| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_pw91.c | 2289 double t10352, t10353, t10381, t10385, t10394, t10406, t10416, t10420; in func_pol() local
7147 t10394 = t97 * t1250; in func_pol()
7148 …5636233534648050268e1 * t97 * t1254 * t3543 + 0.22254493413859220108e2 * t10394 * t1263 - 0.333817… in func_pol()
8321 … t503 - 0.55636233534648050268e1 * t97 * t3321 * t1633 + 0.11127246706929610054e2 * t10394 * t1608; in func_pol()
8473 …5636233534648050268e1 * t97 * t3321 * t1714 + 0.11127246706929610054e2 * t10394 * t1705 - 0.556362… in func_pol()
8611 …1740120788830160e2 * t1261 * t4765 * t16449 + 0.11127246706929610054e2 * t10394 * t1753 - 0.278181… in func_pol()
8732 …36233534648050268e1 * t1261 * t1704 * t4163 + 0.11127246706929610054e2 * t10394 * t1810 + 0.111272… in func_pol()
9158 …7818116767324025134e1 * t97 * t1600 * t5354 + 0.55636233534648050268e1 * t10394 * t1886 + 0.564263… in func_pol()
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| H A D | gga_c_op_g96.c | 932 double t10394, t10395, t10398, t10407, t10418, t10419, t10425, t10426; in func_pol() local
3988 t10394 = t8 * t730 * t2827; in func_pol()
3989 t10395 = t10394 * t2840; in func_pol()
4244 t11972 = t10394 * t3197; in func_pol()
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| H A D | gga_c_revtca.c | 1591 double t10386, t10387, t10388, t10389, t10390, t10391, t10393, t10394; in func_pol() local
6133 t10394 = 0.6191309500282456820e-5 * t10094; in func_pol()
6135 …t10389 + t10390 - t10391 + 0.63401987714815823568e-1 * t10073 + t10393 - t10394 + 0.18566022315198… in func_pol()
6653 …252118426136e-5 * t11185 + 0.18566022315198348135e-3 * t11188 + t10393 - t10394 + t10396 - t10399 … in func_pol()
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| H A D | gga_c_hcth_a.c | 1786 double t10391, t10394, t10396, t10397, t10398, t10399, t10400, t10402; in func_pol() local
5987 t10394 = t1597 * t1035 * t3002; in func_pol()
5998 …4e1 * t10384 + 0.2e1 / 0.3e1 * t10388 - 0.4e1 * t10391 + 0.4e1 / 0.3e1 * t10394 + t10397 + t9650 -… in func_pol()
6006 …4 - t10376 / 0.6e1 + 0.3e1 * t10380 - t10384 + t10388 / 0.6e1 - t10391 + t10394 / 0.3e1 + 0.7e1 / … in func_pol()
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| H A D | gga_c_bmk.c | 1695 double t10353, t10365, t10366, t10379, t10384, t10386, t10394, t10408; in func_pol() local
5789 …t10394 = 0.63116250000000000000e0 * t399 * t10366 + 0.35297250000000000000e1 * t392 * t10366 - 0.1… in func_pol()
5806 t10471 = t10270 + t10298 + t10325 + t10394 + t10408 + t10432 + t10446 + t10468; in func_pol()
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| H A D | gga_c_sg4.c | 3115 double t10388, t10391, t10394, t10397, t10404, t10411, t10412, t10415; in func_pol() local
9763 t10394 = t2919 * t3161 * t319; in func_pol()
9774 … t10388 + 0.18000000000000000000e1 * t10391 + 0.90000000000000000000e0 * t10394 + t10437 + t10139 … in func_pol()
