e1 + 0.3e1 * t… in func_unpol()
4618 double t4629, t4633, t4637, t4641, t4648, t4651, t4654, t4655; in func_pol() local
7719 t4648 = t1739 * t4574; in func_pol()
7727 …t4668 = -0.27e2 / 0.4e1 * t4648 * t267 + 0.3e1 / 0.2e1 * t4651 * t267 - 0.3e1 / 0.2e1 * t1348 * t4… in func_pol()
7740 …t4717 = -0.27e2 / 0.4e1 * t4685 + 0.3e1 / 0.2e1 * t4688 + 0.27e2 / 0.4e1 * t4648 - 0.3e1 / 0.2e1 *… in func_pol()
10883 …8e1 * t13891 * t3679 - 0.27e2 / 0.2e1 * t3678 * t14185 + 0.27e2 / 0.4e1 * t4648 * t3632 - 0.3e1 / … in func_pol()
17031 …/ 0.2e1 + 0.27e2 / 0.4e1 * t4648 * t12721 - 0.3e1 / 0.4e1 * t13896 * t12715 + 0.3e1 * t4651 * t127… in func_pol()
17401 t50609 = t4648 * t1808; in func_pol()
17402 t50612 = t4648 * t746; in func_pol()
[all …]
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| H A D | gga_c_pbe.c | 1607 double t4642, t4645, t4646, t4647, t4648, t4652, t4653, t4654; in func_pol() local
4213 t4648 = t526 * t526; in func_pol()
4214 t4652 = 0.35089341735807877242e1 * t235 * t511 * t4648 * t221; in func_pol()
4241 t4732 = 0.51947577317044391277e2 * t235 * t596 * t4648 * t599; in func_pol()
4266 …t4841 = 0.51947577317044391277e2 * t657 * t4648 * t599 - 0.35089341735807877242e1 * t650 * t4648 *… in func_pol()
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| H A D | gga_x_beefvdw.c | 1772 double t4601, t4603, t4604, t4630, t4635, t4637, t4648, t4650; in func_pol() local
3463 t4648 = t7 * t744 * t2031; in func_pol()
3464 …t7 * t737 * t4635 * t178 * t4637 / 0.3e1 - t7 * t554 * t4635 * t97 * t4637 / 0.3e1 - t4648 / 0.3e1; in func_pol()
3502 …t4989 = -t7 * t287 * t2283 * t288 / 0.2e1 + t4630 / 0.4e1 - t4648 / 0.2e1 - t4656 / 0.2e1 + t4659 … in func_pol()
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| H A D | gga_c_optc.c | 6451 t4648 = t844 * t4646 * t99; in func_pol()
6456 t4653 = t4648 * t4652; in func_pol()
6600 t4992 = t4648 * t4991; in func_pol()
10750 t15686 = t4648 * t15685; in func_pol()
10756 t15694 = t4648 * t15693; in func_pol()
10973 t16348 = t4648 * t16347; in func_pol()
11060 t16553 = t4648 * t16552; in func_pol()
11275 t17308 = t4648 * t17307; in func_pol()
18293 t52450 = t4648 * t52139 * t4651; in func_pol()
18304 t52475 = t4648 * t15668 * t15684; in func_pol()
[all …]
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| H A D | gga_c_scan_e0.c | 1627 double t4624, t4641, t4643, t4646, t4648, t4650, t4651, t4655; in func_pol() local
4275 t4648 = t682 * t654 * t4646; in func_pol()
4283 … * t4641 - 0.98781737744032673980e-1 * t4643 - 0.19756347548806534796e0 * t4648 + 0.39268789572319… in func_pol()
4662 …* t4641 - 0.49390868872016336991e-1 * t4643 - 0.49390868872016336991e-1 * t4648 + 0.29451592179239… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 178 double t4501, t4540, t4543, t4569, t4599, t4622, t4648, t4654; in func_unpol() local
1426 t4648 = t1410 * t204; in func_unpol()
1430 …945 - 0.33611150622326622096e-5 * t1904 * t63 * t4648 - 0.10863392770340942874e-5 * t1912 * t123 *… in func_unpol()
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| H A D | gga_c_regtpss.c | 2492 double t4637, t4639, t4641, t4644, t4645, t4648, t4650, t4651; in func_pol() local
5532 t4648 = 0.13009920719177044025e-1 * t1471 * t732; in func_pol()
5556 …854491829355115987e0 * t1486 * t962 + 0.10975748638225852664e-1 * t4645 - t4648 - 0.28912093960683… in func_pol()
