| /dports/biology/pbbam/pbbam-0.18.0/tests/src/cram/ |
| H A D | pbmerge_aligned_ordering.t.in | 50 …5_042212_sidney_c100564852550000001823085912221377_s1_X0/7247/7338_7831\tlambda_NEB3011\t4904 (esc)
83 …5_042212_sidney_c100564852550000001823085912221377_s1_X0/7247/7338_7831\tlambda_NEB3011\t4904 (esc)
108 …5_042212_sidney_c100564852550000001823085912221377_s1_X0/7247/7338_7831\tlambda_NEB3011\t4904 (esc)
153 …5_042212_sidney_c100564852550000001823085912221377_s1_X0/7247/7338_7831\tlambda_NEB3011\t4904 (esc)
192 …5_042212_sidney_c100564852550000001823085912221377_s1_X0/7247/7338_7831\tlambda_NEB3011\t4904 (esc)
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 2187 t4904 = t4701*t65
2188 t4905 = t62*t4904
2193 t4915 = t4733*t26*t4904
2201 t4935 = 0.1000000000e1_dp*t237*t471*t4904
2298 *t2098*t4904 - 0.4500000000e1_dp*t5256*t4701*t4940 &
2574 t5963 = 0.1000000000e1_dp*t379*t471*t4904
4963 t4904 = t4701*t65
4964 t4905 = t62*t4904
4969 t4915 = t4733*t26*t4904
4977 t4935 = 0.1000000000e1_dp*t237*t471*t4904
[all …]
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| /dports/science/cp2k-data/cp2k-7.1.0/src/xc/ |
| H A D | xc_xbecke88_lr_adiabatic.F | 2187 t4904 = t4701*t65
2188 t4905 = t62*t4904
2193 t4915 = t4733*t26*t4904
2201 t4935 = 0.1000000000e1_dp*t237*t471*t4904
2298 *t2098*t4904 - 0.4500000000e1_dp*t5256*t4701*t4940 &
2574 t5963 = 0.1000000000e1_dp*t379*t471*t4904
4963 t4904 = t4701*t65
4964 t4905 = t62*t4904
4969 t4915 = t4733*t26*t4904
4977 t4935 = 0.1000000000e1_dp*t237*t471*t4904
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_ev93.c | 974 double t4896, t4904, t4907, t4910, t4914, t4916, t4918, t4921; in func_pol() local
2750 t4904 = t1736 / 0.2e1; in func_pol()
2783 …* t1754 + 0.3e1 / 0.4e1 * t1773 + 0.3e1 / 0.4e1 * t1787 + 0.2e1 * t1734 + t4904 - 0.3e1 * t1742 - … in func_pol()
2814 …3 = -t1729 - t1715 - t4896 + t1732 + t1740 + t1746 - t1755 + t1774 + t1788 - t1820 + t1734 + t4904; in func_pol()
2867 …v4rho2sigma2[12] = t9 * t5460 - t1819 + 0.2e1 * t1822 - 0.2e1 * t1825 + t1828 - t4896 + t4904 - t4… in func_pol()
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| H A D | gga_c_wl.c | 570 double t4892, t4894, t4895, t4902, t4904, t4905, t4912, t4913; in func_pol() local
2689 t4904 = t1249 * t1272; in func_pol()
2690 t4905 = 0.12152025000000000000e-1 * t4904; in func_pol()
2709 …* t4894 - 0.10126687500000000000e-1 * t4902 - 0.18228037500000000000e-1 * t4904 - 0.16405233750000… in func_pol()
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| H A D | gga_c_gaploc.c | 6325 double t4898, t4899, t4900, t4903, t4904, t4907, t4908, t4911; in func_pol() local
10611 t4904 = t1364 * t1042; in func_pol()
15572 …533 + 0.85801175884441024008e1 * t4840 * t487 * t4904 + 0.42900587942220512004e1 * t1380 * t1409 *… in func_pol()
