| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_acggap.c | 1172 t2102 = t199 * t745; in func_unpol()
7208 t2102 = t432 * t378; in func_pol()
7210 t2105 = t2102 * t2104; in func_pol()
7317 t2297 = t2102 * t2296; in func_pol()
9546 t7226 = t2102 * t7225; in func_pol()
9568 t7268 = t2102 * t7267; in func_pol()
10025 t7874 = t2102 * t7873; in func_pol()
10163 t8235 = t2102 * t8234; in func_pol()
10195 t8311 = t2102 * t8310; in func_pol()
10215 t8353 = t2102 * t8352; in func_pol()
[all …]
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| H A D | gga_k_exp4.c | 533 double t2055, t2060, t2063, t2068, t2075, t2099, t2102, t2103; in func_pol() local
1379 t2102 = t6 * t90 * t380; in func_pol()
1384 …7e-8 * t229 * t372 / t22 / t565 / t230 * t1222) + 0.3e1 / 0.2e1 * t2099 + t2102 - t357 * t2103 * t… in func_pol()
1405 …/ 0.3e1 * t2060 + 0.5e1 / 0.6e1 * t2063 + t2099 / 0.2e1 + 0.2e1 / 0.3e1 * t2102 + t921 * t860 * t7… in func_pol()
1422 …+ t2158 + t2143 + 0.5e1 / 0.3e1 * t2161 + 0.5e1 / 0.9e1 * t2114 - t2054 + t2102 / 0.3e1 + 0.5e1 / … in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 4084 t2102 = t15 * t578; in func_pol()
4085 t2103 = t2102 * t1373; in func_pol()
4500 t2999 = t2102 * t2780; in func_pol()
4629 t3351 = t2102 * t3192; in func_pol()
5404 t5146 = t2102 * t4503; in func_pol()
5413 t5177 = t2102 * t4595; in func_pol()
6114 t6722 = t2102 * t6450; in func_pol()
6119 t6742 = t2102 * t6459; in func_pol()
6121 t6748 = t2102 * t6455; in func_pol()
6942 t8806 = t2102 * t8503; in func_pol()
[all …]
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| H A D | gga_c_am05.c | 895 double t2085, t2086, t2088, t2092, t2094, t2096, t2099, t2102; in func_pol() local
1940 t2102 = 0.13012297560362087810e0 * t2096 * t980 * t877; in func_pol()
1943 …088 - t2092 - 0.73245789224026180216e-3 * t2094 - t1861 + t1865 + t2099 - t2102 - t1868 + t1871 + … in func_pol()
2081 …t2503 = 0.10389515463408878255e3 * t2487 - t1861 + t1865 + t2099 - t2102 - t1868 + t1871 + 0.3e1 *… in func_pol()
2126 …8e1 * t2620 + t40 * t2671 * t81 + 0.8e1 * t2674 + 0.8e1 * t2676 + t2099 - t2102 - t1868 + t1871 + … in func_pol()
2157 …t2870 = t40 * t2859 * t81 - t1861 + t1865 - t1868 + t1871 + t2099 - t2102 - t2494 + 0.72e2 * t2495… in func_pol()
2179 …t2999 = 0.6e1 * t2617 - 0.48e2 * t2620 - 0.48e2 * t2676 + t2099 - t2102 - t1868 + t1871 - t2104 - … in func_pol()
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| H A D | gga_c_op_xalpha.c | 364 double t2095, t2102, t2109, t2129, t2135, t2146, t2147, t2165; in func_pol() local
1129 …t2102 = -0.21683330888888888888e0 * t536 * t668 * t655 + 0.24092589876543209876e-1 * t531 * t228 *… in func_pol()
1131 v4rho4[3] = t1859 + t1891 + t1917 + t1939 + t1960 + t2007 + t2052 + t2102; in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1064 double t2091, t2094, t2097, t2102, t2106, t2108, t2119, t2141; in func_pol() local
2151 t2102 = 0.10e2 / 0.27e2 * t7 * t68 * t1051 * t104; in func_pol()
2162 …(t2021 + t2085) - t2091 / 0.2e1 - 0.5e1 / 0.9e1 * t2094 + t2097 / 0.2e1 + t2102 + t2106 - 0.2e1 / … in func_pol()
2207 …0.36e2 * t2298 - t2091 / 0.8e1 - 0.5e1 / 0.12e2 * t2094 + t2097 / 0.4e1 + t2102 + t2106 + t1026 * … in func_pol()