5729 …68140941025997310e0 * t4524 * t1576 + 0.54878743191129263322e-2 * t4645 - t4648 - 0.14456046980341… in func_pol()
5816 …t5085 - 0.26020884564615598386e1 * t1439 * t5351 - 0.43368140941025997310e0 * t459 * t5373 - t4648; in func_pol()
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| H A D | gga_c_acggap.c | 196 double t4477, t4527, t4534, t4567, t4613, t4641, t4648, t4669; in func_unpol() local
1612 t4648 = t327 * t1092; in func_unpol()
1752 …64615598386e1 * t2235 * t2289 - 0.26020884564615598386e1 * t868 * t2286 * t4648 * t606 + 0.2602088… in func_unpol()
1759 … * t869 * t327 * t1707 + 0.26020884564615598386e1 * t868 * t260 * t1376 * t4648 * t1380 + 0.130104… in func_unpol()
1766 …1 * t860 * t854 * t2222 * t162 + 0.43368140941025997310e0 * t868 * t874 * t4648 * t82 + 0.39512695… in func_unpol()
4139 double t4646, t4648, t4651, t4654, t4656, t4657, t4660, t4661; in func_pol() local
8564 t4648 = t4646 * t166 * t4618; in func_pol()
8572 … + 0.85748036236139473944e-3 * t4644 - 0.25724410870841842183e-1 * t402 * t4648 - 0.80031500487063… in func_pol()
13054 t15529 = t1030 * t4648; in func_pol()
13540 t17633 = t1016 * t4648; in func_pol()
[all …]
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| H A D | gga_c_pw91.c | 2037 double t4645, t4647, t4648, t4649, t4650, t4651, t4652, t4654; in func_pol() local
5046 t4648 = 0.77534644304710291488e-2 * t4647; in func_pol()
5085 …t4694 = t4642 - t4645 + t4648 + t4651 - t4656 + t4659 + t4662 - t4666 + t4669 - t4672 - t4677 - t4… in func_pol()
8159 …t15072 = -t5259 + t4642 - t4645 + t4648 + t5021 - t5260 + t15068 - t15069 + t15070 - t15071 - t526… in func_pol()
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| H A D | gga_x_ityh.c | 1390 double t4634, t4635, t4648, t4676, t4713, t4722, t4723, t4726; in func_ferr() local
2318 …t4648 = 0.2e1 * t506 * t1778 - 0.3e1 / 0.2e1 * t1265 * t1764 - 0.9e1 / 0.4e1 * t961 * t1764 + t346… in func_ferr()
2338 …e1 * t1065 * t1477 - 0.4e1 / 0.3e1 * t38 * t39 * (t4549 + t4578 + t4612 + t4648 + t4676 + t4713 + … in func_ferr()
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| H A D | gga_c_gapc.c | 281 double t4640, t4645, t4648, t4653, t4656, t4659, t4664, t4667; in func_unpol() local
2524 t4648 = t392 * t1721; in func_unpol()
2526 … - 0.64871090864172852780e-2 * t4645 * t547 + 0.29518907335069444446e-5 * t4648 * t1725 - 0.506805… in func_unpol()
3836 …07 * t13837 + 0.12050706115393220915e-3 * t3343 * t539 - 0.88556722005208333337e-5 * t4648 * t4795; in func_unpol()
4325 double t4648, t4651, t4654, t4655, t4658, t4661, t4662, t4665; in func_ferr() local
6612 t4648 = t4647 * t1744; in func_ferr()
6630 …t4692 = 0.16882049790461501057e-6 * t4643 * t1745 + 0.16882049790461501057e-6 * t1739 * t4648 - 0.… in func_ferr()
7930 …249483064819836e-4 * t12989 * t3334 - 0.37140509539015302324e-5 * t4639 * t4648 - 0.18570254769507… in func_ferr()
7966 …088331128452164e-4 * t12897 * t4080 + 0.50646149371384503171e-6 * t4643 * t4648 + 0.69565088331128… in func_ferr()
8191 …846004228e-6 * t254 * t5762 * t1745 + 0.67528199161846004228e-6 * t5789 * t4648 - 0.33816362383187… in func_ferr()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_tm.c | 2179 double t4637, t4639, t4641, t4643, t4645, t4648, t4650, t4651; in func_ferr() local
3446 t4648 = t674 * t308; in func_ferr()
