| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn.c | 850 double t2200, t2205, t2211, t2213, t2215, t2218, t2262, t2263; in func_pol() local
1942 t2213 = 0.29070683134633122642e-2 * t535 * t476; in func_pol()
1952 … t2205 + 0.11239335477713059192e-2 * t1296 * t452 * t454 * t114 - t2211 - t2213 - t2215 - t2298 + … in func_pol()
2055 …t2883 = 0.16e2 * t2865 - 0.16e2 * t2867 + t2870 + 0.48e2 * t2871 - t2874 + t2211 + t2213 + t2215 +… in func_pol()
2152 …t3115 = -0.12e2 * t3095 + t3098 - t2874 + t2211 + t2213 + t2215 + t2298 + t3099 - t3101 + t3103 - … in func_pol()
2199 ….8e1 * t3352 + 0.20e2 * t3354 + 0.12e2 * t3356 - 0.32e2 * t3358 + t2211 + t2213 + t2215 + t2298 - … in func_pol()
2217 …12e2 * t3348 - 0.24e2 * t3350 + 0.60e2 * t3354 - 0.36e2 * t3356 + t2211 + t2213 + t2215 + t2298 - … in func_pol()
2242 …t3620 = t2213 + t2215 + t2298 - t3480 / 0.6e1 - t2876 + 0.384e3 * t3104 + 0.144e3 * t3106 + t2878 … in func_pol()
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| H A D | lda_c_vwn_2.c | 850 double t2187, t2189, t2194, t2199, t2202, t2207, t2210, t2213; in func_pol() local
1996 …t2213 = -0.8e1 / 0.27e2 * t2189 * t240 + 0.16e2 / 0.9e1 * t961 * t433 + 0.4e1 / 0.9e1 * t2194 * t2… in func_pol()
1997 t2214 = t53 * t2213; in func_pol()
2002 t2224 = t138 * t2213 * t68; in func_pol()
2005 t2232 = t117 * t2213; in func_pol()
2410 t4474 = t338 * t2213 * t76; in func_pol()
2414 t4537 = t383 * t2213 * t68; in func_pol()
2421 t4582 = t234 * t2213 * t78; 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 | 4122 double t2197, t2200, t2205, t2207, t2210, t2212, t2213, t2214; in func_pol() local
5526 t2213 = t82 * t2212; in func_pol()
5809 …t2873 = -0.12e2 * t674 * t1084 + 0.171e3 / 0.1000e4 * t2213 * t2841 - 0.12e2 * t225 * t2845 - 0.12… in func_pol()
6246 … 0.2e1 * t434 * t1112 + t4210 * t80 + t1542 * t263 + 0.171e3 / 0.1000e4 * t2213 * t4213 + t4246 * … in func_pol()
6660 …2254 * t1901 + t5289 * t104 - 0.6e1 * t5256 * t227 + 0.171e3 / 0.1000e4 * t2213 * t5293 - 0.9e1 / … in func_pol()
6758 …0e2 * t4194 * t474 + t274 * t5567 / 0.10e2 - t1559 + 0.171e3 / 0.1000e4 * t2213 * t5570 - 0.27e2 /… in func_pol()
8030 …1084 + 0.171e3 / 0.250e3 * t2213 * t4038 * t297 - 0.12e2 * t2247 * t1551 - 0.24e2 * t674 * t4099 +… in func_pol()
8207 …t2213 * t4627 * t297 + 0.171e3 / 0.500e3 * t6999 * t4604 - 0.12e2 * t2891 * t1350 - 0.6e1 * t1062 … in func_pol()
9151 …5144032920e-1 * t5110 * t1735 + 0.171e3 / 0.500e3 * t2213 * t1754 * t1412 + 0.171e3 / 0.500e3 * t2… in func_pol()
9600 …11329 * t1754 + 0.513e3 / 0.1000e4 * t8493 * t5906 + 0.513e3 / 0.1000e4 * t2213 * t1782 * t1590 - … in func_pol()
[all …]
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| H A D | mgga_c_revscan.c | 7154 t2213 = t540 * t221; in func_pol()
9487 t6745 = t2213 * t6744; in func_pol()
9919 t7391 = t2213 * t7390; in func_pol()
10036 t7563 = t2213 * t7562; in func_pol()
10233 t7873 = t2213 * t7872; in func_pol()
11131 t9777 = t9776 * t2213; in func_pol()
15740 t23784 = t2213 * t6740 * t6730; in func_pol()
16022 t24529 = t2213 * t7397 * t6730; in func_pol()
18399 t34567 = t2246 * t2213; in func_pol()
