| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_xc_th1.c | 563 double t2770, t2773, t2774, t2777, t2792, t2793, t2799, t2810; in func_pol() local
1602 t2774 = t2478 * t2773; in func_pol()
1607 …* t2774 / 0.9e1 - t1095 * t2777 / 0.3e1 + t1078 * t2774 / 0.9e1 - t1078 * t2777 / 0.3e1 + t1085 * … in func_pol()
2271 …t2774 - 0.8e1 / 0.9e1 * t2491 * t2777 + t2496 * t2774 / 0.3e1 - t2496 * t2777 + 0.10e2 / 0.27e2 * … in func_pol()
2455 …t2774 / 0.18e2 + t3155 * t2777 / 0.6e1 - t1250 * t7259 / 0.4e1 + t231 * t3193 / 0.4e1 + 0.2e1 / 0.… in func_pol()
2456 …t2774 / 0.18e2 + t3165 * t2777 / 0.6e1 - 0.11e2 / 0.36e2 * t1256 * t7259 + 0.11e2 / 0.36e2 * t241 … in func_pol()
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| H A D | gga_c_pbe_vwn.c | 1990 double t2769, t2771, t2774, t2775, t2776, t2777, t2783, t2787; in func_pol() local
3885 t2774 = t2358 * t365; in func_pol()
3888 t2777 = t2774 * t2776; in func_pol()
4111 t3320 = t2774 * t452 * t1161; in func_pol()
5347 …2 = -0.5e1 / 0.256e3 * t917 * t2774 * t452 * t2406 + t917 * t2760 * t7120 * t921 / 0.128e3 - 0.5e1… in func_pol()
5357 …t2774 * t7167 * t921 - 0.3e1 / 0.512e3 * t2689 * t4756 * t7173 + 0.7e1 / 0.96e2 * t7177 - t1111 * … in func_pol()
5433 …2761 * t2375 / 0.256e3 - 0.5e1 / 0.128e3 * t917 * t2774 * t7488 * t921 - 0.5e1 / 0.256e3 * t917 * … in func_pol()
5568 ….7e1 / 0.12e2 * t8007 - 0.5e1 / 0.192e3 * t917 * t2774 * t2775 * t3170 - 0.5e1 / 0.384e3 * t917 * … in func_pol()
5575 …7103 - t1111 * t2760 * t3561 * t2769 / 0.192e3 - 0.5e1 / 0.384e3 * t917 * t2774 * t452 * t2803 + 0… in func_pol()
5584 …761 * t3170 / 0.192e3 - 0.5e1 / 0.192e3 * t917 * t2774 * t1143 * t1161 - 0.5e1 / 0.192e3 * t917 * … in func_pol()
[all …]
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| H A D | gga_x_rge2.c | 584 double t2758, t2774, t2835, t2865, t2866, t2867, t2869, t2870; in func_pol() local
1691 t2774 = t53 * t2209; in func_pol()
1692 …t2835 = 0.58177440000000000000e1 * t377 * t2774 * t179 * t857 + 0.71824000000000000000e-1 * t377 *… in func_pol()
1781 …000000e0 * t377 * t2636 * t439 * t332 + 0.58177440000000000000e1 * t377 * t2774 * t439 * t350 + 0.… in func_pol()
1851 …00000e1 * t377 * t2698 * t1166 * t133 + 0.58177440000000000000e1 * t377 * t2774 * t1166 * t152 - 0… in func_pol()
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| H A D | gga_x_sg4.c | 757 double t2745, t2758, t2761, t2774, t2786, t2803, t2811, t2820; in func_pol() local
1837 t2774 = t1186 * t1224; in func_pol()
1840 …* t2705 - 0.2e1 / 0.9e1 * t2594 + t2582 - t2664 / 0.6e1 - 0.2e1 / 0.9e1 * t2774 + t1190 * t2728 * … in func_pol()
1853 …v4rho3sigma[9] = -0.2e1 / 0.3e1 * t2719 - 0.2e1 / 0.3e1 * t2774 - 0.2e1 * t2786 + t2582 + t205 * t… in func_pol()