3447 …+ 0.72e2 * t4639 + 0.36e2 * t4641 + 0.36e2 * t4643 + 0.18e2 * t4645 + 0.18e2 * t4648 + t675 + t679; in func_ferr()
3475 … * t453 - 0.48e2 * t4793 * t453 - 0.24e2 * t474 * t4643 - 0.12e2 * t474 * t4648 + 0.324e3 * t466 *… in func_ferr()
3479 …* t1170 + 0.48e2 * t118 * t4639 + 0.24e2 * t118 * t4643 + 0.12e2 * t118 * t4648 + 0.48e2 * t1238 *… in func_ferr()
4219 double t4648, t4651, t4653, t4661, t4663, t4665, t4671, t4673; in func_pol() local
6443 t4648 = t1357 * t1070; in func_pol()
6469 …465869629629629630e0 * t1356 * t4645 - 0.33959641333333333334e1 * t3525 * t4648 - 0.15093173925925… in func_pol()
8257 …55289876543209876e1 * t3530 * t4645 + 0.11319880444444444445e2 * t10054 * t4648 - 0.30186347851851… in func_pol()
8845 …10579753086419753e0 * t3530 * t5848 - 0.67919282666666666667e1 * t12870 * t4648 - 0.15093173925925… in func_pol()
[all …]
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| H A D | mgga_x_rtpss.c | 1591 double t4633, t4648, t4654, t4657, t4680, t4688, t4711, t4717; in func_ferr() local
2767 t4648 = t683 * t683; in func_ferr()
2769 …1777 + 0.73e2 / 0.32400e5 * t1097 * t1780 + 0.73e2 / 0.103680e6 * t2130 * t4648 - 0.73e2 / 0.43200… in func_ferr()
3099 double t4630, t4634, t4645, t4646, t4648, t4650, t4653, t4655; in func_pol() local
5616 t4648 = t555 * t3994; in func_pol()
5622 …t4660 = 0.9e1 / 0.16e2 * t653 * t3645 - 0.75e2 / 0.128e3 * t4646 - 0.9e1 / 0.64e2 * t4648 - 0.81e2… in func_pol()
7583 …t12514 = -0.15e2 / 0.8e1 * t4648 - 0.45e2 / 0.16e2 * t3983 * t10168 + 0.9e1 / 0.8e1 * t3983 * t101… in func_pol()
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| H A D | mgga_k_pc07.c | 8104 double t4648, t4653, t4656, t4659, t4662, t4665, t4668, t4669; in func_pol() local
10948 t4648 = t1521 * t155; in func_pol()
10963 …9022073214e0 * t4640 * t4641 + 0.261371889e1 * t4645 * t170 - 0.48501e1 * t4648 * t866 - 0.97002e1… in func_pol()
15214 …t22940 = -0.145503e2 * t4648 * t3342 - 0.291006e2 * t22823 * t866 + 0.9409388004e2 * t6629 * t333 … in func_pol()
15263 …- 0.873018e2 * t4665 * t4867 + 0.582012e2 * t1115 * t23245 + 0.582012e2 * t4648 * t3411 - 0.235234… in func_pol()
15743 … + 0.97002e1 * t13689 * t7134 + 0.97002e1 * t1339 * t23274 + 0.194004e2 * t4648 * t4125 - 0.784115… in func_pol()
15758 …t26541 = -0.522743778e1 * t4032 * t4673 + 0.388008e2 * t18460 * t1161 - 0.48501e1 * t4648 * t4047 … in func_pol()
16906 …3 * t1130 * t22992 + 0.6272925336e2 * t870 * t31860 * t875 - 0.291006e2 * t4648 * t4656 - 0.940938… in func_pol()
16938 …952e1 * t1130 * t23511 + 0.18818776008e3 * t22928 * t1157 + 0.1164024e3 * t4648 * t4653 - 0.940938… in func_pol()
17077 …115667e1 * t26505 * t1134 - 0.784115667e1 * t3518 * t33083 - 0.145503e2 * t4648 * t5550 + 0.253535… in func_pol()
[all …]
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| H A D | mgga_x_regtpss.c | 267 double t4645, t4647, t4648, t4651, t4654, t4657, t4661, t4662; in func_unpol() local
2495 t4648 = t228 * t4647; in func_unpol()
2506 …0 * t1372 + 0.59853333333333333333e0 * t4645 - 0.53868000000000000000e0 * t4648 * t4412 - 0.528736… in func_unpol()
4153 …56098164073195583e0 * t3361 * t14851 * t7220 - 0.10773600000000000000e1 * t4648 * t16182 - 0.10574… in func_unpol()
4188 … - 0.23941333333333333334e1 * t7284 * t16579 + 0.21547200000000000000e1 * t4648 * t15639 - 0.10851… in func_unpol()
4544 double t4635, t4639, t4640, t4645, t4648, t4651, t4654, t4664; in func_ferr() local