2251 ….3e1 - 0.5e1 / 0.18e2 * t2298 - 0.5e1 / 0.18e2 * t2094 + t2097 / 0.12e2 + t2102 + t2106 + t1041 * … in func_pol()
2278 …t2783 = -0.5e1 / 0.12e2 * t2298 - 0.5e1 / 0.36e2 * t2094 + t2102 + t2106 + t1026 * t1035 * t491 * … in func_pol()
2321 …t3085 = -0.5e1 / 0.9e1 * t2298 + t2102 + t2106 + 0.2e1 / 0.3e1 * t1026 * t444 * t491 * t497 + 0.2e… in func_pol()
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| H A D | gga_c_lm.c | 837 double t2099, t2102, t2103, t2113, t2114, t2130, t2134, t2137; in func_pol() local
2068 t2102 = t108 * t729; in func_pol()
2072 …96 - 0.128e3 / 0.9e1 * t2099 * t945 - 0.8e1 / 0.9e1 * t2102 * t2103 * t327 - 0.16e2 / 0.9e1 * t210… in func_pol()
2183 …2074 + t2090 + 0.64e2 / 0.27e2 * t2113 * t2114 * t325 - 0.64e2 / 0.27e2 * t2102 * t2103 * t325 + 0… in func_pol()
2209 …2 * t108 * t2754 - 0.16e2 / 0.9e1 * t2102 * t527 * t36 * t294 - 0.32e2 / 0.9e1 * t205 * t1223 - 0.… in func_pol()
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| H A D | gga_c_w94.c | 550 double t2070, t2075, t2077, t2079, t2081, t2085, t2093, t2102; in func_pol() local
1530 t2102 = t350 * t201 * t1468; in func_pol()
1531 …5e1 / 0.27e2 * t115 * t1745 * t2081 - 0.10e2 / 0.9e1 * t115 * t558 * t2085 + 0.5e1 / 0.3e1 * t2102; in func_pol()
1564 … t547 * t2212 + 0.25e2 / 0.6e1 * t2079 + 0.10e2 / 0.3e1 * t2093 + 0.5e1 * t2102 + 0.10e2 * t1914 +… in func_pol()
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| H A D | gga_x_hjs.c | 6866 t2102 = t806 * t806; in func_pol()
8244 t5986 = t2102 * t806; in func_pol()
8277 t6059 = t789 * t2102; in func_pol()
8538 t6677 = t1094 * t2102; in func_pol()
8541 t6685 = t1009 * t2102; in func_pol()
10060 t11271 = t1436 * t2102; in func_pol()
10096 t11356 = t3899 * t2102; in func_pol()
10108 t11424 = t391 * t2102; in func_pol()
11655 t16717 = t2102 * t2102; in func_pol()
12347 t19337 = t790 * t2102; in func_pol()
[all …]
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| H A D | gga_x_vmt84.c | 902 double t2102, t2107, t2109, t2110, t2111, t2116, t2118, t2120; in func_pol() local
1893 t2102 = t7 * t849 * t423; in func_pol()
1914 …t2174 = 0.4e1 / 0.3e1 * t2096 + 0.2e1 / 0.3e1 * t2099 + 0.2e1 / 0.3e1 * t2102 - t7 * t305 * t406 *… in func_pol()
1956 …/ 0.9e1 * t2085 - t2092 / 0.6e1 + 0.2e1 / 0.3e1 * t2096 + t2099 / 0.3e1 + t2102 / 0.3e1 + t2118 / … in func_pol()
1991 ….12e2 - 0.10e2 / 0.27e2 * t2085 + 0.2e1 / 0.9e1 * t2096 + t2099 / 0.9e1 + t2102 / 0.9e1 + t2122 / … in func_pol()
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| H A D | gga_x_mpbe.c | 787 double t2077, t2084, t2089, t2093, t2096, t2102, t2104, t2117; in func_pol() local
1780 t2102 = 0.1e1 / t128 / t1744; in func_pol()
1791 …324 * t2102 * t69 * t2104 / 0.3e1 - t7 * t118 * t179 * t1076 - t7 * t183 * t566 * t427 / 0.2e1 - t… in func_pol()
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| H A D | gga_x_am05.c | 1701 double t2102, t2103, t2106, t2109, t2112, t2115, t2118, t2119; in func_pol() local
2837 t2102 = t537 * t539; in func_pol()
2838 t2103 = t854 * t2102; in func_pol()
3233 t3254 = t1433 * t2102; in func_pol()
3235 t3258 = t1428 * t2102; in func_pol()
3621 … 0.19e2 / 0.162e3 * t179 * t2118 * t190 + t2516 * t849 * t2102 / 0.144e3 - t2512 * t843 * t2102 / … in func_pol()
