/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_xc_b97mv.c | 6678 t3138 = t3137 * t184; in func_pol() 9544 t9660 = t3137 * t334; in func_pol() 10153 t11372 = t1030 * t3137; in func_pol() 10729 t12859 = t3342 * t3137; in func_pol() 10739 t12894 = t3359 * t3137; in func_pol() 12995 t21975 = t3137 * t653; in func_pol() 12998 t21983 = t3137 * t648; in func_pol() 13412 t25690 = t3137 * t876; in func_pol() 14084 t30518 = t656 * t3137; in func_pol() 14085 t30521 = t662 * t3137; in func_pol() [all …]
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H A D | mgga_x_rlda.c | 1004 double t3137, t3138, t3140, t3157, t3162, t3163, t3175, t3190; in func_pol() local 2880 t3137 = t2418 * t479 / 0.6e1; in func_pol() 2885 …v4rho2tau2[0] = -t3137 - 0.4e1 / 0.3e1 * t3138 - t3140 - t145 * t256 * t478 * t180 / 0.6e1 - t145 … in func_pol() 2897 …v4rho2tau2[3] = -t3137 - 0.2e1 / 0.3e1 * t3138 - t3140 / 0.2e1 - 0.2e1 / 0.3e1 * t3175 - t963 * t1… in func_pol() 2908 …v4rho2tau2[6] = -t3137 - 0.4e1 / 0.3e1 * t3175 - t145 * t256 * t478 * t305 / 0.6e1 - t145 * t360 *… in func_pol()
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H A D | mgga_x_m08.c | 116 double t3136, t3137, t3141, t3178, t3185, t3216, t3240, t3241; in func_unpol() local 960 t3137 = 0.1e1 / t3136; in func_unpol() 1102 …t3137 * t105 + t110 * (t3178 + t3216 + t3268 + t3327 + t3382 + t3434 + t3479 + t3521) + t30 * (t35… in func_unpol() 1457 double t3134, t3137, t3140, t3147, t3152, t3157, t3162, t3165; in func_ferr() local 2290 t3137 = t1388 * t2377; in func_ferr() 2297 …0.56000e5 * t275 * t3137 - 0.224000e6 / 0.9e1 * t123 * t3140 - 0.140000e6 / 0.9e1 * t1793 * t3134 … in func_ferr() 2324 … t3140 - 0.112000e6 / 0.3e1 * t126 * t3283 - 0.224000e6 / 0.9e1 * t1708 * t3137 - 0.896000e6 / 0.9… in func_ferr() 2330 …* t3157 - 0.16000e5 / 0.9e1 * t1692 * t3147 - 0.140000e6 / 0.9e1 * t120 * t3137 - 0.80000e5 / 0.9e… in func_ferr() 2342 … 0.56000e5 * t197 * t3137 - 0.224000e6 / 0.9e1 * t66 * t3140 - 0.140000e6 / 0.9e1 * t1521 * t3134 … in func_ferr() 2353 …0e5 / 0.81e2 * t169 * t3252 - 0.100000e6 / 0.3e1 * t190 * t3134 - 0.140000e6 / 0.9e1 * t60 * t3137; in func_ferr() [all …]
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H A D | mgga_c_kcis.c | 9080 t3137 = t43 * t6; in func_pol() 9081 t3138 = t3136 * t3137; in func_pol() 9452 t3864 = t3863 * t3137; in func_pol() 10670 t6667 = t3137 * t6666; in func_pol() 10676 t6676 = t3137 * t6675; in func_pol() 17899 t24528 = t3137 * t6731; in func_pol() 17903 t24535 = t3137 * t6742; in func_pol() 27777 t85403 = t3137 * t85402; in func_pol() 27951 t85900 = t3137 * t24508; in func_pol() 27953 t85903 = t3137 * t24500; in func_pol() [all …]
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H A D | mgga_c_vsxc.c | 3210 double t3133, t3135, t3137, t3138, t3139, t3141, t3142, t3145; in func_pol() local 5931 t3137 = 0.1e1 / t851 / tau[0]; in func_pol() 5932 t3138 = t101 * t3137; in func_pol() 9539 t9744 = t102 * t3137; in func_pol() 9546 t9751 = t387 * t3137; in func_pol() 10080 t10443 = t766 * t3137; in func_pol() 13172 t31049 = t1348 * t1349 * t3137; in func_pol() 13189 …000e-1 * t287 * t9720 + 0.77726750000000000000e-2 * t247 * t386 * t1370 * t3137 - 0.77726750000000… in func_pol() 13768 …000000000e-2 * t529 * t10443 + 0.38863375000000000000e-2 * t247 * t2311 * t3137 - 0.62500000000000… in func_pol() 13782 ….19431687500000000000e-2 * t247 * t33758 * t388 - 0.38863375000000000000e-2 * t247 * t2315 * t3137; in func_pol() [all …]
