| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_pw86.c | 638 double t3080, t3081, t3092, t3093, t3106, t3127, t3146, t3156; in func_pol() local
1799 t3092 = t2750 * t519 / 0.90e2; in func_pol()
1802 …30 * t2713 * t506 * t297 + 0.7e1 / 0.225e3 * t430 * t1094 * t506 * t306 - t3092 - 0.4e1 / 0.45e2 *… in func_pol()
1828 …14e2 / 0.225e3 * t3162 + 0.14e2 / 0.225e3 * t430 * t1094 * t1224 * t140 - t3092 - 0.2e1 / 0.45e2 *… in func_pol()
1847 …* t3146 - 0.406e3 / 0.3375e4 * t3156 + 0.28e2 / 0.225e3 * t3162 + t3080 - t3092 - t3185 / 0.15e2 -… in func_pol()
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| H A D | gga_c_p86.c | 973 double t3083, t3086, t3089, t3090, t3091, t3092, t3094, t3097; in func_pol() local
2466 t3092 = 0.140e3 / 0.3e1 * t1189; in func_pol()
2469 …t3099 = 0.14e2 * t1177 - t3089 + t3090 + t3091 + t3092 - 0.6e1 * t1191 + t3094 + 0.9e1 / 0.2e1 * t… in func_pol()
2558 …* t1191 + 0.16258165000000000000e-2 * t1200 + t7 * (t3210 + t3225 + t3237 + t3244) + t3092 - t3248; in func_pol()
2598 …253 + t3193 - 0.4e1 * t1257 - t1229 + t1232 + t7 * (t3325 + t3332 + t3344 + t3345) + t3092 - t3248; in func_pol()
2625 …t3448 = t3090 + t3091 + t3092 + 0.9e1 / 0.2e1 * t1282 - 0.18290435625000000000e-2 * t1284 + 0.2438… in func_pol()
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| H A D | gga_c_lyp.c | 561 double t3092, t3095, t3100, t3104, t3105, t3106, t3110, t3114; in func_pol() local
2012 t3092 = t361 * t367 * t369; in func_pol()
2115 … 0.32e2 / 0.9e1 * t3083 + t3087 - 0.4e1 / 0.3e1 * t3089 - 0.4e1 / 0.3e1 * t3092 - 0.8e1 / 0.9e1 * … in func_pol()
2305 …t4325 = 0.8e1 / 0.3e1 * t3083 + t3087 - t3089 / 0.3e1 - 0.2e1 / 0.3e1 * t3092 - 0.2e1 / 0.3e1 * t3… in func_pol()
2440 … 0.4e1 / 0.9e1 * t3081 + 0.16e2 / 0.9e1 * t3083 + t3087 - 0.2e1 / 0.9e1 * t3092 - 0.4e1 / 0.9e1 * … in func_pol()
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| H A D | gga_c_wl.c | 502 double t3090, t3091, t3092, t3093, t3095, t3101, t3115, t3131; in func_pol() local
1996 t3092 = 0.60010000000000000000e-1 * t3091; in func_pol()
2000 …t3115 = 0.18003000000000000000e-1 * t3085 - 0.72012000000000000000e-1 * t3087 + t3090 + t3092 - 0.… in func_pol()
2032 …t3275 = t3092 - 0.22500000000000000000e0 * t126 * t99 * t28 * t567 + 0.18003000000000000000e-1 * t… in func_pol()
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| H A D | gga_c_lm.c | 860 double t3085, t3086, t3088, t3089, t3090, t3091, t3092, t3093; in func_pol() local
2269 t3092 = 0.9e1 / 0.4e1 * t3091; in func_pol()
2283 …t3117 = t3081 - t3083 + t3086 + t3090 + t3092 - t3095 + t3098 - t3101 + 0.2156e4 / 0.243e3 * t45 *… in func_pol()
2406 …t3335 = t3081 - t3083 + t3086 + t3090 + t3092 - t3095 + t3098 - t3101 - 0.7e1 / 0.27e2 * t280 * t7… in func_pol()
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| H A D | gga_x_lv_rpw86.c | 1084 double t3074, t3085, t3092, t3097, t3102, t3107, t3125, t3144; in func_pol() local
