| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mn12.c | 205 double t8251, t8271, t8275, t8278, t8287, t8292, t8297, t8312; in func_unpol() local
1770 t8297 = t48 * t770 * t10; in func_unpol()
1771 …8292 + 0.800e3 / 0.3e1 * t202 * t2648 * t8297 + 0.520e3 / 0.9e1 * t2147 * t3341 + 0.800e3 * t205 *… in func_unpol()
1772 …1 * t178 * t3345 * t4241 + 0.800e3 / 0.3e1 * t175 * t2648 * t8297 + 0.800e3 * t178 * t2648 * t8297; in func_unpol()
1783 …3341 + 0.800e3 / 0.3e1 * t107 * t2648 * t8297 + 0.520e3 / 0.9e1 * t2132 * t3341 + 0.800e3 * t110 *… in func_unpol()
1786 …t145 * t8271 + 0.800e3 * t147 * t2648 * t8297 + 0.800e3 * t3526 * t8371 + 0.800e3 / 0.3e1 * t144 *… in func_unpol()
1787 …3341 + 0.800e3 / 0.3e1 * t161 * t2648 * t8297 + 0.520e3 / 0.9e1 * t2010 * t3341 + 0.800e3 * t164 *… in func_unpol()
3855 double t8285, t8290, t8294, t8296, t8297, t8301, t8304, t8332; in func_pol() local
6655 t8297 = t1121 * t2042; in func_pol()
6660 …v3rho2sigma[2] = -0.4e1 / 0.3e1 * t8290 - t8294 - t8296 - t1040 * t2244 * t8297 / 0.6e1 - t1040 * … in func_pol()
[all …]
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| H A D | hyb_mgga_x_m05.c | 2364 double t8264, t8275, t8276, t8286, t8291, t8296, t8297, t8317; in func_pol() local
5371 t8297 = t609 * t3486; in func_pol()
5377 …t8337 = 0.21021924538451568254e-1 * t8297 + 0.15766443403838676191e-1 * t1164 * t222 * t226 * t827… in func_pol()
5398 …v4rho3tau[4] = -0.4e1 / 0.9e1 * t8318 - t8275 + 0.21021924538451568255e-1 * t8297 - t8333 - 0.4e1 … in func_pol()
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| H A D | mgga_x_sa_tpss.c | 7753 double t8274, t8278, t8282, t8285, t8289, t8296, t8297, t8310; in func_pol() local
11583 t8297 = t37 * t817; in func_pol()
11626 …t8494 = -0.4e1 / 0.9e1 * t4632 * t768 * t8297 * t386 + 0.4e1 / 0.15e2 * t284 * t3336 * t2996 * t38… in func_pol()
12342 …10114 + 0.5e1 / 0.486e3 * t3280 * t10116 - 0.4e1 / 0.9e1 * t4632 * t768 * t8297 * t646 - 0.5e1 / 0… in func_pol()
14575 …t8297 * t1023 - 0.5e1 / 0.243e3 * t11781 * t22713 + 0.5e1 / 0.486e3 * t3280 * t22846 - 0.5e1 / 0.2… in func_pol()
15429 …27429 + 0.5e1 / 0.486e3 * t3280 * t27429 - 0.4e1 / 0.9e1 * t4632 * t768 * t8297 * t1787 - 0.4e1 / … in func_pol()
15713 …27822 + 0.5e1 / 0.162e3 * t3280 * t29075 - 0.4e1 / 0.3e1 * t4632 * t768 * t8297 * t2191 + t255 * t… in func_pol()
16385 … 0.5e1 / 0.81e2 * t3625 * t3004 * t30165 - 0.4e1 / 0.9e1 * t4632 * t768 * t8297 * t2505 + 0.5e1 / … in func_pol()
16390 …843 - 0.10e2 / 0.729e3 * t3633 * t32393 + 0.4e1 / 0.3e1 * t14352 * t768 * t8297 * t2412 - 0.5e1 / … in func_pol()
16686 … + 0.2e1 * t14352 * t768 * t29110 * t646 - 0.4e1 / 0.3e1 * t4632 * t768 * t8297 * t2796 - 0.2e1 / … in func_pol()
[all …]
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| H A D | hyb_mgga_xc_wb97mv.c | 4384 double t8291, t8292, t8295, t8296, t8297, t8300, t8301, t8302; in func_pol() local
10028 t8297 = t994 * t8296; in func_pol()
10042 …t8297 - 0.91420000000000000000e1 * t8300 * t8302 + 0.10970400000000000000e2 * t8305 * t8307 - 0.14… in func_pol()
17686 …40000000000000e-2 * t6416 * t36324 + 0.54140928000000000000e-4 * t36328 * t8297 + 0.15039146666666… in func_pol()