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| H A D | gga_x_sogga11.c | 1468 double t2758, t2761, t2764, t2767, t2768, t2770, t2774, t2777; in func_pol() local
2733 t2774 = t1307 * t2739; in func_pol()
2754 …4 * t2742 + 0.80e2 / 0.729e3 * t2768 * t2608 * t2770 - 0.80e2 / 0.243e3 * t2774 * t2758 + 0.16e2 /… in func_pol()
3019 … / 0.729e3 - 0.10e2 / 0.243e3 * t2768 * t4229 * t4183 + 0.10e2 / 0.81e2 * t2774 * t4214 + 0.341e3 … in func_pol()
3129 …764 * t4759 / 0.1944e4 + 0.5e1 / 0.324e3 * t2768 * t4784 * t4746 - 0.5e1 / 0.108e3 * t2774 * t4769; in func_pol()
3232 … / 0.5184e4 - 0.5e1 / 0.864e3 * t2768 * t5228 * t5193 + 0.5e1 / 0.288e3 * t2774 * t5221 - 0.35e2 /… in func_pol()
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| H A D | gga_x_ityh.c | 1368 double t2730, t2742, t2745, t2769, t2772, t2774, t2781, t2786; in func_ferr() local
2139 t2774 = t431 * t2772 * t729; in func_ferr()
2141 … * t434 - 0.12e2 * t263 * t1163 - 0.12e2 * t82 * t2769 - 0.108e3 * t248 * t2774 + 0.54e2 * t1025 *… in func_ferr()
2194 …t2774 + 0.4e1 * t506 * t1175 - 0.2e1 * t495 * t1257 * t481 - 0.3e1 * t1265 * t1153 - 0.135e3 / 0.2… in func_ferr()
2550 double t2765, t2766, t2768, t2769, t2771, t2772, t2774, t2779; in func_pol() local
4030 t2774 = t145 * t507 * t1185; in func_pol()
4066 t2857 = -t2765 - t2769 + t2772 - t2774 - t2834 - t2838 - t2841 - t2845 - t2848 - t2852 - t2856; in func_pol()
5134 …t7416 = -0.3e1 * t2765 - 0.3e1 / 0.2e1 * t2768 + t7407 - 0.3e1 * t2774 - 0.9e1 / 0.8e1 * t2833 - 0… in func_pol()
5287 …+ t7419 - t2845 - t2856 - t2838 - t2840 / 0.2e1 - t3184 - t2834 + t7407 - t2774 - t2765 - t2769 - … in func_pol()
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| H A D | gga_x_ev93.c | 941 double t2745, t2757, t2768, t2774, t2777, t2784, t2789, t2791; in func_pol() local
2443 t2774 = t374 * t928 * t420; in func_pol()
2446 …1 / 0.27e2 * t2768 + 0.2e1 / 0.9e1 * t801 * t433 * t993 - 0.2e1 / 0.9e1 * t2774 + 0.7e1 / 0.3e1 * … in func_pol()
2486 …t3086 = t2742 / 0.9e1 - t2745 / 0.3e1 - t2757 / 0.6e1 + t2768 / 0.9e1 - t2774 / 0.3e1 - t2777 - t2… in func_pol()
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| H A D | gga_x_sfat_pbe.c | 150 double t2774, t2806, t2822, t2824, t2831, t2832, t2840, t2844; in func_unpol() local
1190 t2774 = t371 * t2520 * t1 * t59; in func_unpol()
1191 …+ 0.12171145659148281143e-4 * t2774 * t2555 + 0.37657315595988592927e-4 * t2774 * t2568 + 0.291277… in func_unpol()
1722 double t2715, t2717, t2718, t2731, t2768, t2769, t2770, t2774; in func_ferr() local
2698 t2774 = t5 * t596 * t2431; in func_ferr()
2699 t2775 = t2774 * t2346; in func_ferr()
2775 t3270 = t2774 * t3079; in func_ferr()
2934 t4558 = t2774 * t3953; in func_ferr()
2986 t4883 = t2774 * t106; in func_ferr()
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| H A D | gga_c_op_pbe.c | 795 double t2770, t2771, t2772, t2773, t2774, t2777, t2778, t2779; in func_pol() local