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H A D | mgga_x_gx.c | 2451 double t3135, t3137, t3139, t3140, t3143, t3145, t3147, t3149; in func_pol() local 4420 t3137 = t1701 * t3111; in func_pol() 4429 … / 0.9e1 * t2603 * t363 - 0.25e2 / 0.324e3 * t3135 - 0.125e3 / 0.7776e4 * t3137 + t3145 * t117 - 0… in func_pol() 5943 …8e3 * t7727 * t800 + 0.50e2 / 0.81e2 * t7533 * t938 - 0.125e3 / 0.162e3 * t3137 + 0.125e3 / 0.162e… in func_pol()
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H A D | mgga_x_sa_tpss.c | 174 double t3126, t3128, t3130, t3131, t3132, t3133, t3135, t3137; in func_unpol() local 1656 t3137 = t814 * t150; in func_unpol() 1657 t3139 = t2056 * t2048 * t3137; in func_unpol() 1873 …e4 * t1161 - 0.65e2 / 0.8748e4 * t1167 - 0.5e1 / 0.81e2 * t2056 * t2641 * t3137 + 0.2e1 / 0.81e2 *… in func_unpol() 2846 …18e2 - t3124 * t281 * t8191 / 0.81e2 - 0.20e2 / 0.243e3 * t2056 * t7081 * t3137 + 0.5e1 / 0.162e3 … in func_unpol() 3417 … / 0.45e2 * t162 * t545 * t4865 * t267 + 0.25e2 / 0.9e1 * t6407 * t1423 * t3137 - 0.25e2 / 0.108e3… in func_unpol() 3897 double t3113, t3115, t3118, t3120, t3125, t3131, t3137, t3138; in func_ferr() local 5292 t3137 = t1189 * t1682; in func_ferr() 5293 t3138 = t3137 * t711; in func_ferr() 6450 t8487 = t3137 * t1899; in func_ferr() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_k_pw86.c | 581 double t3125, t3126, t3132, t3137, t3190, t3198, t3206, t3214; in func_pol() local 1744 t3137 = 0.17822885858826970813e-6 * t963 * t1164; in func_pol() 1746 …* t3126 * t1156 * t128 - t3132 - 0.7e1 / 0.75e2 * t1001 * t1002 * t1105 + t3137 + 0.17822885858826… in func_pol() 1776 …179 * t415 * t427 * t451 - 0.7e1 / 0.125e3 * t179 * t415 * t199 * t1141 + t3137 + 0.17822885858826… in func_pol()
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H A D | gga_c_regtpss.c | 1026 t3137 = t5 * t191; in func_unpol() 2097 t3137 = t1406 * t72; in func_ferr() 6423 t6607 = t3137 * t2437; in func_pol() 6490 t6825 = t3137 * t2432; in func_pol() 6998 t8496 = t3137 * t3111; in func_pol() 7000 t8502 = t3137 * t3107; in func_pol() 7019 t8574 = t3137 * t3043; in func_pol() 7092 t8878 = t3137 * t3013; in func_pol() 7096 t8896 = t3137 * t3024; in func_pol() 7482 t10293 = t3137 * t3763; in func_pol() [all …]
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H A D | gga_x_ft97.c | 1082 double t3137, t3156, t3174, t3180, t3193, t3236, t3242, t3245; in func_pol() local 2364 t3137 = t22 * t819 * t215; in func_pol() 2367 …5 * t34 * t35 * t813 * t828 - 0.4864e4 * t804 * t1351 + 0.2048e4 * t817 * t3137 + 0.5120e4 * t2001… in func_pol() 2450 …84 + 0.864e3 * t336 * t1613 - 0.256e3 * t352 * t3727 - 0.1536e4 * t1361 * t3137 + 0.256e3 * t343 *… in func_pol() 2527 …018 - 0.144e3 * t535 * t1829 - 0.288e3 * t565 * t3732 + 0.864e3 * t1630 * t3137 - 0.1440e4 * t564 … in func_pol() 2603 …694 * t3732 - 0.576e3 * sigma[0] * t698 * t22 * t1355 - 0.432e3 * t1834 * t3137 - 0.288e3 * t1833 … in func_pol()
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H A D | gga_x_sg4.c | 760 double t3098, t3133, t3137, t3147, t3157, t3188, t3192, t3210; in func_pol() local 1932 t3137 = t1186 * t1412; in func_pol() 1937 …v4rhosigma3[0] = -t3137 / 0.2e1 - t205 * t480 * t1411 * t107 / 0.2e1 - 0.3e1 / 0.8e1 * t205 * t206… in func_pol() 1968 v4rhosigma3[10] = -t205 * t480 * t1411 * t161 / 0.2e1 - t3137 / 0.2e1; in func_pol()