9775 … t10388 - 0.60000000000000000000e0 * t10391 - 0.30000000000000000000e0 * t10394 - 0.10000000000000… in func_pol()
10208 … t10388 + 0.12000000000000000000e1 * t10391 + 0.60000000000000000000e0 * t10394 + 0.40000000000000… in func_pol()
10229 … t10388 - 0.20000000000000000000e0 * t10391 - 0.10000000000000000000e0 * t10394 - 0.66666666666666… in func_pol()
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| H A D | gga_c_optc.c | 2748 double t10381, t10389, t10390, t10394, t10395, t10398, t10399, t10402; in func_pol() local
8873 t10394 = t2406 * t863; in func_pol()
8874 t10395 = t1483 * t10394; in func_pol()
8952 t10589 = t9611 * t10394; in func_pol()
14063 t27319 = t373 * t27317 * t10394; in func_pol()
14195 ….14488602482981263091e-1 * t27989 - 0.10866451862235947318e-1 * t10012 * t10394 * t27379 - 0.86931… in func_pol()
14251 t28283 = t926 * t3073 * t10394; in func_pol()
14281 …4897887578546e-1 * t10067 * t7521 + 0.21732903724471894637e-1 * t10028 * t10394 * t27608 + 0.36221… in func_pol()
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| H A D | gga_c_pbeloc.c | 2319 double t10391, t10392, t10394, t10398, t10400, t10403, t10415, t10433; in func_pol() local
7039 …t10394 = -t331 * t335 * t308 * t9577 / 0.768e3 + 0.595e3 / 0.3456e4 * t10356 - 0.119e3 / 0.3456e4 … in func_pol()
7112 …t11028 = t10351 + t10394 + t10438 + t10476 + t10528 + t10582 + t10619 + t10667 + t10704 + t10752 +… in func_pol()
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| H A D | gga_c_sogga11.c | 3277 double t10382, t10384, t10386, t10388, t10389, t10391, t10392, t10394; in func_pol() local
7972 …t10394 = 0.83407901499999999996e-1 * t10358 - 0.10425987687500000000e-1 * t10360 - 0.3475329229166… in func_pol()
8276 …178 + 0.3e1 * t238 * t3526 + t240 * (t10965 + t10720 + t10684 + t10434 + t10394 + t10896 + t10543 … in func_pol()
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
| H A D | mpfr_yukawa.f90 | 916 t10385,t10388,t10391,t10394,t10397,t10400,t10403,t10406,t10409,t10412,& local
5775 t10394 = t39 * t40 * t10326
5783 … / .CONVERT."0.65536D5" * t10394 + .CONVERT."0.2295D4" * t10397 + .CONVERT."0.1490818103775D13" &
6986 … / .CONVERT."0.2048D4" * t10394 - .CONVERT."0.5202D4" * t10397 - .CONVERT."0.1822111015725D13" &
7860 …t10391 - .CONVERT."0.959493919812553125D18" / .CONVERT."0.1024D4" * t10394 + .CONVERT."0.2907D4" *…
9791 …* t10391 + .CONVERT."0.1343291487737574375D19" / .CONVERT."0.256D3" * t10394 + .CONVERT."0.6332659…
10416 ….CONVERT."0.2494684191512638125D19" / .CONVERT."0.128D3" * t10394 - .CONVERT."0.569939388368656556…
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| /dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
| H A D | mpfr_yukawa.f90 | 916 t10385,t10388,t10391,t10394,t10397,t10400,t10403,t10406,t10409,t10412,& local
5775 t10394 = t39 * t40 * t10326
5783 … / .CONVERT."0.65536D5" * t10394 + .CONVERT."0.2295D4" * t10397 + .CONVERT."0.1490818103775D13" &