2392 t2774 = t2771 * t2773; in func_pol()
2412 …9112957686912579e-5 * t2762 * t2766 + 0.70287338873060737737e-5 * t2770 * t2774 + 0.25000000000000… in func_pol()
4019 …6595399219973780293e-9 * t2762 * t3479 * t1448 * t9949 + 0.14057467774612147547e-4 * t9954 * t2774; in func_pol()
4022 t9967 = t9966 * t2774; in func_pol()
4347 …0.46858225915373825158e-5 * t11689 + 0.70287338873060737737e-5 * t11692 * t2774 + 0.23429112957686… in func_pol()
4353 …338873060737737e-5 * t9954 * t3140 - 0.21086201661918221321e-4 * t11709 * t2774 - 0.70287338873060… in func_pol()
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| H A D | gga_c_gaploc.c | 1618 t2774 = t2773 * t274; in func_unpol()
9607 t2774 = t940 * t445; in func_pol()
9608 t2775 = t2774 * t557; in func_pol()
9906 t3333 = t2774 * t867; in func_pol()
11969 t8238 = t2774 * t1622; in func_pol()
12974 t10478 = t2774 * t2477; in func_pol()
13622 t11491 = t2774 * t2878; in func_pol()
14348 t13045 = t2774 * t3180; in func_pol()
16864 t25168 = t2774 * t5072; in func_pol()
17979 t32427 = t2774 * t7248; in func_pol()
[all …]
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| H A D | gga_c_op_b88.c | 782 double t2763, t2766, t2767, t2770, t2773, t2774, t2777, t2778; in func_pol() local
2237 t2774 = t672 * t2773; in func_pol()
2245 …6688033333333333334e-1 * t207 * t2770 - 0.20006410000000000000e0 * t207 * t2774 - 0.60019230000000… in func_pol()
3555 t8489 = t551 * t2774; in func_pol()
3580 …t8675 = -0.13337606666666666667e0 * t1951 * t2786 - 0.20006410000000000000e0 * t554 * t2774 - 0.26… in func_pol()
3651 …000000000000e0 * t207 * t2392 * t2762 - 0.60019230000000000000e0 * t706 * t2774 - 0.60019230000000… in func_pol()
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| H A D | gga_c_op_g96.c | 735 double t2758, t2761, t2762, t2765, t2768, t2769, t2773, t2774; in func_pol() local
2317 t2774 = t1658 * t203; in func_pol()
2318 t2775 = t452 * t2774; in func_pol()
3949 …4531629183661790e-3 * t10109 - 0.21762852289268685099e-3 * t449 * t1403 * t2774 - 0.11354531629183… in func_pol()
3976 …080e-3 * t464 * t2796 * t545 - 0.16203862845814184013e-3 * t464 * t5916 * t2774 + 0.36458691403081… in func_pol()
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| H A D | gga_x_chachiyo.c | 1356 double t2767, t2768, t2769, t2770, t2772, t2773, t2774, t2775; in func_pol() local
3659 t2774 = t2773 / 0.72e2; in func_pol()
3665 …t2780 = -t2748 + t2752 - t2754 + t2758 - t2760 + t2762 - t2766 - t2768 - t2770 - t2774 + t2777 - t… in func_pol()
5283 …t9627 = -t9278 + t2752 - t9280 + t2758 - t9282 + t2762 - t2766 - t2768 - t2770 - t2774 + t2777 - t… in func_pol()
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| H A D | gga_c_bmk.c | 1395 double t2768, t2769, t2772, t2773, t2774, t2777, t2778, t2779; in func_pol() local