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H A D | gga_x_cap.c | 915 double t3136, t3137, t3139, t3152, t3162, t3164, t3172, t3180; in func_pol() local 2113 t3137 = t1232 * t1355; in func_pol() 2124 …v4rho2sigma2[0] = -t3136 - 0.4e1 / 0.3e1 * t3137 - t3139 - t181 * t336 * t591 * t234 / 0.6e1 - t18… in func_pol() 2145 …v4rho2sigma2[6] = -t3136 - 0.2e1 / 0.3e1 * t3137 - t3139 / 0.2e1 - 0.2e1 / 0.3e1 * t3248 - t1236 *… in func_pol()
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H A D | gga_c_w94.c | 580 double t3089, t3137, t3144; in func_pol() local 1926 t3137 = t263 * t263; in func_pol() 1929 …v4sigma4[10] = -0.24e2 * t60 * t923 * t3137 + 0.36e2 * t60 * t765 * t269 - 0.6e1 * t60 * t134 * t3… in func_pol()
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H A D | gga_k_thakkar.c | 810 double t3099, t3102, t3137, t3141, t3180, t3185, t3187, t3218; in func_pol() local 1993 t3137 = t531 * t531; in func_pol() 1994 …1 * t1211 * t219 * t426 - 0.11733333333333333333e0 * t2893 * t1336 + 0.220e-1 * t58 * t405 * t3137; in func_pol()
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H A D | gga_c_lm.c | 863 double t3127, t3129, t3130, t3133, t3134, t3136, t3137, t3139; in func_pol() local 2293 t3137 = 0.81184710608631984390e-1 * t3136; in func_pol() 2311 …* t323 + 0.14e2 / 0.243e3 * t269 * t731 - t3124 - t3127 - t3130 + t3134 + t3137 + t3144 - t3147 + … in func_pol() 2407 …t3336 = -t3127 - t3130 + t3134 + t3137 + t3144 - t3147 + t3150 - t3153 - t3156 - t3159 + t3161 + t… in func_pol()
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H A D | gga_x_sfat_pbe.c | 3318 double t3135, t3137, t3139, t3142, t3144, t3148, t3157, t3158; in func_pol() local 5111 t3137 = t1141 * t1141; in func_pol() 5112 t3139 = t151 * t112 * t3135 * t3137; in func_pol() 5575 t4189 = t1585 * t4187 * t3137; in func_pol() 6715 t8455 = t3137 * t1141; in func_pol() 6722 …e1 + t127 * t128 * t8443 / 0.8e1 - 0.16e2 * t1135 * t151 * t128 * t3135 * t3137 + 0.24e2 * t1135 *… in func_pol() 6737 …320e1 * t3179 * t3165 - 0.11887618264977321320e1 * t1125 * t345 * t3135 * t3137 * t8621 + 0.289945… in func_pol() 7063 t10748 = t5056 * t3137 * sigma[2]; in func_pol() 7081 …65 / 0.6e1 + 0.29420038794049261164e1 * t4075 * t661 * t3135 * sigma[2] * t3137 - t127 * t386 * t4… in func_pol() 7423 t13018 = t5056 * t3137; in func_pol() [all …]
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H A D | gga_c_op_pbe.c | 813 double t3137, t3140, t3143, t3146, t3149, t3152, t3155, t3158; in func_pol() local 2550 t3137 = t2763 * t3136; in func_pol() 2557 …000000000000000000e0 * t1202 * t767 + 0.23429112957686912579e-5 * t2762 * t3137 + 0.70287338873060… in func_pol() 4344 t11689 = t9925 * t3137; in func_pol() 4347 … - 0.10000000000000000000e1 * t9911 + 0.23429112957686912579e-5 * t9970 * t3137 + 0.14057467774612… in func_pol() 4537 …787 - t9899 - 0.14057467774612147547e-4 * t11712 * t3137 + 0.46858225915373825158e-5 * t11696 * t3… in func_pol()
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H A D | gga_x_lg93.c | 1044 double t3106, t3109, t3113, t3120, t3121, t3137, t3139, t3141; in func_pol() local 2951 t3137 = t1201 * t1178; in func_pol() 2953 …037036e-17 * t1186 * t438 * t8 * t32 * t442 - 0.55555555555555555555e-9 * t3137 + 0.20370370370370… in func_pol() 3005 …* t3109 - 0.12345679012345679012e-9 * t3121 - 0.37037037037037037037e-9 * t3137 + 0.13580246913580… in func_pol()
