/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_lyp.c | 649 double t6644, t6645, t6648, t6650, t6655, t6668, t6672, t6675; in func_pol() local 2741 t6645 = t720 * t63; in func_pol() 2744 …0.9e1 * t2525 * t663 - t6640 - 0.11e2 / 0.324e3 * t2535 * t2736 - t6644 + t6645 * t226 / 0.6e1 + t… in func_pol() 2827 …4 / 0.12e2 + t7046 + t7047 / 0.12e2 + 0.11e2 / 0.1728e4 * t2746 * t2660 + t6645 * t215 / 0.6e1 + t… in func_pol() 2873 … 0.10e2 / 0.27e2 * t929 * t2031 - 0.11e2 / 0.243e3 * t942 * t552 * t779 + t6645 * t300 / 0.6e1 + t… in func_pol() 2919 …2839 + 0.11e2 / 0.1728e4 * t7263 * t1003 - 0.4e1 / 0.9e1 * t2739 * t635 + t6645 * t294 / 0.6e1 + 0… in func_pol()
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H A D | gga_c_pbe.c | 1665 double t6628, t6631, t6632, t6633, t6634, t6638, t6639, t6645; in func_pol() local 4686 t6645 = t2451 * t600; in func_pol() 4687 t6646 = 0.17315859105681463759e2 * t6645; in func_pol() 4885 t7845 = 0.51947577317044391276e2 * t6645; in func_pol() 5005 t8672 = 0.10389515463408878255e3 * t6645; in func_pol()
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H A D | gga_c_regtpss.c | 2595 double t6636, t6639, t6640, t6645, t6650, t6651, t6659, t6663; in func_pol() local 6433 t6645 = t698 * t698; in func_pol() 6458 …t6713 = 0.5e1 / 0.4e1 * t6639 * t284 * t5 * t6640 + 0.3e1 / 0.16e2 * t778 * t284 * t5 * t6645 - 0.… in func_pol() 6497 …* t6787 * t314 * t6640 + 0.12862205435420921092e-1 * t337 * t887 * t314 * t6645 - 0.32131292352189… in func_pol() 6652 …* t7372 * t6640 + 0.360e3 * t1104 * t6589 * t698 - 0.36e2 * t118 * t871 * t6645 - 0.48e2 * t1104 *… in func_pol() 6792 …t7901 = -0.36e2 * t3323 * t4587 * t677 + 0.18e2 * t634 * t6645 * t90 + t7324 + t7326 + t7329 + t73… in func_pol()
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H A D | gga_c_bmk.c | 1591 double t6624, t6628, t6639, t6640, t6645, t6646, t6655, t6663; in func_pol() local 4898 t6645 = t882 * t2019; in func_pol() 4899 t6646 = t6645 * t133; in func_pol() 6936 t19953 = t6645 * sigma[2]; in func_pol()
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H A D | gga_x_gg99.c | 3785 double t6645, t6647, t6649, t6650, t6652, t6655, t6659, t6662; in func_pol() local 7577 t6645 = 0.2e1 / 0.3e1 * t393 * t6643; in func_pol() 7590 …+ t6618 + t6620 + t6622 - t6626 - t6630 + t6634 - t6636 + t6638 - t6641 - t6645 - t6647 + t6649 - … in func_pol() 9576 …t20325 = t6634 - t6636 + t6638 - t6641 - t6645 - t6647 + t6649 - t6650 - t6652 - t6682 + t4 * (t20… in func_pol() 9687 …t21579 = t6634 - t6636 + t6638 - t6641 - t6645 - t6647 + t6649 - t6650 - t6652 - t6682 + t4 * (t20… in func_pol()
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H A D | gga_c_zvpbeloc.c | 2326 double t6636, t6637, t6638, t6639, t6641, t6643, t6645, t6647; in func_pol() local 6181 t6645 = 0.6e1 * t376 * t6643; in func_pol() 6199 …7073e-1 * t6507 - t6626 - t6629 - t6631 + t6633 - t6635 + t6639 + t6641 - t6645 + t6649 - t6653 - … in func_pol() 6232 …t6722 = -t6653 + t6618 + t6639 + t6615 - t6629 - t376 * t6719 - t6645 + t6649 + t6658 + t6633 + 0.… in func_pol()
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H A D | gga_c_pbeloc.c | 2207 double t6645, t6646, t6648, t6649, t6651, t6654, t6656, t6658; in func_pol() local 6135 t6645 = t172 * t576; in func_pol() 6136 t6646 = t171 * t6645; in func_pol() 6143 t6660 = t179 * t6645; in func_pol()