17695 …000000e-3 * t1897 * t36327 * t8292 - 0.50551603200000000000e-3 * t36355 * t8297 - 0.46807040000000… in func_pol()
17756 …3 * t1933 * t36667 * t8292 + 0.58976870400000000000e-3 * t1904 * t36667 * t8297 - 0.46807040000000… in func_pol()
17761 …4 * t1915 * t36667 * t8292 - 0.81211392000000000000e-4 * t1886 * t36667 * t8297 + 0.35088e2 * t363… in func_pol()
20268 …t8297 + 0.27070464000000000000e-4 * t54977 * t8297 + 0.27070464000000000000e-4 * t54980 * t8292 - … in func_pol()
20279 …t55053 = -0.40605696000000000000e-4 * t55010 * t8297 - 0.54852000000000000000e2 * t54966 * t8302 +… in func_pol()
20533 …888 * t1866 + 0.27070464000000000000e-4 * t56465 * t8297 - 0.40605696000000000000e-4 * t56469 * t8… in func_pol()
[all …]
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| H A D | mgga_x_regtpss.c | 344 double t8255, t8292, t8297, t8300, t8305, t8308, t8312, t8321; in func_unpol() local
3124 t8297 = t768 * t768; in func_unpol()
3126 …* t523 - 0.73e2 / 0.97200e5 * t6181 * t322 + 0.73e2 / 0.194400e6 * t522 * t8297 - 0.73e2 / 0.97200… in func_unpol()
8768 double t8297, t8304, t8310, t8313, t8314, t8322, t8323, t8326; in func_pol() local
13008 t8297 = t8296 * t219; in func_pol()
13015 …0 * t2645 - 0.14468712037037037037e1 * t2674 + 0.646416e0 * t8297 - 0.646416e0 * t824 * t8297 + 0.… in func_pol()
16261 …46998774363698034139e1 * t7811 * t8338 * t22090 - 0.43094400000000000000e0 * t2187 * t1387 * t8297; in func_pol()
17324 …73436458e0 * t15554 * t8413 + 0.80802000000000000000e-1 * t2676 * t2677 * t8297 + 0.10773600000000… in func_pol()
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| H A D | mgga_xc_b98.c | 5870 double t8291, t8293, t8294, t8295, t8297, t8298, t8299, t8301; in func_pol() local
11621 t8297 = t26 * t598; in func_pol()
11622 t8298 = t8297 * t291; in func_pol()
17405 t27675 = t8297 * t1471; in func_pol()
17631 t29215 = t8297 * t2208; in func_pol()
18619 t35794 = t8297 * t299; in func_pol()
18629 …t35877 = -0.41152256229995427525e-5 * t35834 * t8158 * t8297 - 0.54531265990970582467e-9 * t16414 … in func_pol()
18982 t37374 = t35834 * t9143 * t8297; in func_pol()
20085 t43551 = t8297 * t14608; in func_pol()
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| H A D | mgga_c_m05.c | 3423 double t8289, t8290, t8291, t8292, t8293, t8297, t8298, t8301; in func_pol() local
8598 t8297 = t2031 * t163; in func_pol()
8599 t8298 = t8297 * sigma[2]; in func_pol()
12910 …t8297 - 0.6560e4 / 0.9e1 * t380 * t30260 + 0.6272e4 / 0.3e1 * t1528 * t30264 - 0.6848e4 / 0.3e1 * … in func_pol()
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| H A D | mgga_x_rscan.c | 447 double t8297, t8301, t8303, t8305, t8308, t8311, t8312, t8315; in func_unpol() local
4233 t8297 = t253 * t2575 * t255 * t258; in func_unpol()
4235 …86 - 0.15e2 / 0.4e1 * t8289 - 0.361e3 / 0.64e2 * t8293 + 0.9e1 / 0.32e2 * t8297 + 0.533e3 / 0.144e… in func_unpol()
4410 …t9738 = 0.18759375000000000000e0 * t8297 + 0.24688263888888888889e1 * t8301 + 0.150075000000000000… in func_unpol()
14667 double t8294, t8297, t8298, t8303, t8304, t8307, t8310, t8315; in func_pol() local
