/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_op_b88.c | 840 double t4027, t4030, t4031, t4034, t4035, t4038, t4039, t4040; in func_pol() local 2751 t4030 = t161 * t1009; in func_pol() 2752 t4031 = t4030 * t935; in func_pol() 3958 …000000000e0 * t10356 * t11379 * t372 - 0.40012820000000000000e0 * t1902 * t4030 * t372 + 0.8002564… in func_pol() 4172 …330 * t3267 - 0.20006410000000000000e0 * t1902 * t4030 * t431 - 0.20006410000000000000e0 * t1911 *… in func_pol() 4573 …4 + t16006) - 0.20006410000000000000e0 * t1902 * t4030 * t621 - 0.20006410000000000000e0 * t1911 *… in func_pol() 4596 …3333333333e-1 * t932 * t4030 * t3183 + 0.80025640000000000000e0 * t1902 * t933 * t3173 + 0.2222934… in func_pol() 4643 …951 * t3234 - 0.60019230000000000000e0 * t1902 * t4030 * t687 - 0.60019230000000000000e0 * t1911 *… in func_pol() 4740 …0000000000e0 * t1902 * t4030 * t719 - 0.20006410000000000000e0 * t1911 * t12904 * t3517 - 0.200064… in func_pol() 4808 …t4030 * t800 + 0.12003846000000000000e1 * t1902 * t933 * t3610 + 0.18005769000000000000e1 * t1911 … in func_pol() [all …]
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H A D | gga_x_vmt84.c | 928 double t3883, t3892, t3954, t3975, t4030, t4051, t4106; in func_pol() local 2270 …t4030 = 0.96e2 * t60 * t22 / t946 * t28 + t394 * t396 * t746 * t58 / 0.4608e4 - t383 * t61 * t713 … in func_pol() 2272 v4sigma4[0] = -0.3e1 / 0.8e1 * t237 * t238 * t4030; in func_pol()
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H A D | gga_x_sfat.c | 3138 double t4023, t4027, t4028, t4030, t4033, t4041, t4046, t4048; in func_pol() local 5098 t4030 = t2926 * t557 * t993; in func_pol() 5106 …t4067 = -0.90e2 * t4028 * t4030 - 0.16e2 / 0.27e2 * t137 * t4033 - 0.2e1 / 0.3e1 * t3116 * t568 + … in func_pol() 5193 …t4344 = 0.135e3 / 0.16e2 * t4100 * t4030 - 0.108e3 * t1554 * t4104 - 0.54e2 * t1554 * t4108 - 0.36… in func_pol() 6495 …* t4030 - 0.3240e4 * t1554 * t4285 * t557 * t418 * t2755 - 0.54e2 * t4112 * t4108 - 0.324e3 * t155… in func_pol() 6504 … * t1020 * t597 + 0.4e1 / 0.3e1 * t137 * t121 * t4344 + 0.90e2 * t11244 * t4030 + 0.1080e4 * t4028… in func_pol() 6514 ….4e1 * t4085 * t1090 + 0.4e1 / 0.3e1 * t3124 * t1542 - 0.270e3 * t11368 * t4030 - 0.270e3 * t4028 … in func_pol() 6777 …432e3 * t5035 * t13715 * t1133 * t18 * t5040 + 0.135e3 / 0.8e1 * t13721 * t4030 + 0.135e3 / 0.16e2… in func_pol() 6792 ….3e1 * t399 * t13905 - 0.4e1 / 0.3e1 * t11283 * t568 - 0.180e3 * t13997 * t4030 + 0.36e2 * t4093 *… in func_pol()
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H A D | gga_x_am05.c | 1757 double t4021, t4024, t4027, t4030, t4033, t4036, t4042, t4050; in func_pol() local 3373 t4030 = t7 * t607 * t1689; in func_pol() 3376 … 0.3e1 - t4018 / 0.6e1 - t4021 / 0.6e1 + t4024 / 0.27e2 - t4027 / 0.6e1 - t4030 / 0.2e1 + t4033 / … in func_pol() 3451 … 0.3e1 * t4021 + 0.4e1 / 0.27e2 * t4024 - 0.2e1 / 0.3e1 * t4027 - 0.2e1 * t4030 + 0.4e1 / 0.27e2 *… in func_pol()