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H A D | gga_x_hjs.c | 224 double t6570, t6626, t6631, t6645, t6679, t6740, t6766, t6769; in func_unpol() local 1866 t6645 = t1040 * t1140; in func_unpol() 1867 … t646 * t1895 - t1183 * t492 * t1170 - 0.25311786666666666666e1 * t5263 * t6645 + 0.3e1 / 0.4e1 * … in func_unpol() 1926 …t3299 * t839 - 0.8e1 * t1479 * t1971 - 0.11345493333333333333e1 * t2008 * t6645 - 0.4e1 * t3221 * … in func_unpol() 1990 …+ 0.2e1 * t1512 * t1173 * t499 + t3322 * t2498 + 0.80e2 / 0.3e1 * t5255 * t6645 - 0.2e1 * t3407 * … in func_unpol() 1996 …18 * t7163 + 0.11345493333333333333e0 * t6387 - 0.105e3 / 0.2e1 * t2153 * t6645 + 0.47459600000000… in func_unpol() 1999 …- 0.35e2 / 0.4e1 * t8106 * t879 - 0.35e2 / 0.2e1 * t918 * t6387 - 0.21807676800000000000e2 * t6645; in func_unpol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_mn12.c | 2085 double t6645, t6670, t6673, t6691, t6728, t6739, t6763, t6848; in func_ferr() local 3324 t6645 = t38 * t249 * tau[0]; in func_ferr() 3326 …425 * t6645 + 0.2600e4 / 0.3e1 * t155 * t6545 - 0.3280e4 / 0.9e1 * t155 * t6574 + 0.650e3 / 0.3e1 … in func_ferr() 3328 …0e4 / 0.9e1 * t1138 * t6645 - 0.3280e4 / 0.3e1 * t404 * t6574 - 0.6560e4 / 0.9e1 * t143 * t6541 - … in func_ferr() 3338 …80e4 / 0.27e2 * t54 * t6645 - 0.13120e5 / 0.27e2 * t261 * t6645 - 0.3280e4 / 0.9e1 * t57 * t6574 -… in func_ferr() 3341 … t101 * t6580 - 0.3280e4 / 0.27e2 * t101 * t6645 + 0.1300e4 * t215 * t6580 - 0.13120e5 / 0.27e2 * … in func_ferr() 3343 …80e4 / 0.27e2 * t79 * t6645 - 0.13120e5 / 0.27e2 * t292 * t6645 - 0.3280e4 / 0.9e1 * t82 * t6574 -… in func_ferr() 3345 …t6645 - 0.8000e4 / 0.9e1 * t336 * t6590 - 0.13120e5 / 0.27e2 * t336 * t6645 - 0.5000e4 / 0.9e1 * t… in func_ferr() 3348 …353 * t6645 + 0.2600e4 / 0.3e1 * t193 * t6545 - 0.3280e4 / 0.9e1 * t193 * t6574 + 0.650e3 / 0.3e1 … in func_ferr() 3350 …* t314 * t6645 - 0.3280e4 / 0.9e1 * t121 * t6574 - 0.2000e4 * t923 * t6590 - 0.10000e5 / 0.3e1 * t… in func_ferr() [all …]
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H A D | hyb_mgga_x_js18.c | 4460 double t6637, t6639, t6642, t6645, t6648, t6661, t6662, t6665; in func_ferr() local 6592 t6645 = t713 * t2027; in func_ferr() 7892 t17719 = t6645 * t473; in func_ferr() 8210 t21228 = t6645 * t649; in func_ferr() 8733 double t6645, t6658, t6659, t6665, t6670, t6672, t6679, t6681; in func_pol() local 12547 t6645 = t46 * t1637; in func_pol() 16358 …t6645 + 0.25155289876543209876e-1 * t17880 * t6645 - 0.6e1 * t3810 * t6627 - 0.6e1 * t5116 * t5735… in func_pol() 22356 …t6645 + 0.25155289876543209876e-1 * t52141 * t6645 + 0.25155289876543209876e-1 * t63401 * t5754 + … in func_pol() 23590 …e-1 * t21241 * t6645 + 0.58695676378600823043e-1 * t5835 * t23620 + 0.648e3 * t5453 * t73322 + 0.5… in func_pol() 23671 …t6645 + 0.50310579753086419752e-1 * t21339 * t21106 + 0.50310579753086419752e-1 * t64718 * t6645 +… in func_pol() [all …]
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H A D | mgga_x_mbeefvdw.c | 21172 t6645 = t1541 * t6643 * t298; in func_pol() 21173 t6646 = t5364 * t6645; in func_pol() 22466 t10685 = t7112 * t6645; in func_pol() 22468 t10689 = t7117 * t6645; in func_pol() 22470 t10693 = t7128 * t6645; in func_pol() 22517 t10951 = t7135 * t6645; in func_pol() 22519 t10955 = t7107 * t6645; in func_pol() 23083 t12560 = t9250 * t6645; in func_pol() 23092 t12604 = t9371 * t6645; in func_pol() 23094 t12608 = t9240 * t6645; in func_pol() [all …]