20005 t8297 = t518 * t164; in func_pol()
20006 t8298 = t5647 * t8297; in func_pol()
24475 t22219 = t8003 * t8297; in func_pol()
24478 t22236 = t22235 * t8297; in func_pol()
24493 t22281 = t18301 * t8297; in func_pol()
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| H A D | mgga_x_m11_l.c | 4250 double t8297, t8299, t8304, t8306, t8310, t8313, t8314, t8318; in func_pol() local
7147 t8297 = t210 * t7669 * t1029; in func_pol()
7151 …91 * t8288 - 0.16e2 / 0.243e3 * t210 * t2711 * t8292 + 0.16e2 / 0.729e3 * t8297 - 0.8e1 / 0.81e2 *… in func_pol()
7554 …t3109 * t9509 + 0.4e1 / 0.81e2 * t210 * t891 * t9513 + 0.32e2 / 0.729e3 * t8297 + 0.4e1 / 0.81e2 *… in func_pol()
7914 …6 * t11280 - 0.16e2 / 0.81e2 * t210 * t2711 * t11284 + 0.16e2 / 0.243e3 * t8297 + 0.4e1 / 0.81e2 *… in func_pol()
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| H A D | mgga_c_revtpss.c | 5032 double t8291, t8292, t8294, t8297, t8300, t8301, t8302, t8304; in func_pol() local
13358 t8297 = t1988 * t607; in func_pol()
13384 … - 0.12862205435420921092e-2 * t8294 * t593 + 0.85748036236139473944e-3 * t8297 * t613 + 0.1714960… in func_pol()
14441 … 0.85748036236139473944e-3 * t11063 * t1869 + 0.28582678745379824648e-3 * t8297 * t1132 + 0.114330… in func_pol()
23637 t35972 = t8297 * t1882; in func_pol()
23693 …+ 0.68598428988911579156e-2 * t1878 * t8383 - 0.34299214494455789578e-2 * t8297 * t1936 + 0.182929… in func_pol()
25521 t46348 = t8297 * t3238; in func_pol()
25676 … 0.85748036236139473944e-3 * t11109 * t8358 + 0.14291339372689912324e-2 * t8297 * t3244 + 0.142913… in func_pol()
25735 … 0.28582678745379824648e-3 * t36922 * t1132 + 0.17149607247227894789e-2 * t8297 * t3196 - 0.434456… in func_pol()
27162 …t36102 - 0.19055119163586549765e-3 * t36145 + 0.28582678745379824648e-3 * t8297 * t4320 + 0.571653… in func_pol()
[all …]
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| H A D | mgga_c_pkzb.c | 2914 double t8282, t8287, t8290, t8292, t8293, t8296, t8297, t8302; in func_pol() local
8517 t8297 = t8296 * t700; in func_pol()
8671 …0000000000000000000e1 * t683 * t8293 + 0.32163958997385070134e2 * t1902 * t8297 + 0.32163958997385… in func_pol()
14240 …t22880 = 0.64327917994770140268e2 * t5413 * t8297 - 0.40000000000000000000e1 * t1853 * t8293 * t70… in func_pol()
15136 …t29237 = -0.3e1 * t129 * t10517 * t16443 * t763 + 0.96491876992155210402e2 * t6059 * t8297 + 0.192… in func_pol()
15292 …3128080361e4 * t23549 * t6050 * t700 - 0.57895126195293126241e3 * t6419 * t8297 + 0.18000000000000… in func_pol()
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| H A D | mgga_c_vsxc.c | 3532 double t8297, t8299, t8301, t8303, t8305, t8308, t8310, t8311; in func_pol() local
8566 t8297 = t583 * t2605; in func_pol()
8570 … * t8293 + 0.20102474373365668834e1 * t8295 - 0.15545350000000000000e-1 * t8297 - 0.62500000000000… in func_pol()
12487 t25932 = 0.31090700000000000000e-1 * t8297; in func_pol()
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| H A D | mgga_x_mggac.c | 443 double t8289, t8290, t8293, t8296, t8297, t8300, t8301, t8306; in func_unpol() local
4727 t8297 = t4085 * t8296; in func_unpol()