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| H A D | gga_x_s12.c | 772 double t2020, t2036, t2052, t2064, t2076, t2087, t2102, t2105; in func_pol() local
1764 …t2102 = -t764 / 0.3e1 + 0.2e1 / 0.3e1 * t768 + 0.2e1 / 0.9e1 * t772 - 0.4e1 / 0.9e1 * t775 - 0.2e1… in func_pol()
1766 v4rho4[2] = t2064 + t2076 + t2087 + t2102; in func_pol()
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| H A D | gga_x_ncap.c | 115 double t2065, t2069, t2072, t2073, t2081, t2095, t2102, t2103; in func_unpol() local
877 t2102 = t1580 * t9; in func_unpol()
878 t2103 = t276 * t2102; in func_unpol()
894 …* t402 - 0.256e3 / 0.9e1 * t749 * t1720 * t173 - 0.128e3 / 0.9e1 * t193 * t2102 * t599 * t25 * t22… in func_unpol()
977 …3 * t1141 + 0.2e1 / 0.3e1 * t417 * t2907 * t129 + 0.16e2 / 0.3e1 * t193 * t2102 * t840 * t25 * t18… in func_unpol()
2235 double t2095, t2098, t2101, t2102, t2105, t2106, t2107, t2108; in func_pol() local
3450 t2102 = t1380 * t2094; in func_pol()
3481 …t2213 = 0.8e1 / 0.3e1 * t440 * t2102 - 0.4e1 / 0.9e1 * t415 * t2108 + 0.4e1 / 0.27e2 * t405 * t211… in func_pol()
4548 …t7308 = -t735 * t5729 / 0.6e1 - 0.2e1 / 0.9e1 * t1979 * t2114 + 0.8e1 / 0.3e1 * t753 * t2102 - 0.2… in func_pol()
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| H A D | gga_c_pw91.c | 111 double t1976, t2012, t2033, t2073, t2102, t2107, t2132, t2157; in func_unpol() local
806 …t2102 = -0.26645794802423731009e1 * t272 * t892 + 0.60852130428521304981e0 * t1100 * t435 - 0.8693… in func_unpol()
1889 double t2094, t2095, t2097, t2098, t2099, t2101, t2102, t2104; in func_pol() local
3854 t2102 = t102 * t2101; in func_pol()
3856 …6 * t2087 + 0.3e1 / 0.16e2 * t803 * t2091 - t2097 - 0.7e1 / 0.16e2 * t2099 - t2102 * t2104 / 0.4e1; in func_pol()
4449 …t3222 = 0.10142021738086884163e0 * t3125 - t2102 * t3128 / 0.4e1 - t3132 + t803 * t3134 / 0.8e1 + … in func_pol()
4779 …6e-1 * t3211 * t3944 - t2474 - 0.10866451862235947318e-1 * t126 * t3948 - t2102 * t3952 / 0.4e1 + … in func_pol()
4941 …0.7e1 / 0.16e2 * t3848 + 0.7e1 / 0.48e2 * t3850 - t311 * t4358 / 0.48e2 - t2102 * t4362 / 0.4e1 - … in func_pol()
6307 …420820e-1 * t7350 + t7355 + t803 * t312 * t7356 / 0.4e1 - 0.3e1 / 0.2e1 * t2102 * t312 * t7360 - 0… in func_pol()
6744 …e2 * t803 * t312 * t8712 + t803 * t312 * t8716 / 0.16e2 - 0.3e1 / 0.4e1 * t2102 * t312 * t8720 + t… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | hyb_mgga_x_js18.c | 119 double t2088, t2090, t2092, t2094, t2095, t2102, t2105, t2110; in func_unpol() local
1255 t2102 = t1636 * t505; in func_unpol()
2398 … 0.10e2 + t6605 - 0.24e2 * t5225 * t2090 + 0.108e3 * t4423 * t2102 + 0.108e3 * t4440 * t2102 + 0.1… in func_unpol()
2461 t6836 = t690 * t2102; in func_unpol()
2490 t6959 = t117 * t2102; in func_unpol()
4322 double t2102, t2105, t2109, t2112, t2115, t2128, t2129, t2135; in func_ferr() local
5448 t2102 = t257 * t2079; in func_ferr()
8561 double t2086, t2098, t2100, t2102, t2107, t2110, t2113, t2122; in func_pol() local
11072 t2102 = t137 * t1999; in func_pol()
19164 …t2102 * t35259 + t2107 * t35259 / 0.4e1 + 0.18e2 * t28206 * t11256 - 0.9e1 * t8910 * t11265 - 0.30… in func_pol()
[all …]