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H A D | gga_c_pbe_vwn.c | 2053 double t4021, t4024, t4025, t4028, t4030, t4032, t4033, t4036; in func_pol() local 4409 t4030 = t1393 * t1143; in func_pol() 4417 …t4045 = -t1384 * t1459 - 0.2e1 * t1392 * t4025 + t1392 * t4028 + t1392 * t4030 + t1392 * t4033 + t… in func_pol() 6020 …t3794 * t1393 * t11008 - 0.4e1 * t1392 * t10630 * t4024 + 0.2e1 * t3783 * t4030 - 0.12e2 * t3999 *… in func_pol() 6214 …* t3808 * t11982 - 0.6e1 * t494 * t3788 * t1379 * t1321 + 0.2e1 * t3993 * t4030 + t1392 * t11992 *… in func_pol() 6629 …* t1457 + 0.4e1 * t1529 * t4016 + 0.2e1 * t4460 * t4028 + 0.2e1 * t4460 * t4030 - 0.6e1 * t4468 * … in func_pol()
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H A D | gga_c_op_pbe.c | 853 double t4030, t4032, t4036, t4046, t4049, t4050, t4051, t4052; in func_pol() local 2896 t4030 = t1086 * t1000; in func_pol() 2897 …431101520000000000e2 * t4026 - 0.12000000000000000000e2 * t4028 - 0.12000000000000000000e2 * t4030; in func_pol() 2975 …6 - 0.30000000000000000000e1 * t4028 - t4322 - 0.30000000000000000000e1 * t4030 - 0.60000000000000… in func_pol()
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H A D | gga_x_gg99.c | 167 double t4016, t4023, t4024, t4029, t4030, t4034, t4039, t4040; in func_unpol() local 1350 t4030 = t886 * t313; in func_unpol() 1359 …4 + 0.273e3 / 0.32e2 * t4029 * t4030 * t3747 + 0.189e3 / 0.16e2 * t4029 * t4034 * t3747 + 0.273e3 … in func_unpol() 1456 …t1392 + 0.63e2 / 0.2e1 * t4112 * t1346 * t4803 + 0.91e2 / 0.8e1 * t4029 * t4030 * t4803 + 0.63e2 /… in func_unpol() 1473 … / 0.8e1 * t2927 * t128 * t2772 * t681 * t279 + 0.91e2 / 0.32e2 * t4039 * t4030 * t4955 + 0.63e2 /… in func_unpol() 1560 … * t497 * t2036 + t27 * t275 * t2372 / 0.8e1 + 0.273e3 / 0.32e2 * t4029 * t4030 * t6326 + 0.189e3 … in func_unpol()
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H A D | gga_x_chachiyo.c | 1423 double t4015, t4028, t4029, t4030, t4033, t4034, t4040, t4043; in func_pol() local 4243 …t4030 = -0.64e2 / 0.19683e5 * t3398 - 0.64e2 / 0.59049e5 * t3404 - 0.64e2 / 0.19683e5 * t3406 - 0.… in func_pol() 4340 …248 / 0.3e1 - t3928 - t1259 - t909 - t914 + t8 * (t3966 + t3987 + t4000 + t4030 + t4063 + t4077 + … in func_pol()
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H A D | gga_c_hcth_a.c | 1543 double t4028, t4030, t4031, t4032, t4033, t4035, t4036, t4037; in func_pol() local 3950 t4030 = t2587 * t607; in func_pol() 3951 t4031 = t4030 * t834; in func_pol() 6181 t11476 = t4030 * t2581; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_mbeef.c | 2647 t4030 = t2740 * t3625; in func_unpol() 32527 t4030 = t4028 * t4029; in func_pol() 35574 t15911 = t15910 * t4030; in func_pol() 35589 t15933 = t15932 * t4030; in func_pol() 35669 t16065 = t16064 * t4030; in func_pol() 35786 t16400 = t16399 * t4030; in func_pol() 35792 t16411 = t16410 * t4030; in func_pol() 35824 t16464 = t16463 * t4030; in func_pol() 35830 t16475 = t16474 * t4030; in func_pol() 36521 t19751 = t19750 * t4030; in func_pol() [all …]
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H A D | hyb_mgga_x_js18.c | 180 double t4018, t4020, t4022, t4024, t4026, t4027, t4030, t4045; in func_unpol() local 1751 t4030 = t682 * t763; in func_unpol() 2125 t5614 = t4030 * t154; in func_unpol() 2138 t5688 = t4030 * t229; in func_unpol() 3287 t13512 = t4030 * t493; in func_unpol() 3357 t14363 = t4030 * t403; in func_unpol() 3446 t15131 = t4030 * t1651; in func_unpol() 3474 t15574 = t4030 * t703; in func_unpol() 3643 t17258 = t4030 * t664; in func_unpol() 3716 t18083 = t4030 * t623; in func_unpol() [all …]