18899 t35529 = t2246 * t739 * t2213; in func_pol()
[all …]
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| H A D | hyb_mgga_x_js18.c | 5485 t2214 = t16 * t2213; in func_ferr()
5487 t2218 = t17 * t2213; in func_ferr()
5494 t2238 = t257 * t2213; in func_ferr()
5502 t2271 = t209 * t2213; in func_ferr()
5510 t2299 = t480 * t2213; in func_ferr()
6347 t5733 = t763 * t2213; in func_ferr()
6349 t5739 = t246 * t2213; in func_ferr()
6366 t5846 = t462 * t2213; in func_ferr()
6662 t6942 = t41 * t2213; in func_ferr()
6739 t7248 = t36 * t2213; in func_ferr()
[all …]
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| H A D | mgga_x_mbeef.c | 32020 t2213 = t81 * t2111; in func_pol()
33133 t6347 = t718 * t2213; in func_pol()
33134 t6350 = t711 * t2213; in func_pol()
33152 t6607 = t840 * t2213; in func_pol()
33153 t6610 = t844 * t2213; in func_pol()
33154 t6613 = t848 * t2213; in func_pol()
33155 t6616 = t852 * t2213; in func_pol()
33156 t6619 = t856 * t2213; in func_pol()
36187 t18165 = t2530 * t2213; in func_pol()
36188 t18168 = t2534 * t2213; in func_pol()
[all …]
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| H A D | mgga_c_pkzb.c | 2573 double t2204, t2207, t2210, t2213, t2214, t2215, t2216, t2221; in func_pol() local
5661 t2213 = t1316 * t2167; in func_pol()
7055 …+ 0.25724410870841842183e-2 * t1319 * t4631 - 0.64311027177104605458e-3 * t2213 * t4636 - 0.514488… in func_pol()
8182 …+ 0.85748036236139473944e-3 * t1319 * t7373 - 0.21437009059034868486e-3 * t2213 * t7378 - 0.800315… in func_pol()
8209 …44e-3 * t1319 * t7423 - 0.42874018118069736972e-3 * t2213 * t7428 - 0.21437009059034868486e-3 * t2… in func_pol()
8404 …t2213 * t7882 - 0.21437009059034868486e-3 * t2213 * t7887 - 0.42874018118069736972e-2 * t4605 * t7… in func_pol()
13665 …t2213 * t170 * t19118 + 0.68026775414003982663e-1 * t19122 + 0.25724410870841842183e-1 * t18151 * … in func_pol()
13687 …t2213 * t170 * t19219 + 0.25724410870841842183e-1 * t18222 * t170 * t2176 * t4433 + 0.257244108708… in func_pol()
15004 …2 * t170 * t28108 - 0.64311027177104605458e-3 * t2213 * t170 * t28224 - 0.21437009059034868486e-3 … in func_pol()
15036 …1027177104605458e-3 * t2213 * t170 * t28409 - 0.64311027177104605458e-3 * t2213 * t170 * t28413 - … in func_pol()
[all …]
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| H A D | mgga_x_vt84.c | 8380 t2214 = t487 * t2213; in func_pol()
9840 t5838 = t1273 * t2213; in func_pol()
9850 t5868 = t2213 * t40; in func_pol()
10571 t7807 = t1672 * t2213; in func_pol()
10591 t7883 = t45 * t2213; in func_pol()
10753 t8275 = t1969 * t2213; in func_pol()
12453 t17012 = t2213 * t489; in func_pol()
13381 t22685 = t81 * t2213; in func_pol()
13383 t22691 = t72 * t2213; in func_pol()
13392 t22767 = t486 * t2213; in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 2969 double t2211, t2213, t2215, t2217, t2223, t2224, t2226, t2227; in func_pol() local
4427 t2213 = t940 * t608; in func_pol()
4428 t2215 = t606 * t607 * t2213; in func_pol()
5600 t5876 = t606 * t1211 * t2213; in func_pol()
5602 t5879 = t606 * t1869 * t2213; in func_pol()