6986 … / .CONVERT."0.2048D4" * t10394 - .CONVERT."0.5202D4" * t10397 - .CONVERT."0.1822111015725D13" &
7860 …t10391 - .CONVERT."0.959493919812553125D18" / .CONVERT."0.1024D4" * t10394 + .CONVERT."0.2907D4" *…
9791 …* t10391 + .CONVERT."0.1343291487737574375D19" / .CONVERT."0.256D3" * t10394 + .CONVERT."0.6332659…
10416 ….CONVERT."0.2494684191512638125D19" / .CONVERT."0.128D3" * t10394 - .CONVERT."0.569939388368656556…
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_c_bc95.c | 2627 double t10386, t10388, t10389, t10390, t10391, t10394, t10396, t10397; in func_pol() local
8717 t10394 = t1469 * t2822; in func_pol()
8728 …t10420 = 0.28947563097646563121e3 * t10391 * t3283 - 0.58482236226346462070e0 * t10394 - 0.9982280… in func_pol()
9023 … t10386 - 0.23392894490538584828e1 * t10388 - 0.11696447245269292414e1 * t10394 - t8664 - 0.160e3 … in func_pol()
9672 …- 0.58482236226346462070e0 * t8649 - t10389 - 0.17544670867903938621e1 * t10394 - t8664 - t10407 -… in func_pol()
9957 …t18235 = -t8647 - 0.23392894490538584828e1 * t10394 - t8664 + t8677 + t8680 - 0.96e2 * t10412 - 0.… in func_pol()
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| H A D | mgga_c_tpssloc.c | 4497 double t10394, t10397, t10398, t10399, t10400, t10403, t10419, t10422; in func_pol() local
13675 t10394 = t3259 * t192; in func_pol()
13876 …t10888 = -0.2e1 * t10394 * t809 - t798 * t10868 + 0.2e1 * t10873 * t226 - 0.2e1 * t10876 * t809 + … in func_pol()
14791 …t13458 = -0.2e1 * t10394 * t1153 - 0.2e1 * t10876 * t1153 - t798 * t13433 - t13437 * t809 + t13439… in func_pol()
16966 … t19173 * t19175 - t16800 * t1153 + 0.19190897446562641759e-1 * t16773 - t10394 * t1364 - t10885 *… in func_pol()
17271 …t19933 = -0.32898681336964528730e-1 * t19197 + t19917 - t17504 * t1153 - t10394 * t1421 + 0.328986… in func_pol()
28429 … - 0.2e1 * t2373 * t19167 - 0.63969658155208805863e-1 * t69798 - 0.2e1 * t10394 * t4859 - 0.493480… in func_pol()
30480 …3463 * t5034 + 0.4e1 * t2218 * t22007 + 0.2e1 * t5014 * t13449 + 0.4e1 * t10394 * t5625 + 0.4e1 * … in func_pol()
33454 ….6e1 * t19173 * t3369 * t6208 * t8483 - t100972 * t809 + 0.2e1 * t10394 * t6199 - t10394 * t6209 +… in func_pol()
34100 …64365e-1 * t103489 - t24591 * t3398 - 0.6e1 * t19173 * t19907 * t19245 - t10394 * t6321 - t10885 *… in func_pol()
[all …]
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| H A D | mgga_c_scanl.c | 11521 double t10382, t10383, t10386, t10387, t10394, t10398, t10399, t10400; in func_pol() local
18658 t10394 = t3118 * t559; in func_pol()
18686 …t10462 = -t10394 * t573 - t3120 * t1521 / 0.2e1 - 0.50e2 / 0.243e3 * t10398 * t10400 - 0.20e2 / 0.… in func_pol()
20640 …t15682 = -0.5e1 / 0.4374e4 * t3906 - t162 * t15619 * t573 / 0.5832e4 - 0.2e1 * t10394 * t1028 + 0.… in func_pol()
26739 … 0.2000e4 / 0.2187e4 * t38100 * t38101 * t5224 * t5227 - 0.3e1 / 0.2e1 * t10394 * t1521 - t3120 * … in func_pol()
29649 … 0.185e3 / 0.34992e5 * t3920 * t13801 * t52450 - t38110 * t882 / 0.2e1 - t10394 * t2543 - 0.13e2 /… in func_pol()