16962 …073 + 0.21450293971110256002e1 * t4840 * t942 * t4904 + 0.21450293971110256002e1 * t1380 * t2838 *… in func_pol()
17493 …t30026 = 0.71500979903700853338e0 * t1380 * t3121 * t4904 - 0.47667319935800568892e0 * t9749 * t49… in func_pol()
17604 …1850426669e0 * t1614 * t9735 + 0.71500979903700853338e0 * t1380 * t3125 * t4904 + t30472 + 0.92686… in func_pol()
18738 …3 * t33592 + t30016 + t30018 + 0.71500979903700853338e0 * t1380 * t3340 * t4904 + t34252 + t34254 … in func_pol()
18955 t34835 = 0.71500979903700853338e0 * t4380 * t10741 * t4904; in func_pol()
19710 ….24539472610509279794e2 * t526 * t4474 * t11544 + 0.71500979903700853338e0 * t1380 * t3525 * t4904; in func_pol()
19718 …850426669e0 * t1614 * t11512 + 0.71500979903700853338e0 * t1380 * t3529 * t4904 - 0.69017266717057… in func_pol()
[all …]
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| H A D | gga_c_gapc.c | 293 double t4890, t4895, t4898, t4901, t4904, t4905, t4908, t4909; in func_unpol() local
2622 t4904 = t92 * t3109; in func_unpol()
2629 … - 0.14492726735651760868e-5 * t160 * t4901 - 0.18758436440271560323e-8 * t4904 * t4905 + 0.164136… in func_unpol()
3854 …t14393 = -0.37573735981319380031e-8 * t4904 * t13223 + 0.24657764237740843146e-7 * t5096 * t3395 -… in func_unpol()
8589 double t4894, t4895, t4896, t4903, t4904, t4905, t4908, t4909; in func_pol() local
12622 t4904 = t4903 * t412; in func_pol()
12623 t4905 = t430 * t4904; in func_pol()
18233 t25247 = t8819 * t986 * t4904; in func_pol()
18411 t25703 = t384 * t8569 * t4904; in func_pol()
18772 t26506 = t9582 * t9583 * t4904; in func_pol()
[all …]
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| H A D | gga_c_regtpss.c | 2505 double t4887, t4888, t4889, t4891, t4894, t4895, t4903, t4904; in func_pol() local
5644 t4904 = t1440 * t4903; in func_pol()
5645 … + 0.72280234901709995518e-2 * t4494 + 0.86736281882051994620e0 * t1439 * t4904 + 0.97574405393827… in func_pol()
8781 …1439 * t4535 * t1526 * t904 - t16046 + 0.17347256376410398924e1 * t4524 * t4904 + 0.48186823267806… in func_pol()
9126 …e1 * t4857 * t4858 * t11919 - t15856 + 0.17347256376410398924e1 * t4865 * t4904 - 0.26020884564615… in func_pol()
9853 …1769129231196772e1 * t5484 * t20532 + 0.34694512752820797848e1 * t19141 * t4904 + 0.37187329209051… in func_pol()
9942 …- 0.50779446784275991476e-1 * t19877 + 0.17347256376410398924e1 * t5592 * t4904 + 0.57119737665102… in func_pol()
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| H A D | gga_c_bmk.c | 1510 double t4880, t4884, t4889, t4899, t4901, t4902, t4903, t4904; in func_pol() local
4223 t4904 = t296 * t4903; in func_pol()
4239 …0 * t4775 + 0.10000000000000000000e1 * t4777 + 0.50000000000000000001e0 * t4904 + 0.50000000000000… in func_pol()
6221 …1 * t4775 + 0.20000000000000000000e1 * t4777 + 0.10000000000000000000e1 * t4904 + 0.10000000000000… in func_pol()