5662 t6009 = t606 * t2209 * t2213; in func_pol()
7624 t13286 = t606 * t4996 * t2213; in func_pol()
7630 t13305 = t606 * t4970 * t2213; in func_pol()
7643 … 0.2e1 * t13318 + t13322 - t1205 * t607 * t2213 * t1260 / 0.2e1 - t13328 - 0.3e1 / 0.2e1 * t606 * … in func_pol()
7826 t14352 = t606 * t5867 * t2213; in func_pol()
[all …]
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| H A D | mgga_x_m06l.c | 109 double t2200, t2202, t2205, t2211, t2213, t2214, t2216, t2217; in func_unpol() local
894 t2213 = t118 * t1540; in func_unpol()
895 t2214 = t2213 * t287; in func_unpol()
1221 …* t1902 + 0.1250016111180513792e-5 * t2454 * t4277 - 0.6694387022592e-3 * t2213 * t4214 + 0.625008… in func_unpol()
1439 double t2211, t2213, t2216, t2218, t2221, t2227, t2229, t2230; in func_ferr() local
2241 t2213 = t121 * t1559; in func_ferr()
2244 …t2206 - 0.2240712e-1 * t2209 + 0.418399188912e-4 * t2211 - 0.2240712e-1 * t2213 * t276 + 0.1673596… in func_ferr()
2552 …e-1 * t2208 * t4211 - 0.2091995944560e-3 * t3515 * t1864 + 0.8962848e-1 * t2213 * t4211 - 0.836798… in func_ferr()
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| H A D | mgga_x_rlda.c | 989 double t2203, t2208, t2213, t2229, t2257, t2258, t2267, t2277; in func_pol() local
2450 t2213 = t305 * t305; in func_pol()
2451 …3 - t8 * t235 * t60 * t2208 / 0.2e1 - 0.5e1 / 0.27e2 * t8 * t1400 * t38 * t2213 - 0.2e1 / 0.3e1 * … in func_pol()
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| H A D | mgga_x_2d_js17.c | 969 double t2145, t2146, t2151, t2178, t2199, t2203, t2213, t2221; in func_pol() local
2486 …t2213 = -t849 + t903 + t913 + 0.24e2 * t786 - 0.12e2 * t791 - 0.12e2 * t795 - 0.6e1 * t798 - 0.12e… in func_pol()
2489 v4rho4[3] = t2051 + t2203 + t2213 + t2221; in func_pol()
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| H A D | mgga_k_pc07.c | 137 double t2203, t2205, t2208, t2209, t2210, t2211, t2212, t2213; in func_unpol() local
1383 t2213 = t2208 * t2212; in func_unpol()
4061 double t2212, t2213, t2221, t2224, t2234, t2235, t2241, t2251; in func_ferr() local
5291 t2213 = t2168 + t2212; in func_ferr()
5332 t2385 = t133 * t2213; in func_ferr()
5339 t2421 = -t2213; in func_ferr()
6441 t7612 = t309 * t2213; in func_ferr()
6549 t8180 = t318 * t2213; in func_ferr()
7200 t12642 = t439 * t2213; in func_ferr()
7241 t12970 = t74 * t2213; in func_ferr()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_hcth_a.c | 116 double t2178, t2210, t2213, t2218, t2242, t2245, t2250; in func_unpol() local
854 t2213 = t61 * t1195; in func_unpol()
857 …t2213 * t890 - 0.20436811776000000000e0 * t2218 * t1653) + t252 * t1241 + t97 * (-0.11261431296e-3… in func_unpol()
1443 double t2200, t2204, t2212, t2213, t2214, t2215, t2216, t2233; in func_pol() local
3126 t2213 = t2204 + t2212; in func_pol()
3127 t2214 = t2213 * t246; in func_pol()
4733 t5880 = t2213 * t603; in func_pol()
5003 t6581 = t2213 * t745; in func_pol()
5108 t6789 = t2213 * t774; in func_pol()
5137 t6847 = t2213 * t802; in func_pol()
[all …]
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| H A D | gga_x_g96.c | 456 double t2205, t2213, t2215, t2222, t2225, t2234, t2237, t2241; in func_pol() local