31050 t61323 = t10394 * t1503; in func_pol()
31068 …/ 0.9e1 * t61461 * t10430 - 0.2e1 * t38110 * t1028 - 0.4e1 * t10394 * t3129 - 0.4e1 * t10394 * t31… in func_pol()
32932 …3e1 / 0.2e1 * t10451 * t17654 + 0.3e1 / 0.2e1 * t3124 * t10454 * t3552 - t10394 * t3552 / 0.2e1 - … in func_pol()
33986 t78151 = t10394 * t185; in func_pol()
[all …]
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| H A D | mgga_x_revtm.c | 4928 double t10373, t10376, t10378, t10381, t10388, t10391, t10394, t10397; in func_pol() local
8683 t10394 = t2909 * t540 * t130; in func_pol()
8688 …t10426 = 0.1080e4 * t1364 * t10394 - 0.36e2 * t1372 * t10397 - 0.36e2 * t1372 * t10400 + 0.3e1 / 0… in func_pol()
8726 …- 0.162e3 * t9275 * t1366 - 0.324e3 * t2984 * t3860 - 0.1080e4 * t1029 * t10394 - 0.972e3 * t2984 … in func_pol()
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| H A D | mgga_x_vt84.c | 3573 double t10356, t10364, t10368, t10386, t10388, t10394, t10410, t10416; in func_ferr() local
6010 t10394 = t5533 * t62 * t987; in func_ferr()
6014 … * t4660 * t1946 * t10388 * sigma[0] - 0.70480493755364682462e0 * t495 * t10394 - 0.35240246877682… in func_ferr()
6321 …096098751072936492e1 * t689 * t10416 - 0.28192197502145872984e1 * t689 * t10394 + 0.14096098751072… in func_ferr()
6347 …55364682459e0 * t545 * t978 * t2841 + 0.26261031973248880684e-3 * t846 * t10394 + 0.13130515986624… in func_ferr()
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| H A D | mgga_x_rscan.c | 7481 double t10393, t10394, t10397, t10398, t10401, t10404, t10410, t10411; in func_ferr() local
11356 t10394 = t10393 * t4051; in func_ferr()
11360 …+ 0.85889638002016800000e3 * t8751 * t10105 - 0.51738281939310120000e4 * t10394 * t10133 + 0.15002… in func_ferr()
11806 …+ 0.69283009581067519999e4 * t10188 * t4327 - 0.51738281939310120000e4 * t10394 * t11804 + 0.24005… in func_ferr()
12050 …412768e4 * t6024 * t13786 + t14209 - t14211 - 0.67416549193646520000e4 * t10394 * t13802 + 0.25682… in func_ferr()
12539 … t15537 + t13792 - t13796 + t13798 - t13800 - 0.67416549193646520000e4 * t10394 * t15628 + 0.25682… in func_ferr()
12811 …t17379 = -0.67416549193646520000e4 * t10394 * t17322 + 0.25682494930912960000e4 * t10653 * t17326 … in func_ferr()
13350 … t19473 + 0.10224956905002000000e3 * t19761 - 0.49386541851159660000e4 * t10394 * t19473 + 0.40009… in func_ferr()
13570 …08 + 0.7564965536346624e4 * t19758 * t21108 - 0.49386541851159660000e4 * t10394 * t21108 + 0.42847… in func_ferr()
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| H A D | mgga_c_vsxc.c | 3674 double t10384, t10386, t10387, t10389, t10391, t10394, t10396, t10398; in func_pol() local
9986 t10394 = t7190 * t3088; in func_pol()
9988 … t10382 - 0.48e2 * t10384 - 0.12e2 * t10387 + 0.12e2 * t10389 + 0.48e2 * t10394 - 0.120e3 * t10396; in func_pol()
13893 ….48e2 * t26188 * t3088 + 0.144e3 * t10387 - 0.208e3 * t10389 - 0.160e3 * t10394 + 0.1440e4 * t1039… in func_pol()