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H A D | mgga_x_br89.c | 3248 t4030 = t1442 * t4019; in func_unpol() 8201 t28706 = t3573 * t4030; in func_unpol() 17055 t4030 = t27 * t943; in func_ferr() 17056 t4031 = t4030 * t119; in func_ferr() 36125 t4030 = t805 * t4029; in func_pol() 36129 t4034 = t4030 * t4033; in func_pol() 36651 t4813 = t4030 * t4812; in func_pol() 37349 t5676 = t4030 * t5675; in func_pol() 37589 t5966 = t4030 * t5965; in func_pol() 38452 t7100 = t4030 * t7099; in func_pol() [all …]
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H A D | mgga_x_rtpss.c | 3073 double t4018, t4025, t4030, t4037, t4040, t4043, t4048, t4051; in func_pol() local 5244 t4030 = t2969 * t131; in func_pol() 5250 …6 * t1450 * t1270 + 0.73e2 / 0.600e3 * t2888 * t670 - 0.73e2 / 0.1200e4 * t4030 * t1456 - 0.73e2 /… in func_pol() 5625 …e6 * t1450 * t1592 + 0.73e2 / 0.600e3 * t3673 * t670 - 0.73e2 / 0.600e3 * t4030 * t1721 + 0.73e2 /… in func_pol() 6884 …t4030 * t3382 - 0.73e2 / 0.200e3 * t1455 * t3293 * t568 + 0.73e2 / 0.400e3 * t10286 * t3376 + 0.73… in func_pol() 7361 … * t638 / 0.90e2 - 0.73e2 / 0.600e3 * t10291 * t1721 - 0.73e2 / 0.600e3 * t4030 * t4043 - 0.73e2 /… in func_pol() 7364 …9 * t3698 + 0.73e2 / 0.600e3 * t1455 * t1407 * t1592 + 0.73e2 / 0.300e3 * t4030 * t4040 - 0.73e2 /… in func_pol() 7588 …* t1804 * t1270 - 0.5913e4 / 0.50e2 * t12540 * t4322 + 0.73e2 / 0.400e3 * t4030 * t4331 + 0.73e2 /… in func_pol() 7953 … * t12012 * t1721 + 0.73e2 / 0.100e3 * t3673 * t1724 - 0.73e2 / 0.400e3 * t4030 * t4682 - 0.73e2 /… in func_pol() 8145 …* t4868 - 0.5913e4 / 0.200e3 * t4321 * t1804 * t1592 + 0.73e2 / 0.200e3 * t4030 * t4873 + 0.73e2 /… in func_pol()
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H A D | mgga_x_m11.c | 141 double t4030, t4033, t4034, t4037, t4040, t4041, t4046, t4072; in func_unpol() local 1164 t4030 = t122 * t148; in func_unpol() 1287 …4146 * t5258 + 0.156800e6 * t3900 * t5258 + 0.156800e6 * t4027 * t5258 + 0.56000e5 * t4030 * t5258; in func_unpol() 1364 …19 - 0.153600e6 * t3993 * t5919 - 0.52800e5 * t3996 * t5919 - 0.33600e5 * t4030 * t5919 - 0.11200e… in func_unpol() 3026 double t4008, t4010, t4013, t4016, t4018, t4025, t4029, t4030; in func_pol() local 5007 t4030 = t4029 * t227; in func_pol() 5018 …t4061 = t4030 - 0.2e1 / 0.27e2 * t4032 + t4035 / 0.9e1 + t414 * t657 * t4037 / 0.27e2 - t414 * t66… in func_pol() 7255 t11424 = t414 * t1334 * t4030; in func_pol() 7270 …872 - 0.10e2 / 0.27e2 * t414 * t1340 * t1321 * t1248 + 0.4e1 / 0.27e2 * t414 * t657 * t4030 * t623; in func_pol() 7724 …t13759 = t13666 - t13668 / 0.9e1 + 0.2e1 * t4030 * t746 + 0.6e1 * t1321 * t2083 + t13675 / 0.27e2 … in func_pol() [all …]
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H A D | mgga_x_gvt4.c | 1380 double t3971, t3984, t3995, t4006, t4025, t4029, t4030, t4040; in func_pol() local 3550 t4030 = t157 * t1657; in func_pol() 3552 …v4rho2tau2[2] = t4029 + 0.32e2 / 0.9e1 * t4030 + 0.4e1 / 0.9e1 * t1211 * t698 * t362 + 0.4e1 / 0.3… in func_pol() 3564 …v4rho2tau2[5] = t4029 + 0.16e2 / 0.9e1 * t4030 + 0.16e2 / 0.9e1 * t4052 + 0.4e1 / 0.9e1 * t1211 * … in func_pol()