1492 …t2213 = -0.2e1 / 0.411e3 * t2179 * t292 * t514 - t2184 - t769 * t292 * t490 / 0.411e3 - 0.4e1 / 0.… in func_pol()
1494 v4rho3sigma[3] = t2178 + t2213; in func_pol()
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| H A D | gga_c_am05.c | 901 double t2199, t2204, t2205, t2210, t2211, t2213, t2214, t2215; in func_pol() local
1986 t2213 = t2139 * t82; in func_pol()
1987 t2214 = 0.384e3 * t2213; in func_pol()
2097 t2539 = 0.192e3 * t2213; in func_pol()
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| H A D | gga_k_mpbe.c | 767 double t2198, t2213, t2224, t2227, t2230, t2232, t2235, t2238; in func_pol() local
1724 …t2213 = 0.4e1 / 0.3e1 * t910 - 0.2e1 / 0.9e1 * t914 + 0.16e2 / 0.9e1 * t917 + 0.4e1 / 0.3e1 * t920… in func_pol()
1727 v4rho4[2] = t2186 + t2198 + t2213 + t2224; in func_pol()
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| H A D | gga_c_revtca.c | 453 double t2132, t2155, t2161, t2188, t2213, t2230, t2235, t2248; in func_ferr() local
1035 t2213 = t2031 * t126; in func_ferr()
1038 …t2213 - 0.50721590171852658857e-1 * t111 * t1453 * t2213 - 0.13924516736398761102e-3 * t147 * t486… in func_ferr()
1227 double t2199, t2200, t2203, t2208, t2211, t2213, t2215, t2216; in func_pol() local
3060 t2213 = t192 * t193 * t2211; in func_pol()
3061 t2215 = 0.2e1 / 0.3e1 * t191 * t2213; in func_pol()
5010 t7826 = 0.32e2 / 0.9e1 * t504 * t2213; in func_pol()
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| H A D | gga_c_op_pbe.c | 768 double t2198, t2201, t2202, t2213, t2214, t2218, t2219, t2222; in func_pol() local
2160 …t2213 = 0.25246924759944584825e1 * t1495 * t2198 - 0.42078207933240974708e0 * t495 * t2202 + 0.598… in func_pol()
2161 t2214 = t112 * t2213; in func_pol()
3565 …0000000000000e0 * t4844 * t490 - 0.90481461500000000000e0 * t164 * t287 * t2213 - 0.90481461500000… in func_pol()
3635 t7726 = t292 * t2213; in func_pol()
3751 …000000000000e1 * t1202 * t2150 - 0.27144438450000000000e1 * t164 * t339 * t2213 + 0.45000000000000… in func_pol()
4472 t12422 = t24 * t111 * t2213; in func_pol()
4481 …954595916211e-4 * t2186 * t702 - 0.10000000000000000000e1 * t350 * t489 * t2213 - 0.20000000000000… in func_pol()
4538 …000000000000e1 * t1202 * t3146 - 0.50000000000000000000e0 * t350 * t553 * t2213 - 0.10000000000000… in func_pol()
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| H A D | gga_c_op_b88.c | 761 double t2209, t2210, t2213, t2219, t2220, t2223, t2224, t2227; in func_pol() local
2051 t2213 = t371 * t733; in func_pol()
2056 …18005769000000000000e1 * t370 * t2210 - 0.90028845000000000000e0 * t370 * t2213 + 0.40012820000000… in func_pol()
3396 t7487 = 0.36011538000000000000e1 * t1228 * t2213; in func_pol()
3398 …000000000000000000e1 * t1364 * t2176 - 0.18005769000000000000e1 * t1055 * t2213 - 0.50000000000000… in func_pol()
3528 …t8365 = -0.18005769000000000000e1 * t1280 * t2213 - t7225 + t7231 - 0.20000000000000000000e1 * t83… in func_pol()
4066 …00000000000e0 * t7330 * t3065 - 0.40012820000000000000e0 * t1902 * t953 * t2213 - 0.20006410000000… in func_pol()