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H A D | mgga_xc_b97mv.c | 3955 double t6641, t6643, t6645, t6646, t6647, t6649, t6651, t6652; in func_pol() local 8305 t6645 = t5274 * t2248; in func_pol() 8308 t6649 = t6645 * t6646 * t6647; in func_pol() 8575 t7219 = t6645 * t6646 * t7217; in func_pol() 12347 …/ 0.24e2 * t6645 * t6646 * t18273 - t2256 * t6498 * t373 * t2 * t314 / 0.2e1 - t2256 * t6498 * t64… in func_pol() 12349 t18304 = t6645 * t18302 * t6647; in func_pol() 13086 ….108e3 * t17551 * t17552 * t21730 - 0.7e1 / 0.36e2 * t6645 * t6646 * t21767 - 0.7e1 / 0.72e2 * t66… in func_pol() 13170 t23548 = t6645 * t18302 * t7217; in func_pol() 13212 …t24090 = t20457 / 0.24e2 + t20460 / 0.48e2 + t20474 / 0.36e2 - 0.7e1 / 0.24e2 * t6645 * t18376 * t… in func_pol() 13539 …t26502 = -t2256 * t2257 * t23584 * t680 / 0.8e1 - t2256 * t6498 * t7240 * t2 / 0.4e1 - t6645 * t22… in func_pol() [all …]
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H A D | mgga_c_bc95.c | 2481 double t6633, t6634, t6636, t6638, t6640, t6642, t6644, t6645; in func_pol() local 7127 t6645 = t1278 * t6644; in func_pol() 7130 t6648 = t6645 * t6647; in func_pol() 10368 …t6645 * t21745 + 0.11851851851851851852e2 * t1144 * t1279 * t658 * t666 - 0.13888888888888888888e0… in func_pol() 10374 … + 0.11912577406438914864e2 * t6651 * t22132 - 0.74074074074074074072e0 * t6645 * t22132 - 0.59259… in func_pol() 10460 …33333333333333333e0 * t1254 * t22785 * t6647 - 0.13888888888888888888e0 * t6645 * t22793 - 0.67008… in func_pol() 10500 …t23285 = 0.33504123955609448055e1 * t22820 * t6646 * t5485 - 0.20833333333333333332e0 * t6645 * t6… in func_pol() 10701 …9 - 0.55555555555555555556e0 * t1310 * t1839 + 0.13888888888888888889e0 * t6645 * t24556 - 0.22336… in func_pol()
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H A D | mgga_x_m11.c | 3131 double t6639, t6641, t6642, t6643, t6644, t6645, t6647, t6648; in func_pol() local 5854 t6645 = t207 * t6644; in func_pol() 5855 t6647 = t353 * t354 * t6645; in func_pol() 8171 t17074 = t353 * t1224 * t6645; in func_pol() 8176 …51 * t607 * t6639 * t608 - t1218 * t2200 * t5936 / 0.2e1 - t1218 * t354 * t6645 * t359 / 0.6e1 - 0… in func_pol() 8255 … / 0.8e1 * t17898 - 0.3e1 / 0.2e1 * t353 * t5073 * t2241 - t353 * t1374 * t6645 / 0.2e1 - t1205 * … in func_pol() 8366 …t6645 * t684 - 0.2e1 * t1218 * t2200 * t7584 - 0.3e1 / 0.2e1 * t8 * t215 * t776 * t7390 - 0.3e1 / … in func_pol()
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H A D | mgga_k_pc07.c | 256 double t6641, t6642, t6645, t6647, t6648, t6651, t6654, t6659; in func_unpol() local 2372 t6645 = t462 * t356; in func_unpol() 2535 …2 * t5137 * t7627 + 0.2090975112e2 * t6639 * t7630 - 0.11268264878568e2 * t6645 * t7633 - 0.563413… in func_unpol() 3165 …704e2 * t11653 * t7702 - 0.16902397317852e2 * t11648 * t2567 - 0.11268264878568e2 * t6645 * t11659; in func_unpol() 4179 double t6631, t6645, t6652, t6655, t6658, t6659, t6662, t6664; in func_ferr() local 6281 …t6645 = -0.1940040e3 * t453 * t5133 - 0.97002e1 * t343 * t1914 * t344 - 0.48501e1 * t343 * t667 * … in func_ferr() 6378 …t7201 = my_piecewise3(t61, 0, t6338 + t6393 + t6440 + t6486 + t6537 + t6594 + t6645 + t6793 + t684… in func_ferr() 8175 double t6645, t6647, t6648, t6650, t6661, t6666, t6671, t6692; in func_pol() local 11678 t6645 = t4782 * t1133; in func_pol() 11681 …334e1 * t6636 - 0.174247926e1 * t6639 + 0.5389e0 * t6643 + 0.87123963e0 * t6645 + 0.156503678869e0… in func_pol() [all …]