6439 …t15856 = 0.15000000000000000000e1 * t4904 + 0.15000000000000000000e1 * t4907 - 0.46635000000000000… in func_pol()
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| H A D | gga_c_op_g96.c | 825 double t4871, t4878, t4887, t4888, t4893, t4900, t4903, t4904; in func_pol() local
3088 t4904 = t4903 * t324; in func_pol()
3089 …000e1 * t1220 * t1124 - 0.71925706400000000000e1 * t4900 * t324 - 0.14385141280000000000e2 * t4904; in func_pol()
3125 …944279800000000000e1 * t5128 - 0.60000000000000000000e1 * t4888 - 0.21577711920000000000e2 * t4904; in func_pol()
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| H A D | gga_c_zvpbeloc.c | 2225 double t4904, t4905, t4906, t4908, t4910, t4912, t4913, t4915; in func_pol() local
5304 t4904 = t3020 * t145; in func_pol()
5305 t4905 = t336 * t4904; in func_pol()
7478 …* t10332 * t445 - 0.6e1 * t1191 * t3735 * t1134 - 0.3e1 * t1191 * t3722 * t4904 - 0.3e1 * t1191 * … in func_pol()
8198 t15748 = t15735 * t14058 * t4904; in func_pol()
8769 t17921 = t15886 * t1611 * t4904; in func_pol()
9535 t21787 = t1465 * t1472 * t4904; in func_pol()
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| H A D | gga_x_sfat_pbe.c | 3408 double t4901, t4902, t4903, t4904, t4905, t4906, t4907, t4911; in func_pol() local
5881 t4904 = t4856 * t332; in func_pol()
5882 t4905 = t878 * t4904; in func_pol()
7324 …t12591 = 0.18025887470765350444e-4 * t11575 + 0.54077662412296051331e-4 * t1441 * t1975 * t4904 + … in func_pol()
7618 …41 * t4838 * t1486 - t14375 + 0.16223298723688815399e-3 * t1441 * t3320 * t4904 + t14389 - 0.91399… in func_pol()
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| H A D | gga_xc_b97.c | 1868 double t4903, t4904, t4906, t4907, t4908, t4909, t4911, t4912; in func_pol() local
4834 t4904 = t241 * t4903; in func_pol()
4854 …* t4894 - 0.19025925925925925925e-1 * t4899 + 0.68493333333333333331e-1 * t4904 - 0.45662222222222… in func_pol()
4948 …5194 + 0.22e2 / 0.9e1 * t4894 - 0.10e2 / 0.27e2 * t4899 + 0.4e1 / 0.3e1 * t4904 - 0.8e1 / 0.9e1 * … in func_pol()
4954 …2 + t5175 - 0.68863333333333333333e0 * t4892 + 0.20659000000000000000e1 * t4904 - 0.30988500000000… in func_pol()
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| H A D | gga_c_hcth_a.c | 1589 double t4890, t4892, t4894, t4896, t4898, t4900, t4901, t4904; in func_pol() local
4324 t4904 = t1900 * t988; in func_pol()
4331 …t4925 = -0.83418009600000000000e-5 * t690 * t4901 + 0.21145766400000000000e-2 * t690 * t4904 - 0.2… in func_pol()
6640 …t14084 = 0.30586603520000000000e-4 * t2150 * t4901 - 0.77534476800000000000e-2 * t2150 * t4904 + 0… in func_pol()
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| H A D | gga_x_sfat.c | 170 double t4899, t4904, t4907, t4911, t4916, t4918, t4941, t4952; in func_unpol() local
1350 t4904 = t161 * t2009; in func_unpol()
1352 …4 / 0.4e1 + t692 * t1470 / 0.8e1 + 0.1296e4 * t4899 * t846 * t316 * t17 - t4904 * t165 / 0.24e2 - … in func_unpol()
