| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_m06l.c | 5420 t5227 = 0.1e1 / t135; in func_pol()
5421 t5237 = t66 * t5227; in func_pol()
5422 t5240 = t72 * t5227; in func_pol()
5423 t5243 = t78 * t5227; in func_pol()
5424 t5246 = t84 * t5227; in func_pol()
5425 t5249 = t90 * t5227; in func_pol()
5426 t5252 = t96 * t5227; in func_pol()
5427 t5255 = t102 * t5227; in func_pol()
5428 t5258 = t108 * t5227; in func_pol()
5430 t5311 = t369 * t5227; in func_pol()
[all …]
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| H A D | mgga_x_tpss.c | 177 double t5184, t5199, t5212, t5219, t5227, t5232, t5235, t5248; in func_unpol() local
1528 t5227 = t1604 * t1802; in func_unpol()
1530 … t4202 / 0.2e1 + t1587 * t101 * t2213 / 0.8e1 - 0.15e2 / 0.512e3 * t383 * t5227 + 0.3e1 / 0.4096e4… in func_unpol()
1654 …t656 / 0.16e2 + 0.3e1 / 0.8e1 * t1593 * t1813 - 0.45e2 / 0.512e3 * t530 * t5227 - 0.3e1 / 0.16e2 *… in func_unpol()
1673 ….16e2 * t1581 * t2006 + t1783 * t1813 / 0.2e1 - 0.15e2 / 0.256e3 * t653 * t5227 + 0.21e2 / 0.256e3… in func_unpol()
1898 double t5206, t5210, t5214, t5227, t5247, t5288, t5297, t5316; in func_ferr() local
3182 v4rhosigma2tau[0] = t5227 + t5288; in func_ferr()
3638 double t5226, t5227, t5229, t5246, t5251, t5258, t5259, t5261; in func_pol() local
6282 t5227 = t5226 * t5018; in func_pol()
6283 …4e2 * t5217 - 0.81e2 / 0.32e2 * t2142 * t5219 - 0.45e2 / 0.32e2 * t5224 + 0.45e2 / 0.512e3 * t5227; in func_pol()
[all …]
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| H A D | hyb_mgga_x_m05.c | 2310 double t5208, t5210, t5212, t5215, t5221, t5223, t5224, t5227; in func_pol() local
4859 t5227 = 0.1e1 / t1836 / t34; in func_pol()
4870 …t5304 = 0.11536567981289824284e-2 * t5224 + 0.12682151042473010890e-6 * t218 * t5227 * t5228 / t28… in func_pol()
5181 …71 * t645 * t1174 * t833 * sigma[0] - 0.47558066409273790837e-7 * t1171 * t5227 / t28 / t1777 / t6… in func_pol()
5483 …31e-4 * t1164 * t645 * t3833 * t621 + 0.17834274903477671564e-7 * t1171 * t5227 / t28 / t4687 * t1… in func_pol()
5832 …e-7 * t7102 * t1838 * t10119 * t204 - 0.66878530888041268363e-8 * t1171 * t5227 / t28 / t1840 * t1… in func_pol()
6387 v4sigma4[0] = 0.25079449083015475635e-8 * t449 * params->csi_HF * t5227 * t4945 * t5235; in func_pol()
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| H A D | mgga_x_sa_tpss.c | 259 double t5218, t5221, t5222, t5226, t5227, t5228, t5233, t5234; in func_unpol() local
2369 t5227 = t1559 * t5226; in func_unpol()
2505 …t2334 * t5116 - 0.10e2 / 0.9e1 * t467 * t1553 * t739 - 0.125e3 / 0.54e2 * t5227 * t5918 - 0.125e3 … in func_unpol()
3301 … t2342 * t11770 - 0.125e3 / 0.144e3 * t5222 * t1099 - 0.125e3 / 0.864e3 * t5227 * t1104 - 0.125e3 … in func_unpol()
3393 …0.6561e4 * t2342 * t12824 + 0.125e3 / 0.18e2 * t5222 * t12833 + 0.125e3 / 0.108e3 * t5227 * t12836; in func_unpol()