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H A D | mgga_x_ms.c | 2941 double t6539, t6556, t6564, t6573, t6582, t6637, t6645, t6654; in func_pol() local 5864 t6645 = t882 * t623; in func_pol() 5865 …603 - 0.12500000e8 / 0.19683e5 * t2135 + 0.2500000e7 / 0.6561e4 * t5810 * t6645 + 0.25000000e8 / 0… in func_pol() 5880 …243e3 * t1686 * t690 * t2408 * t255 + 0.10000e5 / 0.81e2 * t2159 * t690 * t6645 - 0.200e3 / 0.9e1 … in func_pol()
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H A D | mgga_x_mvs.c | 2103 double t6606, t6609, t6618, t6626, t6645, t6650, t6653, t6657; in func_pol() local 5125 …t6645 = 0.10000e5 / 0.243e3 * t1995 * t6618 + 0.10000e5 / 0.243e3 * t2015 * t6618 + 0.10000e5 / 0.… in func_pol() 5129 …t6671 = -0.135e3 / 0.64e2 * t2831 * t2382 * t452 - t39 * t165 * t6645 / 0.4e1 + 0.75e2 / 0.64e2 * … in func_pol()
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H A D | mgga_x_rscan.c | 14586 double t6635, t6638, t6641, t6642, t6645, t6648, t6651, t6652; in func_pol() local 19357 t6645 = t2245 * t300; in func_pol() 19361 …16 * t6638 + 0.199799559359325e3 * t2353 * t6642 + 0.1611300440549070e4 * t6645 * t2370 - 0.214840… in func_pol() 20424 …3150 * t8888 + 0.19700431084236e2 * t3154 * t8894 + 0.537100146849690e3 * t6645 * t3185 - 0.477422… in func_pol() 20934 …4 * t11003 - 0.1432267058265840e4 * t3040 * t3734 + 0.537100146849690e3 * t6645 * t3737 - 0.477422… in func_pol() 24263 …2 - 0.3437440939838016e4 * t3188 * t6665 * t2081 + 0.3222600881098140e4 * t6645 * t6721 - 0.429680… in func_pol() 24266 …01 - 0.29136258152158080e5 * t2405 * t347 * t354 + 0.3222600881098140e4 * t6645 * t6695 - 0.143226… in func_pol() 24327 …11 + 0.71613352913292e2 * t2368 * t2369 * t6501 - 0.12890403524392560e5 * t6645 * t6648 + 0.160039… in func_pol() 25323 …0431084236e2 * t3154 * t25844 + 0.1611300440549070e4 * t6645 * t9258 + 0.805650220274535e3 * t6645… in func_pol() 26046 …587398760e4 * t3040 * t11000 + 0.1611300440549070e4 * t6645 * t11049 + 0.805650220274535e3 * t6645… in func_pol() [all …]
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H A D | mgga_x_scan.c | 3333 double t6631, t6638, t6645, t6652, t6654, t6659, t6662, t6663; in func_pol() local 7003 t6645 = t795 * t801 * t2383; in func_pol() 7005 …t834 * t601 / 0.3e1 - t6638 / 0.6e1 - t600 * t833 * t834 * t624 / 0.2e1 - t6645 / 0.6e1 - t1977 * … in func_pol() 7090 … t2376 - 0.2e1 / 0.9e1 * t7131 + 0.2e1 / 0.27e2 * t6631 - t6638 / 0.9e1 - t6645 / 0.9e1 + 0.2e1 / … in func_pol()
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H A D | mgga_x_mbrxc_bg.c | 376 double t6626, t6629, t6632, t6633, t6638, t6639, t6644, t6645; in func_unpol() local 4182 t6645 = t3392 * t6644; in func_unpol() 23922 double t6642, t6643, t6645, t6646, t6648, t6650, t6652, t6654; in func_pol() local 32721 t6645 = t792 * t1528; in func_pol() 32722 t6646 = t6645 * t1607; in func_pol() 45712 t33560 = t6645 * t7711; in func_pol() 45859 t33958 = t6645 * t4909; in func_pol() 49888 t52017 = t6645 * t10875; in func_pol() 49963 t52212 = t6645 * t11281; in func_pol() 52741 t63654 = t6645 * t13283; in func_pol() [all …]