3294 t2774 = t168 * t2773; in func_pol()
3299 … 0.27e2 * t2763 + 0.4e1 / 0.3e1 * t2769 - 0.2e1 / 0.3e1 * t2730 - 0.2e1 * t2774 + 0.2e1 * t2735 - … in func_pol()
3303 …87 + 0.62517000000000000000e0 * t177 * t2790 - 0.30988500000000000000e1 * t2774 - 0.41678000000000… in func_pol()
3369 … * t2769 - 0.34246666666666666665e-1 * t2730 - 0.10274000000000000000e0 * t2774 + 0.10274000000000… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_tm.c | 4151 double t2758, t2765, t2768, t2771, t2773, t2774, t2775, t2778; in func_pol() local
5766 t2774 = t165 * t2773; in func_pol()
5768 …725 + t390 * t2765 / 0.10e2 - 0.27e2 / 0.100e3 * t2768 * t997 + 0.171e3 / 0.1000e4 * t2774 * t2775; in func_pol()
5991 … t341 * t3451 - 0.12e2 * t341 * t3455 - 0.12e2 * t1203 * t931 + 0.171e3 / 0.1000e4 * t2774 * t3460; in func_pol()
6336 …4381 - 0.6e1 * t341 * t4383 - 0.6e1 * t4338 * t343 + 0.171e3 / 0.1000e4 * t2774 * t4388 - 0.9e1 / … in func_pol()
6856 …0 * t5682 - 0.648e3 * t2587 * t5685 + t5714 * t187 + 0.171e3 / 0.1000e4 * t2774 * t5716 - 0.27e2 /… in func_pol()
8332 …e3 / 0.500e3 * t2774 * t4880 * t413 - 0.12e2 * t5012 * t927 - 0.12e2 * t3794 * t1225 - 0.12e2 * t1… in func_pol()
8950 … * t413 + 0.171e3 / 0.500e3 * t2774 * t1845 * t1307 + 0.171e3 / 0.1000e4 * t2774 * t6029 * t413 + … in func_pol()
9260 …t2774 * t6487 * t413 - 0.12e2 * t1203 * t5479 + 0.171e3 / 0.500e3 * t10690 * t5063 + t18745 * t413… in func_pol()
9689 … / 0.10e2 + 0.513e3 / 0.1000e4 * t2774 * t1845 * t1691 + 0.513e3 / 0.1000e4 * t9475 * t6026 + 0.51… in func_pol()
[all …]
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| H A D | hyb_mgga_x_js18.c | 11310 t2774 = t7 * t15; in func_pol()
11311 t2775 = t5 * t2774; in func_pol()
11977 t4907 = t2774 * t1517 * t944; in func_pol()
12208 t5683 = t2774 * t1743 * t944; in func_pol()
14733 t14528 = t2774 * t4700 * t944; in func_pol()
14736 t14534 = t2774 * t1517 * t9; in func_pol()
15365 t17403 = t2774 * t5655 * t944; in func_pol()
15366 t17407 = t2774 * t1743 * t9; in func_pol()
15513 t17970 = t2774 * t6161 * t455; in func_pol()
15828 t19230 = t2774 * t6161 * t944; in func_pol()
[all …]
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| H A D | hyb_mgga_x_pjs18.c | 3572 double t2769, t2771, t2774, t2782, t2783, t2784, t2787, t2790; in func_pol() local
5448 t2774 = t1412 * t913; in func_pol()
5451 …t2784 = -0.2e1 * t2769 + t2771 * t187 / 0.2e1 + t2774 * t489 / 0.4e1 - 0.4e1 * t1868 * t913 - t533… in func_pol()
5560 …t3199 = -0.2e1 * t3184 + t3186 * t187 / 0.2e1 + t2774 * t710 / 0.4e1 - 0.4e1 * t3191 * t913 - t765… in func_pol()
7032 …3 - t8037 - 0.2e1 * t8038 + t8040 * t187 / 0.2e1 + t8043 * t489 / 0.2e1 + t2774 * t1454 / 0.4e1 + … in func_pol()