3623 … t5181 * t14934 - 0.125e3 / 0.144e3 * t5222 * t1513 - 0.125e3 / 0.864e3 * t5227 * t1517 - 0.125e3 … in func_unpol()
3680 …447 * t10 * t73 + 0.125e3 / 0.18e2 * t5222 * t15479 + 0.125e3 / 0.108e3 * t5227 * t15473 + 0.125e3… in func_unpol()
3724 …181 * t5411 * t73 - 0.500e3 / 0.9e1 * t5222 * t15877 - 0.250e3 / 0.27e2 * t5227 * t15881 - 0.500e3… in func_unpol()
3977 double t5203, t5204, t5205, t5207, t5208, t5227, t5231, t5243; in func_ferr() local
5962 t5227 = t449 * t470; in func_ferr()
[all …]
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| H A D | mgga_c_tpssloc.c | 11382 t5227 = t5149 * t192; in func_pol()
11385 t5230 = t5227 * t5229; in func_pol()
11633 t5806 = t5227 * t5805; in func_pol()
16470 t18022 = t5227 * t18021; in func_pol()
16483 t18045 = t5227 * t18044; in func_pol()
16542 t18185 = t5227 * t18184; in func_pol()
17486 t20670 = t5227 * t20669; in func_pol()
17502 t20708 = t5227 * t20707; in func_pol()
17518 t20741 = t5227 * t20740; in func_pol()
18105 t22577 = t5227 * t22576; in func_pol()
[all …]
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| H A D | mgga_x_mn12.c | 180 double t5199, t5202, t5205, t5215, t5221, t5227, t5230, t5233; in func_unpol() local
1542 t5227 = t2315 * t223; in func_unpol()
1546 …+ 0.20000e5 / 0.27e2 * t133 * t5173 * t5215 - 0.640000e6 / 0.9e1 * t379 * t5227 - 0.320000e6 / 0.9… in func_unpol()
1549 …t5267 = -0.160000e6 / 0.9e1 * t131 * t5227 - 0.64000e5 / 0.9e1 * t2319 * t5233 - 0.128000e6 / 0.3e… in func_unpol()
1559 …t5227 - 0.320000e6 / 0.9e1 * t46 * t5230 - 0.160000e6 / 0.9e1 * t2807 * t5236 - 0.800000e6 / 0.9e1… in func_unpol()
1565 …e1 * t255 * t5227 - 0.320000e6 / 0.9e1 * t67 * t5230 - 0.16000e5 * t856 * t5233 - 0.32000e5 * t248… in func_unpol()
1603 …e5 * t796 * t5233 - 0.32000e5 * t287 * t5236 - 0.160000e6 / 0.9e1 * t91 * t5227 - 0.16000e5 / 0.9e… in func_unpol()
1622 …t6064 = -0.16000e5 * t1292 * t5233 - 0.32000e5 * t521 * t5236 - 0.160000e6 / 0.9e1 * t151 * t5227 … in func_unpol()
1653 …t6274 = -0.32000e5 * t401 * t5236 - 0.160000e6 / 0.9e1 * t182 * t5227 - 0.16000e5 / 0.9e1 * t176 *… in func_unpol()
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| H A D | hyb_mgga_x_js18.c | 4418 double t5201, t5216, t5219, t5224, t5227, t5234, t5243, t5245; in func_ferr() local
6239 t5227 = t4109 * t1206; in func_ferr()
6274 …t5383 = 0.324e3 * t1562 * t5224 - 0.648e3 * t3190 * t5227 + 0.25155289876543209876e-1 * t2185 * t1… in func_ferr()
7465 … 0.648e3 * t3177 * t5224 - 0.1296e4 * t10313 * t5227 + 0.648e3 * t3180 * t5224 - 0.1296e4 * t10318… in func_ferr()
7904 …t17809 = -0.1296e4 * t11563 * t5227 + 0.648e3 * t1226 * t17776 - 0.24e2 * t11422 * t2082 + 0.58695… in func_ferr()
7913 … 0.108e3 * t5131 * t5373 + 0.324e3 * t1226 * t17875 - 0.1296e4 * t11554 * t5227 + 0.648e3 * t5131 … in func_ferr()