1402 …t5818 = -0.3e1 / 0.2e1 * t268 * t269 * t149 * t5660 * t184 - t4904 * t262 / 0.16e2 - 0.480e3 * t24… in func_unpol()
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| H A D | gga_c_zvpbeint.c | 2451 double t4903, t4904, t4905, t4906, t4907, t4908, t4909, t4910; in func_pol() local
5977 t4904 = t4723 / 0.64e2; in func_pol()
5989 …t4917 = -t4823 - t4824 + t4903 - t4248 - t4255 - t4904 - t4905 + t4906 + t4907 + t4484 - t4908 + t… in func_pol()
6097 t5076 = -t5066 + t5067 - t4814 - t4815 - t5069 - t5071 - t4904 - t4905 + t4268 + t5074 + t5075; in func_pol()
8688 …t14352 = -t4820 - t4823 - t4482 - t4483 - t4904 - t4905 + t4256 + t4260 + t14351 + t13104 - t4908 … in func_pol()
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| H A D | gga_c_pw91.c | 2058 double t4898, t4899, t4900, t4901, t4902, t4904, t4905, t4906; in func_pol() local
5220 t4904 = t1093 * t4902 * t395; in func_pol()
5221 t4905 = 0.51689762869806860992e-2 * t4904; in func_pol()
8144 … + t7 * (t14794 + t14827 + t14854 + t15037) - 0.15506928860942058297e-1 * t4904 - 0.25e2 * t4676 -… in func_pol()
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| H A D | gga_c_zpbeint.c | 2031 double t4903, t4904, t4905, t4906, t4907, t4908, t4909, t4910; in func_pol() local
5368 t4904 = t4034 * t1518; in func_pol()
5369 t4905 = 0.3e1 / 0.4e1 * t4904; in func_pol()
8417 t17061 = 0.3e1 / 0.2e1 * t4904; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_x_erf.c | 578 double t4904, t4905, t4910, t4911, t4916, t4917, t4920, t4924; in func_pol() local
2310 …t4904 = -t1786 / 0.2e1 - 0.3e1 / 0.2e1 * t1791 - t1795 / 0.2e1 - 0.3e1 / 0.2e1 * t1799 - t1803 / 0… in func_pol()
2312 v4rho4[0] = t4889 + t4904; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_gx.c | 2492 double t4862, t4867, t4884, t4890, t4893, t4898, t4901, t4904; in func_pol() local
4907 t4904 = t506 * t1287; in func_pol()
4920 …6e3 * t4898 * t713 - 0.25e2 / 0.216e3 * t4901 * t713 - 0.25e2 / 0.648e3 * t4904 * t713 + 0.50e2 / … in func_pol()
5047 …t5472 = 0.25e2 / 0.81e2 * t4904 * t874 + 0.250e3 / 0.81e2 * t4932 * t5439 + 0.250e3 / 0.81e2 * t34… in func_pol()
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| H A D | mgga_x_sa_tpss.c | 3966 double t4870, t4883, t4887, t4904, t4906, t4913, t4916, t4919; in func_ferr() local
5886 t4904 = t43 * t390; in func_ferr()
5903 …t4904 + 0.478953e6 / 0.50e2 * t1637 * t4906 + 0.73e2 / 0.200e3 * t3944 * t413 + 0.5913e4 / 0.100e3… in func_ferr()
7012 … * t1479 - 0.17739e5 / 0.100e3 * t1568 * t4952 + 0.73e2 / 0.50e2 * t670 * t4904 - 0.96875e5 / 0.11… in func_ferr()
7270 …t296 * t1014 + 0.73e2 / 0.25e2 * t214 * t15525 + 0.73e2 / 0.50e2 * t861 * t4904 + 0.5913e4 / 0.25e… in func_ferr()
7330 … * t413 - 0.17739e5 / 0.25e2 * t2724 * t4952 + 0.146e3 / 0.25e2 * t1046 * t4904 + 0.5913e4 / 0.4e1… in func_ferr()