7445 … t10107 - 0.2e1 * t10108 + t10110 * t187 / 0.2e1 + t9349 * t710 / 0.2e1 + t2774 * t2359 / 0.4e1 + … in func_pol()
9943 t22960 = t2774 * t4434; in func_pol()
10207 t24993 = t2774 * t5458; in func_pol()
10490 t27313 = t2774 * t6416; in func_pol()
10749 t29844 = t2774 * t6851; in func_pol()
[all …]
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| H A D | mgga_x_mvsb.c | 116 double t2676, t2683, t2719, t2726, t2750, t2757, t2760, t2774; in func_unpol() local
960 t2774 = t459 * t154; in func_unpol()
961 … * t10 - 0.45e2 / 0.32e2 * t92 * t674 * t1207 - 0.45e2 / 0.32e2 * t1205 * t2774 * t118 - t334 * t3… in func_unpol()
1010 …t3240 = 0.5e1 / 0.64e2 * t334 * t815 * t2774 + 0.5e1 / 0.64e2 * t334 * t815 * t2750 + 0.5e1 / 0.64… in func_unpol()
2418 double t2774, t2777, t2781, t2785, t2787, t2789, t2791, t2792; in func_pol() local
4278 t2774 = t934 * t768; in func_pol()
4302 …64e2 * t97 * t2767 + 0.5e1 / 0.8e1 * t97 * t2771 + 0.5e1 / 0.16e2 * t97 * t2774 - t97 * t2831 / 0.… in func_pol()
5906 …t7624 = 0.15e2 / 0.16e2 * t97 * t720 * t2830 * t280 + 0.15e2 / 0.16e2 * t252 * t2774 - 0.135e3 / 0… in func_pol()
6247 …* t340 * t707 + 0.5e1 / 0.32e2 * t3400 * t2771 + 0.5e1 / 0.64e2 * t3400 * t2774 + 0.5e1 / 0.16e2 *… in func_pol()
6423 … t3209 / 0.32e2 + 0.5e1 / 0.16e2 * t714 * t1311 + 0.5e1 / 0.16e2 * t390 * t2774 + t920 * t3660 / 0… in func_pol()
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| H A D | mgga_x_scanl.c | 7150 t2774 = t1016 * t213; in func_ferr()
9205 t13188 = t2774 * t565; in func_ferr()
9833 t17932 = t2774 * t75; in func_ferr()
13651 t2774 = t814 * t814; in func_pol()
13652 t2775 = t2774 * t288; in func_pol()
16060 t8215 = t2774 * t631; in func_pol()
17094 t11246 = t2774 * t814; in func_pol()
17096 t11253 = t2774 * t829; in func_pol()
17320 t11986 = t2418 * t2774; in func_pol()
17388 t12313 = t2774 * t971; in func_pol()
[all …]
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| H A D | mgga_c_revscan.c | 3364 t2774 = 0.1e1 / t1741; in func_ferr()
7507 t2774 = t2773 * t708; in func_pol()
11089 t9708 = t7324 * t2774; in func_pol()
11352 t10106 = t7841 * t2774; in func_pol()
12011 t11239 = t9699 * t2774; in func_pol()
12089 t11363 = t9933 * t2774; in func_pol()
21518 t43789 = t35514 * t2774; in func_pol()
21659 t44074 = t36099 * t2774; in func_pol()
21900 t44649 = t36863 * t2774; in func_pol()
22036 t44977 = t37663 * t2774; in func_pol()
[all …]
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| H A D | mgga_c_bc95.c | 2190 double t2774, t2775, t2777, t2778, t2780, t2781, t2783, t2784; in func_pol() local
4729 t2774 = t790 * t223; in func_pol()
4730 t2775 = t2774 * t46; in func_pol()
4933 t3015 = t2774 * t47; in func_pol()
8017 t7436 = t2774 * t254; in func_pol()
8025 …87 + 0.33333333333333333334e1 * t7436 * t258 - 0.55272355555555555556e0 * t2774 * t279 * t287 + 0.… in func_pol()