4734 …1 * t2518 * t8286 - t628 * t8290 / 0.6e1 + t628 * t8293 / 0.6e1 + t3214 * t8297 / 0.2e1 + t3214 * … in func_unpol()
4737 …* t2556 * t8286 - t733 * t8290 / 0.12e2 + t733 * t8293 / 0.12e2 + t3232 * t8297 / 0.6e1 + t3232 * … in func_unpol()
9587 …t35915 = t13229 * t8297 / 0.2e1 + t3214 * t35877 / 0.2e1 + t3214 * t35698 / 0.2e1 - t5876 * t5737 … in func_unpol()
9963 ….3e1 / 0.2e1 * t3214 * t38745 - t3214 * t38749 + 0.2e1 / 0.9e1 * t12540 * t8297 + t2837 * t8213 / … in func_unpol()
10043 …6e1 + t6854 * t31247 / 0.4e1 + 0.46e2 / 0.9e1 * t6582 * t29890 + t12826 * t8297 / 0.6e1 - 0.38e2 /… in func_unpol()
24141 double t8295, t8296, t8297, t8298, t8299, t8300, t8301, t8302; in func_pol() local
33881 t8297 = t8296 / 0.2e1; in func_pol()
33897 …t8313 = -t8279 + t8282 + t8286 + t8288 + t8291 - t8297 + t8299 - t8301 + t8304 + t8307 + t8310 + t… in func_pol()
[all …]
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| H A D | mgga_c_scan.c | 3950 double t8297, t8298, t8299, t8301, t8303, t8304, t8306, t8307; in func_pol() local
9741 t8297 = t2344 * t409; in func_pol()
9742 t8298 = t2005 * t8297; in func_pol()
16873 t30288 = t23257 * t8297; in func_pol()
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| H A D | mgga_k_pc07.c | 8222 double t8273, t8278, t8286, t8289, t8297, t8298, t8301, t8302; in func_pol() local
12266 t8297 = t617 * t617; in func_pol()
12267 t8298 = t631 * t8297; in func_pol()
12270 t8310 = t622 * t8297; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_pmgb06.c | 1792 double t8295, t8297, t8298, t8299, t8300, t8302, t8304, t8306; in func_pol() local
6582 t8297 = t131 * t3640; in func_pol()
6586 t8302 = t30 * t8297 * t8300; in func_pol()
7897 t11523 = t30 * t8297 * t11521; in func_pol()
9179 t15049 = t30 * t8297 * t14994; in func_pol()
10509 t18557 = t30 * t8297 * t18555; in func_pol()
11221 t21205 = t30 * t8297 * t21203; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_sfat_pbe.c | 3504 double t8285, t8292, t8297, t8302, t8307, t8308, t8313, t8338; in func_pol() local
6696 t8297 = t8187 * t1147; in func_pol()
6697 …01e-7 * t8292 * t8218 + 0.38034830184838378571e-6 * t8297 * t8209 + 0.11767911123746435290e-5 * t8… in func_pol()
6704 …324886606602e0 * t3110 * t18 * t342 * t1128 + 0.91024287175336279503e-6 * t8297 * t8200 - 0.128773… in func_pol()
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| H A D | gga_x_ityh.c | 2688 double t8262, t8267, t8276, t8285, t8287, t8290, t8295, t8297; in func_pol() local
5227 t8297 = t145 * t8295 * t152; in func_pol()
5230 …t8329 = -0.3e1 / 0.4e1 * t8287 + t8290 / 0.4e1 - t497 * t1025 * t2010 / 0.2e1 - t8297 - 0.3e1 * t1… in func_pol()
5280 …t8573 = -t145 * t765 * t1176 * t767 - t8297 / 0.3e1 - t145 * t8267 * t276 / 0.2e1 + 0.2e1 / 0.9e1 … in func_pol()
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| H A D | gga_xc_b97.c | 2038 double t8296, t8297, t8308, t8313, t8327, t8330, t8333, t8339; in func_pol() local
6230 t8297 = t8296 * sigma[0]; in func_pol()
6231 …2000000000000000e-10 * t329 * t2688 + 0.11664000000000000000e-12 * t329 * t8297 - 0.51840000000000… in func_pol()