7943 … 0.648e3 * t4499 * t5224 - 0.1296e4 * t11298 * t5227 + 0.648e3 * t4516 * t5224 - 0.1296e4 * t13168… in func_ferr()
8048 …3 * t5131 * t5717 + 0.108e3 * t5131 * t5720 - 0.648e3 * t11554 * t5724 - 0.1296e4 * t14552 * t5227; in func_ferr()
8683 double t5215, t5218, t5221, t5222, t5227, t5236, t5239, t5246; in func_pol() local
12073 t5227 = t1563 * t1154; in func_pol()
[all …]
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| H A D | mgga_x_scan.c | 162 double t5193, t5197, t5199, t5200, t5227, t5231, t5240, t5246; in func_unpol() local
1410 t5227 = t548 * t18; in func_unpol()
1415 …t5268 = my_piecewise3(t79, (-0.625e3 / 0.46656e5 * params->c1 * t661 * t136 * t5227 - 0.3125e4 / 0… in func_unpol()
1427 …t5470 = my_piecewise3(t79, (0.625e3 / 0.5832e4 * params->c1 * t5383 * t136 * t5227 + 0.3125e4 / 0.… in func_unpol()
1446 …t5619 = my_piecewise3(t79, (-0.625e3 / 0.729e3 * params->c1 * t5572 * t136 * t5227 - 0.3125e4 / 0.… in func_unpol()
1475 …t5883 = my_piecewise3(t79, (0.5000e4 / 0.729e3 * params->c1 * t5807 * t136 * t5227 + 0.25000e5 / 0… in func_unpol()
1494 …t5956 = my_piecewise3(t79, (-0.40000e5 / 0.729e3 * params->c1 * t2259 * t136 * t5227 - 0.200000e6 … in func_unpol()
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| H A D | mgga_c_revtpss.c | 4857 double t5222, t5223, t5224, t5225, t5226, t5227, t5230, t5232; in func_pol() local
11848 t5227 = t7 * t5226; in func_pol()
11858 v2rhosigma[0] = t1014 * t1437 + t1016 * t5244 + t1430 * t1022 + t5227 * t395 + t4936 + t5230; in func_pol()
17411 …v3rho2sigma[0] = 0.2e1 * t1014 * t5244 + t1016 * t19498 + 0.2e1 * t5227 * t1022 + t1430 * t2957 + … in func_pol()
19532 … t6420 + t1016 * t25666 + t6406 * t1022 + 0.2e1 * t1430 * t5244 + 0.2e1 * t5227 * t1437 + t25632 *… in func_pol()
19739 … t26075 + t6501 * t1022 + t1430 * t5408 + t5391 * t1437 + t1481 * t5244 + t5227 * t1488 + t26037 *… in func_pol()
19818 … t26278 + t6553 * t1022 + t1430 * t5555 + t5546 * t1437 + t1536 * t5244 + t5227 * t1540 + t26254 *… in func_pol()
20796 … t28704 + t6770 * t1022 + t1430 * t6097 + t6080 * t1437 + t1554 * t5244 + t5227 * t1561 + t28658 *… in func_pol()
20892 … t28894 + t6818 * t1022 + t1430 * t6157 + t6140 * t1437 + t1575 * t5244 + t5227 * t1582 + t28848 *… in func_pol()
30501 …5 + t76112 + t76164 + 0.2e1 * t76110 + t82198 + t76173 + t76168 + 0.2e1 * t5227 * t4120 + 0.2e1 * … in func_pol()
[all …]
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| H A D | mgga_x_mvsb.c | 2517 double t5209, t5223, t5224, t5227, t5230, t5232, t5233, t5235; in func_pol() local
5519 t5227 = 0.1e1 / t145 / t1578; in func_pol()
5520 t5230 = t134 * t5227 * t58 * t620; in func_pol()
5530 t5266 = t215 * t5227 * t114 * t635; in func_pol()