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| H A D | mgga_x_mbeefvdw.c | 8962 double t10384, t10394, t10397, t10399, t10402, t10405, t10408, t10414; in func_ferr() local
12674 t10394 = t55 * t2313 * t59; in func_ferr()
12683 …t10428 = -0.308e3 / 0.81e2 * t10394 + 0.253e3 / 0.162e3 * t10414 - 0.1025e4 / 0.972e3 * t10397 + 0… in func_ferr()
12685 …8 * t10194 - 0.1825014792e-1 * t617 * t1217 - 0.55426356056296296297e0 * t10394 - 0.15371216168209… in func_ferr()
12820 … t10044 + 0.15e2 * t10046 + 0.15e2 / 0.2e1 * t10814 + 0.154e3 / 0.27e2 * t10394 - 0.253e3 / 0.108e… in func_ferr()
17274 double t10391, t10392, t10394, t10396, t10397, t10399, t10401, t10402; in func_pol() local
22360 t10394 = t1327 * t342; in func_pol()
22361 … + 0.296875e6 / 0.157464e6 * t10389 - 0.125e3 / 0.243e3 * t10392 - 0.125000e6 / 0.59049e5 * t10394; in func_pol()
28919 …7718750e7 / 0.59049e5 * t10389 - 0.13000e5 / 0.729e3 * t10392 - 0.13000000e8 / 0.177147e6 * t10394; in func_pol()
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| H A D | mgga_x_mbrxc_bg.c | 12199 double t10388, t10391, t10394, t10397, t10399, t10407, t10411, t10434; in func_ferr() local
16986 t10394 = t1207 * t10231; in func_ferr()
24274 double t10384, t10385, t10386, t10391, t10394, t10402, t10408, t10412; in func_pol() local
35587 t10394 = t5988 * t10385; in func_pol()
35591 …0386 + 0.2e1 / 0.3e1 * t5995 * t10386 - 0.4e1 * t5995 * t10391 + t5987 * t10394 / 0.2e1 + 0.4e1 / … in func_pol()
37358 …e1 * t1708 * t10364 - t12562 - t12564 - 0.8e1 * t8418 * t12565 + t8412 * t10394 / 0.2e1 + t12570 *… in func_pol()
49234 …e1 / 0.3e1 * t2039 * t20867 + 0.8e1 / 0.3e1 * t29252 * t10386 + t29265 * t10394 + t5987 * t49375 +… in func_pol()
51100 …6 * t10484 + 0.8e1 / 0.3e1 * t39957 * t10386 + t8412 * t50476 + t39940 * t10394 + 0.32e2 / 0.3e1 *… in func_pol()
55960 … 0.32e2 / 0.3e1 * t79685 * t20823 - 0.256e3 * t10451 * t79690 + t50346 * t10394 + 0.2e1 * t5995 * … in func_pol()
55978 …86 - 0.8e1 * t50359 * t10391 + 0.2e1 * t5987 * t79851 - 0.3e1 * t50440 * t10394 - 0.2e1 * t50439 *… in func_pol()
[all …]
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| H A D | hyb_mgga_x_js18.c | 4525 double t10329, t10332, t10342, t10343, t10355, t10362, t10379, t10394; in func_ferr() local
7132 t10394 = t4093 * t246; in func_ferr()
7144 …t10435 = 0.162e3 * t5641 * t2404 - 0.36e2 * t1568 * t10394 - 0.36e2 * t1568 * t10397 - 0.12e2 * t1… in func_ferr()
7170 … * t745 * t1618 + 0.2e1 * t2351 * t679 + 0.6e1 * t246 * t4036 + 0.54e2 * t10394 + 0.54e2 * t10397 … in func_ferr()
7171 …t10743 = 0.36e2 * t256 * t10394 + 0.36e2 * t256 * t10397 + 0.12e2 * t256 * t10400 - 0.162e3 * t762… in func_ferr()
7211 …5 + 0.972e3 * t3875 * t4162 + 0.972e3 * t3895 * t4162 - 0.36e2 * t1234 * t10394 - 0.36e2 * t1234 *… in func_ferr()
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| H A D | mgga_x_mbeef.c | 14618 double t10388, t10390, t10392, t10394, t10396, t10398, t10400, t10402; in func_ferr() local