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| H A D | mgga_x_pbe_gx.c | 986 t2102 = t34 * t705; in func_unpol()
987 t2103 = t2102 * t137; in func_unpol()
1006 t2262 = t2102 * t185; in func_unpol()
1043 t2507 = t2102 * t479; in func_unpol()
1071 t2676 = t2102 * t536; in func_unpol()
1086 t2812 = t2102 * t582; in func_unpol()
1179 t3358 = t1767 * t29 * t2102; in func_unpol()
1192 t3438 = t763 * t29 * t2102; in func_unpol()
1207 t3516 = t955 * t29 * t2102; in func_unpol()
4040 t2102 = t261 * t261; in func_pol()
[all …]
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| H A D | mgga_c_m05.c | 5184 t2103 = t322 * t2102; in func_pol()
5209 t2155 = -t2102; in func_pol()
5238 t2228 = t2102 * t23; in func_pol()
7198 t5667 = t1203 * t2102; in func_pol()
7249 t5788 = t977 * t2102; in func_pol()
7253 t5793 = t984 * t2102; in func_pol()
7319 t5992 = t2102 * t327; in func_pol()
7696 t6662 = t1626 * t2102; in func_pol()
7698 t6666 = t1631 * t2102; in func_pol()
7777 t6774 = t2102 * t634; in func_pol()
[all …]
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| H A D | mgga_x_mn12.c | 2014 double t2085, t2088, t2093, t2102, t2103, t2106, t2109, t2112; in func_ferr() local
2708 t2102 = t50 * t2076; in func_ferr()
2709 t2103 = t2102 * t110; in func_ferr()
3205 t4928 = t2102 * t238; in func_ferr()
3666 double t2101, t2102, t2105, t2108, t2113, t2114, t2117, t2121; in func_pol() local
5004 t2102 = t2101 * t2067; in func_pol()
6658 …95 - 0.4e-2 * t1103 * t2098 - 0.32e-4 * t3114 * t2102 + 0.16e-4 * t3114 * t2105 + 0.64e-4 * t3117 … in func_pol()
8767 …t2102 - 0.68266666666666666668e-6 * t8489 * t6331 + 0.64e-4 * t8492 * t2102 + 0.341333333333333333… in func_pol()
9015 ….24e-1 * t9678 * t2114 + 0.85333333333333333336e-4 * t9681 * t2102 + 0.32e-4 * t9684 * t2102 - 0.2… in func_pol()
9168 … -0.64e-4 * t4207 * t2102 + 0.32e-4 * t4207 * t2105 + 0.256e-6 * t10624 * t6331 - 0.128e-6 * t1062… in func_pol()
[all …]
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| H A D | mgga_c_pkzb.c | 1223 t2102 = t16 * t2101; in func_unpol()
7603 t5909 = t2102 * t350; in func_pol()
7606 t5918 = t2102 * t361; in func_pol()
8911 t9325 = t793 * t2102; in func_pol()
8932 t9385 = t801 * t2102; in func_pol()
9776 t11269 = t3326 * t2102; in func_pol()
10094 t11957 = t3513 * t2102; in func_pol()
14925 t27716 = t2102 * t2102; in func_pol()
16287 t36607 = t10767 * t2102; in func_pol()
17975 t46352 = t3881 * t2102; in func_pol()
[all …]
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| H A D | mgga_x_gdme.c | 785 double t2084, t2088, t2089, t2092, t2093, t2097, t2098, t2102; in func_pol() local
2274 t2102 = t394 * t237; in func_pol()
2278 … + 0.4e1 / 0.81e2 * t2097 * t840 * t2098 - 0.2e1 / 0.81e2 * t859 * t840 * t2102 + 0.2e1 / 0.27e2 *… in func_pol()
2339 … - 0.8e1 / 0.81e2 * t2351 * t155 * t2098 + 0.4e1 / 0.81e2 * t825 * t155 * t2102 - 0.4e1 / 0.27e2 *… in func_pol()
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| H A D | mgga_x_ms.c | 2810 double t2099, t2100, t2102, t2107, t2110, t2112, t2114, t2118; in func_pol() local
4274 t2102 = t232 * t820; in func_pol()
4277 … 0.100e3 / 0.81e2 * t2097 - 0.100e3 / 0.81e2 * t2100 - 0.100e3 / 0.27e2 * t2102 * t241 - 0.50e2 / … in func_pol()