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H A D | mgga_x_sa_tpss.c | 5566 t4030 = t1387 * t2979; in func_ferr() 10012 t4030 = t1400 * t1325; in func_pol() 10013 t4031 = t4029 * t4030; in func_pol() 10423 t5165 = t1821 * t4030; in func_pol() 10756 t6222 = t2221 * t4030; in func_pol() 13367 t14962 = t5214 * t4030; in func_pol() 13737 t17541 = t2268 * t86 * t4030; in func_pol() 14066 t19757 = t7101 * t4030; in func_pol() 14388 t21756 = t8075 * t4030; in func_pol() 14426 t22210 = t7933 * t4030; in func_pol() [all …]
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H A D | mgga_x_ms.c | 2900 double t4014, t4016, t4018, t4020, t4022, t4024, t4030, t4032; in func_pol() local 5440 t4030 = t8 * t537 * t200; in func_pol() 5441 ….27e2 * t4014 + 0.2e1 / 0.9e1 * t4018 - t8 * t198 * t126 * t4024 / 0.2e1 - 0.20e2 / 0.27e2 * t4030; in func_pol() 5483 …t4248 = -0.5e1 / 0.9e1 * t4030 - t4038 / 0.6e1 + 0.2e1 / 0.3e1 * t4041 + t4044 / 0.3e1 - t4051 / 0… in func_pol() 5530 …t4534 = t3993 / 0.27e2 + t4001 / 0.9e1 + t4018 / 0.27e2 - 0.10e2 / 0.27e2 * t4030 + 0.2e1 / 0.9e1 … in func_pol() 5550 …0.9e1 * t4186 - t4197 / 0.3e1 - 0.5e1 / 0.27e2 * t3976 - 0.5e1 / 0.27e2 * t4030 + t1391 * t1400 * … in func_pol()
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H A D | mgga_c_b88.c | 161 double t4023, t4025, t4027, t4030, t4040, t4055, t4058, t4063; in func_unpol() local 1369 t4030 = t96 * t1429; in func_unpol() 1377 …600000000000000000e1 * t4023 * t3464 * t4027 + 0.42000000000000000000e0 * t4030 * t646 * t1705 - 0… in func_unpol() 1388 …000000000000000003e0 * t4023 * t3644 * t4027 + 0.32000000000000000001e0 * t4030 * t680 * t1705 - 0… in func_unpol() 2677 double t4028, t4030, t4031, t4032, t4033, t4034, t4035, t4036; in func_pol() local 5774 t4030 = 0.40000000000000000000e0 * t3703; in func_pol() 5983 …000e0 * t1288 - 0.29826161777777777780e-1 * t1294 + t4 * (t4028 - t3986 - t4030 - t4033 + t3968 - … in func_pol() 8391 …00000000000000000e0 * t3424 - t3473 - t10919 - t10920 - t10921 - t10922 - t4030 + t3417 + t3419 + … in func_pol()
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H A D | mgga_c_scanl.c | 11177 double t4023, t4024, t4026, t4027, t4030, t4031, t4034, t4035; in func_pol() local 15819 t4030 = t295 * t911; in func_pol() 15820 t4031 = t3288 * t4030; in func_pol() 20154 t14345 = t4030 * t631; in func_pol() 20156 t14349 = t4030 * t643; in func_pol() 20342 t14844 = t4030 * t830; in func_pol() 20344 t14848 = t4030 * t838; in func_pol() 20346 t14852 = t11229 * t4030; in func_pol() 21228 t17260 = t12929 * t4030; in func_pol() 21511 t18137 = t14674 * t4030; in func_pol() [all …]
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H A D | mgga_xc_b98.c | 5603 double t4024, t4025, t4026, t4030, t4031, t4032, t4034, t4035; in func_pol() local 9463 t4030 = 0.1e1 / t961 / t346; in func_pol() 9465 t4032 = t4030 * t4031; in func_pol() 9686 t4493 = t100 * t4030; in func_pol() 10004 t5014 = t4030 * t643; in func_pol() 10747 t6746 = t4030 * t2080; in func_pol() 11015 t7262 = t4030 * t7137; in func_pol() 15869 t16622 = t343 * t4030; in func_pol() 15874 t16649 = t325 * t4030; in func_pol() 15947 t17067 = t630 * t4030; in func_pol() [all …]