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H A D | mgga_x_mbeef.c | 3272 t6645 = t44 * t13; in func_unpol() 3273 t6646 = t1361 * t6645; in func_unpol() 3280 t6656 = t1406 * t6645; in func_unpol() 3285 t6664 = t1414 * t6645; in func_unpol() 3318 t6716 = t1348 * t6645; in func_unpol() 3504 t7260 = t1547 * t6645; in func_unpol() 3510 t7271 = t1453 * t6645; in func_unpol() 3543 t7411 = t1632 * t6645; in func_unpol() 6768 t21841 = t5145 * t6645; in func_unpol() 7002 t22376 = t5349 * t6645; in func_unpol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_x_erf.c | 619 double t6606, t6608, t6610, t6611, t6613, t6628, t6645, t6670; in func_pol() local 2650 t6645 = t115 * t553 * t3323; in func_pol() 2653 …t6676 = -t115 * t116 * t542 * t1042 / 0.8e1 - t115 * t116 * t196 * t2711 / 0.4e1 - t6645 / 0.6e1 +… in func_pol() 2976 …t9276 = -0.3e1 / 0.8e1 * t115 * t201 * t3253 * t323 - t8652 / 0.8e1 - t6645 / 0.4e1 + t4911 - 0.3e… in func_pol()
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H A D | lda_c_pk09.c | 2602 double t6645, t6646, t6650, t6652, t6654, t6657, t6658, t6661; in func_pol() local 5603 t6645 = t2064 * t410; in func_pol() 5604 t6646 = t2063 * t6645; in func_pol() 6595 t11445 = t2758 * t6645; in func_pol() 6615 …471729814e-1 * t11054 + t11351 + t11475 + t6380 + t6381 + t2757 * t2079 * t6645 * t294 * t435 * t2… in func_pol()
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
H A D | mpfr_yukawa.f90 | 857 t6623,t6626,t6633,t6637,t6639,t6645,t6653,t6657,t6661,t6664,t6671,t6674,& local 4061 t6645 = t21 * t175 * t999 4063 ….CONVERT."0.4D1" * t506 + .CONVERT."0.993242250D9" * t1644 - .CONVERT."0.81729648000D11" * t6645 & 4989 * t6645 - .CONVERT."0.900900D6" * t509 5558 t1644 - .CONVERT."0.11115232128000D14" * t6645 + .CONVERT."0.1392300D7" * t509 6497 * t6645 - .CONVERT."0.2088450D7" * t509 + .CONVERT."0.1670760D7" * t512 & 7577 …t14135 = .CONVERT."-0.316784115648000D15" * t6645 + .CONVERT."0.3052350D7" * t509 - .CONVERT."0.24… 8892 …* t6645 - .CONVERT."0.4360500D7" * t509 + .CONVERT."0.3488400D7" * t512 + .CONVERT."0.962451740250… 10730 * t6645 + .CONVERT."0.6104700D7" * t509 - .CONVERT."0.8869955238144000D16" * t21 * t1014 &
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/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
H A D | mpfr_yukawa.f90 | 857 t6623,t6626,t6633,t6637,t6639,t6645,t6653,t6657,t6661,t6664,t6671,t6674,& local 4061 t6645 = t21 * t175 * t999 4063 ….CONVERT."0.4D1" * t506 + .CONVERT."0.993242250D9" * t1644 - .CONVERT."0.81729648000D11" * t6645 & 4989 * t6645 - .CONVERT."0.900900D6" * t509 5558 t1644 - .CONVERT."0.11115232128000D14" * t6645 + .CONVERT."0.1392300D7" * t509 6497 * t6645 - .CONVERT."0.2088450D7" * t509 + .CONVERT."0.1670760D7" * t512 & 7577 …t14135 = .CONVERT."-0.316784115648000D15" * t6645 + .CONVERT."0.3052350D7" * t509 - .CONVERT."0.24… 8892 …* t6645 - .CONVERT."0.4360500D7" * t509 + .CONVERT."0.3488400D7" * t512 + .CONVERT."0.962451740250… 10730 * t6645 + .CONVERT."0.6104700D7" * t509 - .CONVERT."0.8869955238144000D16" * t21 * t1014 &
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