8131 …181527777777777776e-2 * t2771 * t268 * t272 - 0.12954458333333333333e-1 * t2774 * t268 * t272 - 0.… in func_pol()
8632 t10093 = t2774 * t476; in func_pol()
10072 …272611111111111111e-1 * t2771 * t572 * t576 + 0.51817833333333333333e-1 * t2774 * t572 * t576 - 0.… in func_pol()
10319 …363055555555555556e-2 * t2771 * t598 * t600 - 0.25908916666666666667e-1 * t2774 * t598 * t600 - 0.… in func_pol()
[all …]
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| H A D | mgga_x_pkzb.c | 1160 double t2724, t2728, t2733, t2774, t2807, t2817, t2820, t2827; in func_pol() local
2953 …t2774 = t8 * t109 * t62 * t2728 / 0.2e1 + t2530 / 0.9e1 + t2533 / 0.3e1 + 0.16160400000000000000e0… in func_pol()
2963 …0000000e0 * t910 + t913 - t917 + t920 + t766 + t785 + t811 + t10 * (t2699 + t2733 + t2774 + t2845); in func_pol()
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| H A D | mgga_c_m08.c | 3917 double t2772, t2774, t2776, t2778, t2779, t2781, t2784, t2786; in func_pol() local
6160 t2774 = t232 * t2772 * t609; in func_pol()
6163 v2rhosigma[1] = t2686 * t827 + 0.3e1 * t2689 * t2745 - t2689 * t2776 + t792 * t2774 + t2742; in func_pol()
7940 …+ 0.3e1 * t2689 * t9226 - t2689 * t9229 + 0.3e1 * t2689 * t9231 + t2779 * t2774 + t792 * t9214 - t… in func_pol()
8863 …v3rhosigmatau[2] = t15448 * t827 + 0.3e1 * t15450 * t2745 - t15450 * t2776 + t4093 * t2774 + t1546… in func_pol()
8867 …v3rhosigmatau[3] = t15457 * t827 + 0.3e1 * t15459 * t2745 - t15459 * t2776 + t4095 * t2774 + t1547… in func_pol()
11366 …89 * t30726 * t9101 + 0.12e2 * t31485 * t31543 * t31486 + 0.2e1 * t8965 * t2774 - t30372 * t2843 +… in func_pol()
13524 …t57411 = 0.2e1 * t15459 * t9220 + 0.3e1 * t15459 * t9226 - t15459 * t9256 + t15484 * t2774 - t5731… in func_pol()
15202 …v4rhosigmatau2[3] = t18534 * t2774 + 0.3e1 * t2745 * t73404 - t2776 * t73404 + t73402 * t827 + t73… in func_pol()
15206 …v4rhosigmatau2[4] = t18536 * t2774 + 0.3e1 * t2745 * t73413 - t2776 * t73413 + t73411 * t827 + t73… in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_ml1.c | 386 double t2769, t2770, t2771, t2773, t2774, t2775, t2777, t2778; in func_pol() local
1863 t2774 = t116 * t2773; in func_pol()
1864 t2775 = t337 * t2774; in func_pol()
1964 …18763026946711844976e0 * t485 * t2738 + 0.25017369262282459968e0 * t803 * t2774 + 0.12508684631141… in func_pol()
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| H A D | lda_xc_bn05.c | 897 double t2773, t2774, t2777, t2778, t2781, t2782, t2785, t2786; in func_pol() local
2379 t2774 = t2106 * t2773; in func_pol()
2382 …10e2 / 0.81e2 * t2059 - 0.2e1 / 0.81e2 * t2062 - 0.10e2 / 0.81e2 * t661 * t2774 + 0.2e1 / 0.27e2 *… in func_pol()
3615 t7321 = t2123 * t2774; in func_pol()
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