6236 …t8339 = -0.46656000000000000000e-12 * t678 * t8297 - 0.77760000000000000000e-13 * t336 * t2701 + 0… in func_pol()
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| H A D | gga_c_pbe_vwn.c | 2192 double t8272, t8274, t8293, t8295, t8297, t8300, t8302, t8309; in func_pol() local
5600 …t8297 = -t1111 * t919 * t3218 * t907 / 0.384e3 - 0.3e1 / 0.256e3 * t2689 * t1113 * t3184 * t2690 -… in func_pol()
5621 …0.2304e4 * t7214 - 0.7e1 / 0.288e3 * t7216 + 0.119e3 / 0.6912e4 * t8037 + t8297 - 0.7e1 / 0.288e3 … in func_pol()
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| H A D | gga_c_regtpss.c | 2658 double t8297, t8302, t8311, t8313, t8314, t8318, t8319, t8321; in func_pol() local
6937 t8297 = t171 * t355 * t124 * t3170; in func_pol()
6938 …756347548806534796e1 * t1185 * t2840 * t761 - 0.16463622957338778996e-1 * t8297 + 0.78059524315062… in func_pol()
7730 …170898365871023197e1 * t306 * t365 * t10240 - 0.10975748638225852664e-1 * t8297 + 0.52039682876708… in func_pol()
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| H A D | gga_c_optc.c | 2648 double t8292, t8295, t8296, t8297, t8300, t8301, t8302, t8305; in func_pol() local
8073 t8297 = t153 * t8296; in func_pol()
8083 …99677793353920977e-1 * t1635 * t8292 - 0.54332259311179736592e-2 * t531 * t8297 - 0.27166129655589… in func_pol()
8140 …6845350037036744e-1 * t1816 * t8094 - 0.30228422675018518372e-1 * t1816 * t8297 + 0.34772645959155… in func_pol()
13585 t25215 = t5994 * t8297; in func_pol()
13626 t25415 = t1644 * t8297; in func_pol()
18667 t54209 = t4569 * t8297; in func_pol()
18720 t54312 = t15633 * t8297; in func_pol()
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| H A D | gga_x_gg99.c | 3827 double t8292, t8297, t8299, t8306, t8316, t8322, t8323, t8325; in func_pol() local
7907 t8297 = t2565 * t2586; in func_pol()
7910 …3 * t529 - 0.8e1 / 0.27e2 * t2569 * t98 * t8292 * t529 - 0.4e1 / 0.27e2 * t8297 - 0.8e1 / 0.27e2 *… in func_pol()
8017 …t9009 = 0.16e2 / 0.81e2 * t8268 - 0.16e2 / 0.81e2 * t8273 - 0.8e1 / 0.81e2 * t8297 - 0.16e2 / 0.81… in func_pol()
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| H A D | gga_c_zvpbeloc.c | 2387 double t8297, t8301, t8307, t8311, t8315, t8319, t8322, t8325; in func_pol() local
6671 t8297 = t237 * t565; in func_pol()
6679 … t8293 + 0.40e2 / 0.81e2 * t7227 * t405 * t1859 - 0.8e1 / 0.9e1 * t2760 * t8297 - 0.16e2 / 0.9e1 *… in func_pol()
6764 … t8526 - 0.28e2 / 0.81e2 * t7124 * t405 * t1859 + 0.4e1 / 0.9e1 * t2688 * t8297 + 0.2e1 * t2691 * … in func_pol()
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| H A D | gga_c_gaploc.c | 3316 double t8297, t8320, t8331, t8352, t8361, t8366, t8401, t8428; in func_ferr() local
5678 t8297 = t8035 * t313; in func_ferr()
5679 …338e0 * t1109 * t2160 * t3106 + 0.34508633358528674709e2 * t444 * t1099 * t8297 - 0.10725146985555… in func_ferr()
5692 …1110256002e1 * t2231 * t3502 + 0.21450293971110256002e1 * t1043 * t1110 * t8297 + 0.21450293971110… in func_ferr()
5749 …68897136e-1 * t9266 * t1188 + 0.46143157380853345701e-1 * t1154 * t1226 * t8297 + 0.61524209841137… in func_ferr()
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