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H A D | gga_c_op_b88.c | 798 double t3125, t3126, t3127, t3132, t3133, t3136, t3137, t3140; in func_pol() local 2375 t3137 = t558 * t3136; in func_pol() 2383 …10003205000000000000e0 * t207 * t3133 + 0.10003205000000000000e0 * t207 * t3137 - 0.33344016666666… in func_pol() 3928 t11275 = t551 * t3137; in func_pol() 3938 …20006410000000000000e0 * t554 * t3133 + 0.20006410000000000000e0 * t554 * t3137 - 0.90028845000000… in func_pol() 4087 …* t2155 * t944 + 0.10003205000000000000e0 * t706 * t3133 + 0.10003205000000000000e0 * t706 * t3137; in func_pol()
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H A D | gga_x_pbetrans.c | 1355 double t3126, t3137, t3156, t3164, t3183, t3186, t3189, t3192; in func_pol() local 2615 …t3137 = 0.2e1 / 0.3e1 * t1095 - t1099 / 0.3e1 - 0.4e1 / 0.3e1 * t1102 - 0.2e1 / 0.3e1 * t1153 - t1… in func_pol() 2617 v4rho4[2] = t3103 + t3117 + t3126 + t3137; in func_pol()
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H A D | gga_c_scan_e0.c | 1552 double t3132, t3133, t3134, t3136, t3137, t3138, t3140, t3143; in func_pol() local 3596 t3137 = t3132 * t1846; in func_pol() 3597 t3138 = t3136 * t3137; in func_pol() 5323 t9304 = t9303 * t3137; in func_pol() 5534 t9837 = t9836 * t3137; in func_pol()
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H A D | gga_c_gapc.c | 206 double t3121, t3124, t3129, t3130, t3133, t3135, t3136, t3137; in func_unpol() local 1926 t3137 = t457 * t3136; in func_unpol() 4249 double t3117, t3118, t3123, t3126, t3127, t3135, t3136, t3137; in func_ferr() local 6008 t3137 = t1143 * t530; in func_ferr() 6009 t3138 = t3136 * t3137; in func_ferr() 11793 t3137 = t3136 * t1844; in func_pol() 11794 t3138 = t3135 * t3137; in func_pol() 14336 t9006 = t9005 * t3137; in func_pol() 15785 t11753 = t11752 * t3137; in func_pol() 19018 t27084 = t4869 * t162 * t3137; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_c_vwn_2.c | 879 double t3051, t3106, t3129, t3137, t3141, t3149, t3153, t3156; in func_pol() local 2212 t3137 = t2581 * t1267; in func_pol() 2216 …782681e-1 * t1265 * t166 * t3137 + 0.10740213830244109925e-1 * t1248 * t166 * t3141 + 0.1892481225… in func_pol()
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H A D | lda_c_ml1.c | 400 double t3121, t3124, t3127, t3128, t3137, t3144, t3155, t3159; in func_pol() local 1975 t3137 = t933 * t104; in func_pol() 1976 …73759e0 * t1593 * t165 * t2706 - 0.59098295301400721278e0 * t497 * t176 * t3137 - 0.59098295301400… in func_pol() 3224 t8081 = t497 * t514 * t3137; 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 | 149 double t3134, t3137, t3138, t3143, t3145, t3147, t3148, t3153; in func_unpol() local 1282 t3137 = t1378 * t254; in func_unpol() 1283 t3138 = t1897 * t3137; in func_unpol() 1293 t3172 = t3137 * t3170 * t74; in func_unpol() 1305 t3216 = t3137 * t3147; in func_unpol() 1311 t3231 = t527 * t3137; in func_unpol() 1340 t3345 = t2227 * t3137; in func_unpol() 1363 t3575 = t609 * t3137; in func_unpol() 6127 t3137 = t407 * t337; in func_pol() 6128 t3138 = t3137 * t2356; in func_pol() [all …]
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