6652 t4648 = t1267 * t2406; in func_ferr()
6658 …t4648 - 0.16537777453125000000e0 * t411 * t4651 - 0.24225259941101074218e-3 * t1365 * t4654 * t361… in func_ferr()
6661 …1257 + 0.478953e6 / 0.50e2 * t1462 * t4667 - 0.17739e5 / 0.100e3 * t496 * t4648 + 0.73e2 / 0.50e2 … in func_ferr()
7987 …e2 * t5082 * t4667 - t4675 * t158 / 0.9e1 - 0.17739e5 / 0.100e3 * t1454 * t4648 + 0.73e2 / 0.50e2 … in func_ferr()
[all …]
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| H A D | mgga_x_vt84.c | 228 double t4622, t4644, t4648, t4653, t4675, t4685, t4688, t4690; in func_unpol() local
2069 t4648 = t539 * t539; in func_unpol()
2071 …t4675 = 0.3e1 * t100 * t102 * t104 * t4648 - 0.6e1 * t117 * t581 * t585 - 0.4e1 * t1582 * t237 * t… in func_unpol()
3482 double t4636, t4643, t4648, t4651, t4654, t4657, t4660, t4677; in func_ferr() local
5249 t4648 = t730 * t214; in func_ferr()
5250 …111111111111104e0 * t4643 * t470 + 0.4e1 * t1358 * t210 - 0.17662222222222222221e1 * t4648 * t1524; in func_ferr()
5379 …19 + 0.93973991673819576612e0 * t5503 * t497 + 0.33116666666666666664e0 * t4648 * t1948 + 0.704804… in func_ferr()
5393 …2 + 0.44155555555555555552e0 * t5582 * t1529 - 0.44155555555555555552e0 * t4648 * t1981 - 0.441555… in func_ferr()
5545 …2 - 0.93973991673819576616e0 * t4713 * t2696 + 0.22077777777777777776e0 * t4648 * t2363 + 0.469869… in func_ferr()
5621 …4 - 0.46986995836909788308e0 * t5482 * t294 - 0.41395833333333333332e-1 * t4648 * t2345 + t2647 * … in func_ferr()
[all …]
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| H A D | mgga_x_m06l.c | 2891 double t4609, t4612, t4613, t4614, t4617, t4620, t4647, t4648; in func_pol() local
5017 t4648 = t38 * t4647; in func_pol()
5020 …* t88 * t1656 - 0.540e3 * t351 * t1656 - 0.300e3 * t94 * t1664 + 0.10e2 * t4648 * t304 + 0.10e2 * … in func_pol()
6982 …* t952 - 0.23520e5 * t11129 * t961 - 0.23520e5 * t11133 * t337 + 0.30e2 * t4648 * t60 + 0.60e2 * t… in func_pol()
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| H A D | hyb_mgga_x_pjs18.c | 3643 double t4639, t4641, t4642, t4643, t4645, t4646, t4648, t4650; in func_pol() local
6127 t4648 = t8 * t1347 * t1355; in func_pol()
6159 …t4693 = -t4636 - t4642 - t4646 - t4648 / 0.2e1 - t4653 - t4655 + t4659 + t4667 - t4670 / 0.6e1 - t… in func_pol()
6315 …4632 / 0.18e2 - t4636 / 0.3e1 + t5244 / 0.12e2 + t5247 / 0.12e2 - t5251 - t4648 / 0.6e1 - t4655 / … in func_pol()
8840 …t14518 = -0.4e1 * t4636 - 0.2e1 * t4641 - 0.6e1 * t4645 - 0.2e1 * t4648 - 0.6e1 * t4652 - 0.4e1 * … in func_pol()
8849 … t4632 / 0.3e1 - 0.2e1 * t4636 + t6681 + t7084 - t14543 - t4642 - t4646 - t4648 - t4653 - 0.2e1 * … in func_pol()
9162 …/ 0.3e1 - t5798 / 0.9e1 - 0.2e1 / 0.3e1 * t5801 - t5804 / 0.9e1 - t5250 - t4648 / 0.3e1 - 0.2e1 / … in func_pol()
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| H A D | mgga_x_mggac.c | 15106 t4648 = t9 * t4188; in func_ferr()
15107 t4649 = t4648 * t702; in func_ferr()
15985 t7174 = t4648 * t1350; in func_ferr()
31223 t4648 = t658 * M_PI; in func_pol()
31224 t4649 = t4648 * t394; in func_pol()
31226 t4652 = t4648 * t360; in func_pol()
31228 t4655 = t4648 * t348; in func_pol()
33115 t7305 = t4648 * t482; in func_pol()
34856 t9676 = t4648 * t606; in func_pol()
44575 t26876 = t4648 * t1115; in func_pol()
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