18369 t10394 = t1409 * t10284; in func_ferr()
18383 …t10420 = 0.15e2 / 0.8e1 * t10392 - 0.4375e4 / 0.18e2 * t10394 + 0.875e3 / 0.9e1 * t10396 - 0.125e3… in func_ferr()
18600 …45e3 / 0.16e2 * t10388 - 0.35e2 / 0.16e2 * t10392 + 0.48125e5 / 0.36e2 * t10394 - 0.875e3 / 0.4e1 … in func_ferr()
18724 …11910 + 0.39047058041838134431e-2 * t11912 + 0.29193922949479166667e-1 * t10394 - 0.51623364687187… in func_ferr()
23791 …5e4 / 0.8e1 * t36159 - 0.4375e4 / 0.16e2 * t36161 - 0.43750e5 / 0.27e2 * t10394 + 0.17500e5 / 0.27… in func_ferr()
23911 …t38959 = 0.19462615299652777778e0 * t10394 - 0.34415576458125000000e0 * t10396 + 0.359971410647890… in func_ferr()
28549 double t10385, t10386, t10388, t10389, t10390, t10392, t10393, t10394; in func_pol() local
34046 t10394 = t10393 * t10377; in func_pol()
34246 …t10386 - 0.16001762671125000000e-1 * t10390 - 0.10939217240439300411e2 * t10394 + 0.27348043101098… in func_pol()
[all …]
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| H A D | mgga_x_br89_explicit.c | 14287 double t10394, t10397, t10402, t10403, t10418, t10419, t10425, t10426; in func_pol() local
21673 t10394 = t1956 * t507; in func_pol()
21683 …t10435 = -0.62811071439918130814e-2 * t10394 * t1959 + 0.11175695562819155614e0 * t10397 * t1634 +… in func_pol()
29367 …109011e-3 * t2820 * t39595 * params->gamma - 0.62811071439918130814e-2 * t10394 * t7165 + 0.211811… in func_pol()
29395 …+ 0.4e1 * t156 * t7223 * t1647 - t156 * t374 * t39864 + 0.12562214287983626163e-1 * t10394 * t5984; in func_pol()
32232 …695562819155614e0 * t1609 * t4804 * t39549 + 0.12562214287983626163e-1 * t10394 * t9262 - 0.628110… in func_pol()
32964 …42 * t63843 * t380 - 0.2e1 * t2838 * t2002 + 0.12562214287983626163e-1 * t10394 * t10323 + 0.35301… in func_pol()
33431 …18130814e-2 * t2325 * t4800 * t102 * t1647 + 0.62811071439918130814e-2 * t10394 * t11420 + 0.62811… in func_pol()
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| H A D | mgga_c_m06l.c | 6077 double t10376, t10377, t10378, t10394, t10400, t10404, t10416, t10421; in func_pol() local
12967 …t10394 = -0.1408e4 / 0.9e1 * t3156 * t9541 - 0.2464e4 / 0.27e2 * t813 * t9573 - 0.1232e4 / 0.27e2 … in func_pol()
12972 …t10434 = t10394 * t411 + t10400 * t399 - t799 * t10404 - 0.2e1 * t810 * t10404 - 0.3e1 * t829 * t1… in func_pol()
19384 t31200 = t10394 * t828; in func_pol()
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| H A D | mgga_c_revscan.c | 4403 double t10388, t10390, t10394, t10396, t10397, t10398, t10399, t10400; in func_pol() local
11573 t10394 = t2912 * t10313; in func_pol()
11591 …10388 * t210 + t10390 * t210 + t2905 * t529, -0.53912037037037037039e0 * t10394 + 0.29951131687242… in func_pol()
11620 …10482 * t210 + t10484 * t210 + t2938 * t529, -0.10782407407407407408e1 * t10394 + 0.59902263374485… in func_pol()
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