4565 t2698 = t2102 * t304; in func_pol()
4749 … - 0.6e1 * t2951 * t2953 - 0.1250e4 / 0.729e3 * t2956 - 0.50e2 / 0.27e2 * t2102 * t340 - 0.50e2 / … in func_pol()
5760 … * t233 * t782 * t2089 - 0.50e2 / 0.9e1 * t6102 * t241 - 0.50e2 / 0.9e1 * t2102 * t625 + 0.10000e5… in func_pol()
5766 …83e5 * t5010 * t6149 - 0.18e2 * t2951 * t312 * t650 * t255 - 0.50e2 / 0.9e1 * t2102 * t616 + t5858; in func_pol()
5991 …080 * t5011 * t969 - 0.100e3 / 0.27e2 * t7542 * t241 - 0.200e3 / 0.81e2 * t2102 * t787 - 0.200e3 /… in func_pol()
6156 …9e3 * t4859 * t1038 - 0.50e2 / 0.27e2 * t6102 * t340 - 0.100e3 / 0.27e2 * t2102 * t892 - 0.50e2 / … in func_pol()
6551 …/ 0.729e3 * t8456 * t2672 - 0.325e3 / 0.162e3 * t3316 + 0.25e2 / 0.54e2 * t2102 * t1048 + 0.24e2 *… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_4.c | 846 double t2094, t2096, t2098, t2100, t2102, t2106, t2109, t2113; in func_pol() local
1911 t2102 = 0.14804514559303905049e-3 * t1329 * t856; in func_pol()
1917 …731 - 0.16862113513206061329e-1 * t1277 * t1813 * t1278 - t2096 + t2100 + t2102 - t2106 + t2109 - … in func_pol()
1976 …t2460 = -t2450 / 0.2e1 - t2452 / 0.2e1 - t2455 / 0.4e1 - t2458 / 0.6e1 + t2096 - t2100 - t2102 + t… in func_pol()
2087 …/ 0.8e1 - t2452 / 0.4e1 - t2455 / 0.8e1 - t2458 / 0.8e1 + t2096 - t2100 - t2102 + t2106 - t2109 + … in func_pol()
2173 …t3167 = -t2102 + t2106 - t2109 + t2113 + t2116 + t2122 - t2126 + t2132 - t2138 - t2141 + t2143 - t… in func_pol()
2209 …t3396 = -t2100 - t2102 + t2106 - t2109 + t2113 + t2116 + t2122 - t2126 + t2132 - t2138 - t2141 + t… in func_pol()
2236 …t3563 = t2009 + t2011 + t2017 - t2023 + t2029 - t2037 + t2096 - t2100 - t2102 + t2106 - t2109 + t2… in func_pol()
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| H A D | lda_c_vwn_3.c | 859 double t2088, t2089, t2090, t2091, t2095, t2102, t2108, t2111; in func_pol() local
2131 …t2102 = -t1420 - 0.35611666666666666667e0 * t1422 + 0.23741111111111111111e0 * t1425 - 0.276979629… in func_pol()
2132 …150 * t2090 * t2091 + 0.3e1 / 0.2e1 * t150 * t452 * t2095 - t150 * t333 * t2102 / 0.4e1) * t167 * … in func_pol()
2165 …582 - 0.14e2 / 0.27e2 * t357 * t1419 - 0.6e1 * t2209 * t2091 + 0.6e1 * t532 * t2095 - t360 * t2102; in func_pol()
2462 t2859 = t335 * t2102; in func_pol()
2463 … 0.3e1 * t519 * t158 * t441 * t473 + 0.2e1 / 0.3e1 * t519 * t158 * t145 * t2102 - 0.5e1 / 0.9e1 * … in func_pol()
2492 …2108 * t484 / 0.3e1 - 0.2e1 / 0.9e1 * t341 * t1390 * t335 + t341 * t171 * t2102 / 0.3e1 + 0.185268… in func_pol()
2493 …150 * t145 * t2089 * t2091 - 0.2e1 * t150 * t2081 * t2095 + t150 * t446 * t2102 / 0.3e1 + 0.6e1 * … in func_pol()
2495 …4826131082694801066e-1 * t537 * t473 + 0.21608710360898267022e-1 * t364 * t2102 + 0.48069654533189… in func_pol()
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| H A D | lda_c_vwn_2.c | 843 double t2096, t2097, t2098, t2100, t2101, t2102, t2103, t2104; in func_pol() local
1935 t2102 = t235 * t996; in func_pol()
1936 t2103 = t2102 / 0.12e2; in func_pol()
2383 t4350 = t2102 / 0.4e1; in func_pol()
2398 …t4427 = -t2102 / 0.3e1 - t2104 / 0.12e2 - t2321 - 0.8e1 * t2107 - 0.2e1 * t2109 - 0.4e1 * t2110 - … in func_pol()
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