7620 double t4895, t4896, t4898, t4899, t4900, t4903, t4904, t4906; in func_pol() local
10306 t4904 = t1128 * t4903; in func_pol()
10312 …195584e9 * t4896 - 0.625e3 / 0.5668704e7 * t4900 - 0.625e3 / 0.314928e6 * t4904 - 0.3125e4 / 0.272… in func_pol()
13632 …674816e8 * t4896 - 0.4375e4 / 0.472392e6 * t4900 - 0.4375e4 / 0.26244e5 * t4904 - 0.21875e5 / 0.11… in func_pol()
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| H A D | mgga_x_rtpss.c | 3109 double t4903, t4904, t4907, t4908, t4911, t4912, t4915, t4916; in func_pol() local
5783 t4904 = t4239 * t4903; in func_pol()
5785 …8 * t4888 + 0.3e1 / 0.4e1 * t4103 * t4892 - t4896 * t4899 / 0.16e2 + 0.3e1 / 0.8e1 * t4103 * t4904; in func_pol()
7551 t12415 = t9903 * t4904 / 0.2e1; in func_pol()
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| H A D | hyb_mgga_x_pjs18.c | 164 double t4878, t4879, t4884, t4887, t4888, t4904, t4912, t4923; in func_unpol() local
1397 t4904 = t336 * t1653; in func_unpol()
1399 …1 * t1887 * t1706 - 0.9e1 / 0.2e1 * t4603 * t1709 + t4587 * t741 + t504 * t4904 / 0.2e1 + t3351 * … in func_unpol()
1410 …22 / 0.2e1 + t504 * t4927 / 0.2e1 + t504 * t4930 / 0.4e1 - 0.3e1 * t496 * t4904 - 0.9e1 / 0.2e1 * … in func_unpol()
1441 …t1706 - 0.9e1 / 0.2e1 * t4340 * t1709 - 0.6e1 * t4337 * t741 + t4329 * t741 + t561 * t4904 / 0.2e1; in func_unpol()
1442 …t5206 = t3577 * t2231 / 0.4e1 + t1321 * t4884 / 0.8e1 - 0.2e1 * t593 * t4904 + t1309 * t2227 + 0.7… in func_unpol()
1443 …22 - 0.3e1 * t556 * t4927 - 0.3e1 / 0.2e1 * t556 * t4930 - 0.3e1 * t556 * t4904 - 0.9e1 / 0.2e1 * … in func_unpol()
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| H A D | mgga_c_tpss.c | 190 double t4836, t4846, t4847, t4849, t4863, t4904, t4939, t4950; in func_unpol() local
1621 t4960 = t4807 + t4863 + t4904 + t4958; in func_unpol()
1997 double t4866, t4896, t4903, t4904, t4908, t4941, t4962, t4977; in func_ferr() local
3176 t4904 = t698 * t691; in func_ferr()
3179 t4962 = t590 * t4904; in func_ferr()
3625 double t4896, t4897, t4900, t4901, t4904, t4907, t4908, t4912; in func_pol() local
9548 t4904 = t1350 * t1037; in func_pol()
16109 t22264 = t400 * t4904; in func_pol()
28891 t90648 = t1397 * t4904; in func_pol()
28943 t90828 = t1392 * t4904; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 183 double t4877, t4904, t4907, t4909, t4911, t4912, t4913, t4914; in func_unpol() local
1569 t4904 = t1214 * t709; in func_unpol()
1583 …t4941 = 0.4e1 * t702 * t710 + t706 * t4904 - t144 * t4907 - 0.6e1 * t4909 - t4912 - t4913 - 0.6e1 … in func_unpol()
1840 …737 + 0.2e1 * t911 * t710 + 0.2e1 * t3931 * t785 + 0.2e1 / 0.3e1 * t915 * t4904 - t3937 * t5745 / … in func_unpol()
1911 …2 + 0.2e1 * t1051 * t710 + 0.2e1 * t4611 * t785 + 0.2e1 / 0.3e1 * t1055 * t4904 - t4615 * t5745 / … in func_unpol()
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