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| H A D | mgga_x_2d_prhg07.c | 197 double t5205, t5207, t5208, t5227, t5238, t5250, t5251, t5254; in func_unpol() local
1753 …t5227 = -t714 - t208 + t717 - t721 - t660 + t681 - t4731 * t165 * t1824 / 0.8e1 + 0.11e2 / 0.8e1 *… in func_unpol()
1769 v4rholapltau2[0] = t5227 + t5262 + t5283 + t5289 + t5316 + t5347 + t5349 + t5354; in func_unpol()
4522 double t5207, t5210, t5211, t5216, t5221, t5223, t5227, t5229; in func_pol() local
8044 t5227 = t1022 * t1136; in func_pol()
8048 …/ 0.8e1 * t5221 + 0.3e1 / 0.16e2 * t1017 * t356 * t5223 + 0.3e1 / 0.8e1 * t5227 + 0.3e1 / 0.16e2 *… in func_pol()
8127 …5211 - 0.9e1 / 0.16e2 * t5216 - 0.9e1 / 0.16e2 * t5221 + 0.9e1 / 0.16e2 * t5227 + 0.9e1 / 0.16e2 *… in func_pol()
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| H A D | mgga_xc_b97mv.c | 216 double t5216, t5227, t5235, t5270, t5274, t5299, t5305, t5325; in func_unpol() local
1868 …t5227 = -0.99952704e-1 * t1677 * t422 * t2513 * t361 + 0.53308108800000000000e0 * t1677 * t336 * t… in func_unpol()
1869 …* t2289 + t133 * (t4887 + t4938 + t4988 + t5040 + t5086 + t5129 + t5182 + t5227) + 0.3e1 * t776 * … in func_unpol()
3880 double t5219, t5220, t5222, t5223, t5224, t5225, t5226, t5227; in func_pol() local
7707 t5227 = t4705 * t521; in func_pol()
7708 t5228 = t5227 * t202; in func_pol()
12089 …t17121 = -0.40000000000000000000e1 * t1231 * t5227 * t2224 - 0.40000000000000000000e1 * t1223 * t4… in func_pol()
12403 …5000000000000000000e1 * t17172 * t794 + 0.50000000000000000001e0 * t502 * t5227 * t830 + 0.1034520… in func_pol()
13922 …000000000000e1 * t1213 * t5208 * t974 + 0.50000000000000000001e0 * t502 * t5227 * t974 + 0.3e1 * t… in func_pol()
14513 …000000000000000000e1 * t1205 * t10756 + 0.50000000000000000001e0 * t502 * t5227 * t1079 + 0.103452… in func_pol()
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| H A D | mgga_c_m05.c | 3223 double t5218, t5219, t5220, t5222, t5224, t5225, t5227, t5228; in func_pol() local
6966 t5227 = t1390 * t650; in func_pol()
6967 t5228 = t5227 * t361; in func_pol()
10667 …t12825 = 0.15000000000000000000e1 * t5227 * t1071 + 0.48245938496077605201e2 * t1823 * t1158 * t11… in func_pol()
12120 … - 0.10363566666666666667e0 * t1888 * t7322 - 0.62500000000000000001e-1 * t5227 * t2439 - 0.125000… in func_pol()
12131 …0e-2 * t23904 * t421 + 0.2e1 * t1981 * t2509 + 0.50000000000000000001e0 * t5227 * t2382 + 0.100000… in func_pol()
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| H A D | mgga_c_bc95.c | 2363 double t5226, t5227, t5229, t5230, t5231, t5232, t5233, t5234; in func_pol() local
6123 t5227 = t126 * t5226; in func_pol()
6124 …74000000000000000e0 * t5217 + 0.10274000000000000000e0 * t5221 - 0.17123333333333333333e-1 * t5227; in func_pol()
6371 …05 + 0.4e1 / 0.3e1 * t5209 - 0.2e1 / 0.3e1 * t5213 - 0.2e1 * t5217 + 0.2e1 * t5221 - t5227 / 0.3e1; in func_pol()