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H A D | mgga_x_edmgga.c | 3468 double t3992, t3995, t4005, t4009, t4012, t4026, t4027, t4030; in func_pol() local 5500 t4030 = t62 * t918; in func_pol() 5502 …7139506171188e1 * t490 * t4027 - 0.15243447427901234238e2 * t490 * t941 * t4030 + 0.10488523547622… in func_pol() 6551 …t8346 = -0.34297756712777777035e2 * t1597 * t493 * t4030 + 0.15934382750320792050e0 * t2133 * t927… in func_pol() 7414 …73e1 * t2137 * t711 * t13104 - 0.11432585570925925678e2 * t1597 * t1039 * t4030 - 0.15243447427901… in func_pol() 7911 …73e1 * t2137 * t711 * t15636 - 0.11432585570925925678e2 * t1597 * t1278 * t4030 + 0.33230991249459… in func_pol() 8060 …t4030 + 0.20977047095244633367e3 * t5915 * t5553 * t2986 - 0.76217237139506171188e1 * t490 * t1664… in func_pol()
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H A D | mgga_c_pkzb.c | 6658 t4030 = t1104 * t1104; in func_pol() 6659 t4031 = t4030 * t1031; in func_pol() 6662 t4036 = t4035 * t4030; in func_pol() 11181 t13555 = t717 * t4030; in func_pol() 11184 t13560 = t1931 * t4030; in func_pol() 12341 t14940 = t4030 * t1104; in func_pol() 17889 t46026 = t5557 * t4030; in func_pol() 18483 t48650 = t4030 * t966; in func_pol() 18503 t48808 = t4030 * t994; in func_pol() 20183 t55629 = t4030 * t3896; in func_pol() [all …]
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H A D | mgga_x_2d_prhg07.c | 4480 double t4027, t4030, t4033, t4040, t4043, t4046, t4050, t4053; in func_pol() local 7698 t4030 = t762 * t1992; in func_pol() 7705 …e1 / 0.4e1 * t150 * t4023 - t150 * t4027 / 0.2e1 + 0.3e1 / 0.8e1 * t446 * t4030 + 0.3e1 / 0.4e1 * … in func_pol() 12052 t18821 = 0.9e1 / 0.16e2 * t353 * t4030; in func_pol() 12087 …t18995 = -t150 * t766 * t18037 / 0.2e1 + 0.3e1 / 0.8e1 * t1662 * t4030 + 0.3e1 / 0.8e1 * t446 * t7… in func_pol() 13207 …/ 0.8e1 * t3429 * t4040 + t3909 * t3814 / 0.4e1 + 0.3e1 / 0.8e1 * t3429 * t4030 - t21348 - t20725 … in func_pol() 13431 … t20739 - 0.11e2 / 0.8e1 * t446 * t702 * t14388 + 0.5e1 / 0.8e1 * t3909 * t4030 + 0.11e2 / 0.4e1 *… in func_pol() 13478 … * t167 - 0.6e1 * t150 * t22224 + 0.9e1 / 0.2e1 * t150 * t22228 + t4126 * t4030 / 0.4e1 - 0.11e2 /… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_xc_bn05.c | 949 double t4013, t4016, t4019, t4021, t4023, t4026, t4030, t4032; in func_pol() local 2803 t4030 = t7 * t72 * t49 * t1512; in func_pol() 2824 …t4073 = -0.69204e1 * t3017 - t4030 / 0.32e2 - t4034 / 0.4e1 - t4038 / 0.8e1 - t4042 / 0.8e1 - t404… in func_pol() 2993 …t4620 = -t4019 / 0.4e1 + t4298 - t4299 - 0.3e1 / 0.32e2 * t4030 + t4301 + t4302 - t4455 + t4456 - … in func_pol() 4108 ….4e1 - 0.3e1 / 0.16e2 * t3012 - 0.276816e2 * t3015 - 0.207612e2 * t3017 - t4030 / 0.16e2 - t4034 /… in func_pol() 4119 …2 * t2693 - t6326 - t8090 - t8092 - 0.311418e2 * t3017 - 0.3e1 / 0.16e2 * t4030 - 0.3e1 / 0.4e1 * … in func_pol() 4333 …t12587 = t2693 / 0.4e1 - 0.415224e2 * t3017 - 0.3e1 / 0.8e1 * t4030 + t11 * (t11917 + t11958 + t12… in func_pol()
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H A D | lda_c_ml1.c | 430 double t4017, t4018, t4020, t4025, t4030, t4039, t4040, t4043; in func_pol() local 2207 t4030 = t3972 * t312; in func_pol() 2208 … * t4013 * t75 + t4015 * t4018 + 0.12e2 * t4020 * t75 + 0.12e2 * t4025 * t80 - 0.3e1 * t4030 * t75; in func_pol() 2212 … * t4013 + 0.6e1 * t1076 * t4020 + 0.11e2 * t309 * t4013 + 0.3e1 * t309 * t4030 + 0.4e1 * t309 * t… in func_pol()
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