4156 …0000e0 * t1911 * t3466 * t625 - 0.20006410000000000000e0 * t1902 * t933 * t2213 - 0.20006410000000… in func_pol()
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| H A D | gga_c_zvpbeint.c | 1164 double t2205, t2208, t2211, t2213, t2218, t2234, t2236, t2237; in func_ferr() local
1991 t2213 = t448 * t1 * t111; in func_ferr()
2044 … 0.3e1 / 0.128e3 * t957 * t2830 * t960 + 0.9e1 / 0.128e3 * t969 * t2839 * t2213 + 0.3e1 / 0.128e3 … in func_ferr()
2275 double t2202, t2206, t2207, t2210, t2213, t2215, t2218, t2220; in func_pol() local
4548 t2213 = t139 * t636; in func_pol()
4549 t2215 = t770 * t771 * t2213; in func_pol()
4856 t2780 = t770 * t1043 * t2213; in func_pol()
6972 …0 * t6357 - t768 * t1042 * t6362 * t348 / 0.768e3 + t768 * t770 * t2170 * t2213 / 0.128e3 - 0.7e1 … in func_pol()
6989 …* t6393 + t1040 * t1042 * t6362 * t1044 / 0.384e3 + t768 * t770 * t2200 * t2213 / 0.128e3 - 0.3e1 … in func_pol()
7627 ….1024e4 - t768 * t1042 * t1043 * t2097 / 0.3072e4 + t768 * t770 * t2758 * t2213 / 0.256e3 + t768 *… in func_pol()
[all …]
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| H A D | gga_x_ityh.c | 122 double t2190, t2197, t2206, t2207, t2208, t2213, t2220, t2225; in func_unpol() local
942 t2213 = t273 * t443; in func_unpol()
979 …87 * t929 - 0.2e1 / 0.3e1 * t93 * t2208 - 0.4e1 * t1083 * t340 - 0.18e2 * t2213 * t281 - 0.32e2 / … in func_unpol()
1153 …79 + 0.8e1 / 0.3e1 * t93 * t3942 - 0.2e1 / 0.3e1 * t1627 * t340 - 0.3e1 * t2213 * t640 + 0.8e1 / 0… in func_unpol()
2524 double t2189, t2191, t2200, t2202, t2207, t2211, t2212, t2213; in func_pol() local
3814 t2213 = t752 / 0.3e1; in func_pol()
3815 …t2216 = -t717 - t2212 - t2213 - t810 - t758 - t762 - t769 - t821 + t784 - t789 - t796 + t2076 - t5… in func_pol()
3868 …8 - t1020 - t1016 - t1012 - t792 / 0.2e1 - t799 / 0.2e1 + t2067 - t2212 - t2213 - 0.2e1 / 0.3e1 * … in func_pol()
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| H A D | gga_x_lg93.c | 1008 double t2207, t2209, t2210, t2211, t2212, t2213, t2214, t2215; in func_pol() local
2622 t2213 = t623 * t2212; in func_pol()
2623 t2214 = t704 * t2213; in func_pol()
3437 t6540 = t1787 * t2213; in func_pol()
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| H A D | gga_x_q2d.c | 1123 double t2209, t2210, t2211, t2212, t2213, t2214, t2215, t2216; in func_pol() local
2658 t2213 = t369 * t838; in func_pol()
2659 t2214 = t2213 / 0.3072e4; in func_pol()
3451 t5969 = t2213 / 0.1536e4; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
| H A D | mgga_x_tb09.c | 4190 double t2199, t2200, t2205, t2207, t2209, t2212, t2213, t2214; in func_pol() local
5743 t2213 = t1265 * t2209 * t2212; in func_pol()
5744 t2214 = t2207 * t2213; in func_pol()
5756 … / 0.9e1 * t2214 * t2218 + 0.46e2 / 0.9e1 * t2214 * t2224 - 0.24e2 * t2227 * t2213 * t2228 - t2234; in func_pol()
5782 …t2213 * t2243 - 0.4e1 * t2214 * t2248 + 0.56e2 / 0.3e1 * t2214 * t2251 - 0.8e1 / 0.3e1 * t414 * t2… in func_pol()
8464 … * t1778 + 0.12e2 * t2242 * t2213 * t12423 + 0.8e1 * t2273 * t1779 + 0.12e2 * t2279 * t2213 * t124… in func_pol()
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