6372 …1 * t5209 - 0.30988500000000000000e1 * t5217 - 0.51647500000000000000e0 * t5227 + 0.20839000000000… in func_pol()
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| H A D | mgga_x_task.c | 3269 double t5226, t5227, t5230, t5231, t5250, t5252, t5255, t5256; in func_pol() local
5922 t5227 = t589 * t5226; in func_pol()
5926 …75000000000000000000e1 * t515 * t5223 - 0.33750000000000000000e2 * t515 * t5227 - 0.37500000000000… in func_pol()
7460 t13372 = 0.45000000000000000000e2 * t3388 * t5227; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th1.c | 621 double t5215, t5220, t5226, t5227, t5230, t5233, t5248, t5249; in func_pol() local
2147 t5227 = t5226 * t164; in func_pol()
2154 …t5227 - 0.4e1 / 0.3e1 * t1045 * t5230 + t1045 * t5233 / 0.3e1 + 0.28e2 / 0.9e1 * t1050 * t5227 + t… in func_pol()
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| H A D | gga_c_lyp.c | 615 double t5188, t5191, t5204, t5212, t5227, t5230, t5231, t5234; in func_pol() local
2457 t5227 = t786 * t7 * t113; in func_pol()
2462 …t1953 + 0.880e3 / 0.81e2 * t76 * t2262 * t162 - 0.880e3 / 0.9e1 * t1571 * t5227 + 0.440e3 / 0.9e1 … in func_pol()
2488 t5304 = t3741 * t5227; in func_pol()
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| H A D | gga_c_zpbeint.c | 2059 double t5225, t5226, t5227, t5228, t5229, t5230, t5231, t5232; in func_pol() local
5611 t5227 = t394 * t4883; in func_pol()
5612 t5228 = t5227 * t442; in func_pol()
8578 t17774 = t5227 * t4071; in func_pol()
8719 t18279 = t5227 * t4066; in func_pol()
8892 t19174 = t5227 * t4239; in func_pol()
8922 t19283 = t5227 * t4236; in func_pol()
9376 t21086 = t5227 * t4901; in func_pol()
9400 t21169 = t5227 * t5038; in func_pol()
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| H A D | gga_x_hjs.c | 2400 double t5176, t5217, t5221, t5224, t5227, t5230, t5233, t5236; in func_ferr() local
3908 t5227 = t513 * t1735; in func_ferr()
7963 t5227 = t690 * t20; in func_pol()
7964 t5229 = t591 * t5227 * t489; in func_pol()
8200 t5887 = t800 * t5227 * t789; in func_pol()
8483 t6539 = t800 * t5227 * t1009; in func_pol()
8755 t7255 = t591 * t5227 * t921; in func_pol()
11612 t16612 = t800 * t5227 * t2088; in func_pol()
11993 t17921 = t591 * t5227 * t1677; in func_pol()
13110 t22390 = t591 * t5227 * t2958; in func_pol()
[all …]
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| H A D | gga_c_revtca.c | 1348 double t5213, t5216, t5217, t5218, t5219, t5220, t5225, t5227; in func_pol() local
4096 t5227 = t3213 * t2909 * t56; in func_pol()
4097 t5231 = 0.31158711298577793138e1 * t5227 * t510 * t113 * t2912; in func_pol()
4398 t5899 = 0.31158711298577793138e1 * t5227 * t566 * t113 * t2912; in func_pol()
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| H A D | gga_x_sfat.c | 3187 double t5218, t5221, t5222, t5223, t5226, t5227, t5230, t5231; in func_pol() local
5528 t5227 = t5226 * t236; in func_pol()
5540 …8 - 0.12566370614359172954e2 * t1617 * t5223 + 0.47374101125228921372e3 * t5227 * t1922 - 0.189496… in func_pol()
6757 …1125228921372e3 * t1176 * t62 * t236 * t1922 + 0.12633093633394379033e4 * t5227 * t5237 - 0.279252… in func_pol()
6961 …9 + 0.75398223686155037724e2 * t1614 * t5673 - 0.28424460675137352823e4 * t5227 * t5681 - t512 * t… in func_pol()
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| H A D | gga_c_sogga11.c | 3084 double t5226, t5227, t5228, t5230, t5231, t5233, t5234, t5236; in func_pol() local
6355 t5227 = t1445 * t5226; in func_pol()
6356 t5228 = t5225 * t5227; in func_pol()
6374 t5253 = t5252 * t5227; in func_pol()
11316 t19228 = t19227 * t5227; in func_pol()
11326 t19243 = t19242 * t5227; in func_pol()
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| H A D | gga_x_hjs_b88_v2.c | 6653 double t5227, t5228, t5231, t5235, t5238, t5241, t5244, t5252; in func_pol() local
10145 …t5227 = 0.47459600000000000000e-1 * t5197 * t108 + 0.94919200000000000000e-1 * t1178 * t1166 + 0.4… in func_pol()
10146 t5228 = t5227 * t171; in func_pol()
13550 t16503 = t5227 * t588; in func_pol()
13884 t17596 = t5227 * t848; in func_pol()
14195 t19238 = t5227 * t1219; in func_pol()
20014 …t51157 = -t5227 * t1955 * t173 / 0.9e1 - 0.2e1 / 0.9e1 * t12771 * t1219 * t173 - (t50887 + t50913 … in func_pol()
20348 …44444444444444e-1 * t505 * t17607 * t132 - t16438 * t848 * t173 / 0.9e1 - t5227 * t2646 * t173 / 0… in func_pol()
20578 …169 * t10561 - 0.4e1 * t5094 * t10561 - 0.4e1 / 0.9e1 * t52715 + t50567 - t5227 * t3070 * t173 / 0… in func_pol()
21131 …19 - 0.4e1 * t1220 * t16619 - 0.15819866666666666667e0 * t16442 * t1191 - t5227 * t4159 * t173 / 0… in func_pol()
[all …]
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| H A D | gga_c_zvpbeint.c | 2477 double t5227, t5228, t5229, t5230, t5234, t5235, t5236, t5237; in func_pol() local
6193 t5227 = t503 * t5053; in func_pol()
6194 t5228 = t308 * t5227; in func_pol()
9581 …101 * t4787 - t16984 / 0.32e2 - 0.3e1 / 0.16e2 * t16992 + 0.2e1 * t2292 * t5227 + 0.9e1 / 0.8e1 * … in func_pol()
9717 …23 - 0.3e1 / 0.16e2 * t17907 + 0.3e1 / 0.128e3 * t14606 + 0.6e1 * t3089 * t5227 - 0.9e1 / 0.16e2 *… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pk09.c | 2540 double t5205, t5207, t5210, t5211, t5224, t5227, t5229, t5232; in func_pol() local
5112 t5227 = t5224 * t89 * t1446 * t1394; in func_pol()
5122 …160612837389e1 * t1385 * t89 * t1457 * t1394 + 0.71081757481838512167e1 * t5227 + 0.28432702992735… in func_pol()
6305 …1 * t5202 - 0.19489173774580151667e2 * t5205 + 0.35540878740919256083e1 * t5227 + 0.14216351496367… in func_pol()
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