2322 t3092 = t497 * t497; in func_pol()
2327 …t2848 - 0.2e1 / 0.3e1 * t2851 - 0.2e1 / 0.3e1 * t2854 - t7 * t319 * t62 * t3092 / 0.2e1 - 0.5e1 / … in func_pol()
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| H A D | gga_x_n12.c | 1145 double t3085, t3087, t3088, t3089, t3090, t3092, t3093, t3107; in func_pol() local
2500 t3092 = t2274 / 0.4e1; in func_pol()
2501 …e1 - t2675 / 0.6e1 - t3084 - t3088 - t2059 - t2063 + t3089 + t3090 - t2739 - t2742 / 0.2e1 + t3092; in func_pol()
3034 …- 0.3e1 * t2255 - t2258 / 0.2e1 - t2261 + t3090 - t2268 / 0.2e1 - t2271 + t3092 + 0.3e1 / 0.2e1 * … in func_pol()
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| H A D | gga_c_op_pbe.c | 810 double t3085, t3088, t3089, t3090, t3091, t3092, t3093, t3094; in func_pol() local
2531 t3092 = t99 * sigma[2]; in func_pol()
2532 t3093 = t169 * t3092; in func_pol()
4250 t11192 = t457 * t3092; in func_pol()
4330 t11635 = t3092 * t105; in func_pol()
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| H A D | gga_c_pbe.c | 1526 double t3084, t3087, t3089, t3090, t3091, t3092, t3093, t3094; in func_pol() local
3485 t3092 = t3091 * t261; in func_pol()
3486 t3093 = 0.7e1 / 0.72e2 * t3092; in func_pol()
3548 …t3224 = t3211 + 0.7e1 / 0.36e2 * t3092 + t3095 / 0.8e1 - t3097 / 0.24e2 + t3102 / 0.384e3 + 0.7e1 … in func_pol()
3597 …t3335 = t3090 + 0.7e1 / 0.144e3 * t3092 + 0.7e1 / 0.144e3 * t3304 + t3309 / 0.16e2 - t3311 / 0.48e… in func_pol()
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| H A D | gga_c_pbe_vwn.c | 2006 double t3082, t3085, t3087, t3090, t3091, t3092, t3094, t3095; in func_pol() local
4019 t3092 = t1012 * t3091; in func_pol()
4136 …+ t3134 + t1915 - t3020 - t3023 - t2654 - t3055 - t3051 - t3053 + 0.6e1 * t3092 + t3095 + t3067 - … in func_pol()
5661 …666 / 0.3e1 + 0.16e2 * t2668 - 0.48e2 * t2670 - 0.32e2 * t2672 + 0.12e2 * t3092 + 0.2e1 * t3095 + … in func_pol()
5795 …t9853 = -t6638 + 0.18e2 * t3092 + 0.6e1 * t3095 + t3492 + 0.9e1 * t3118 - 0.18e2 * t3122 + t6644 -… in func_pol()
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| H A D | gga_x_hjs.c | 153 double t3085, t3092, t3095, t3097, t3104, t3107, t3112, t3115; in func_unpol() local
1295 t3092 = t363 * t1463; in func_unpol()
1296 …5 + 0.2e1 / 0.3e1 * t1329 * t632 - 0.2e1 * t1474 * t811 - 0.28363733333333333333e0 * t2008 * t3092; in func_unpol()
1390 … * t3335 + 0.56727466666666666666e-1 * t3445 - 0.54519192000000000000e1 * t3092 - 0.10903838400000… in func_unpol()
1397 …t3498 = -0.27259596000000000000e1 * t201 * t3049 - 0.105e3 / 0.8e1 * t2153 * t3092 - 0.35e2 / 0.4e… in func_unpol()
1995 …282 * t2238 - 0.105e3 / 0.8e1 * t2153 * t7269 - 0.105e3 / 0.4e1 * t4764 * t3092 - 0.105e3 / 0.8e1 … in func_unpol()
2347 double t3088, t3091, t3092, t3095, t3096, t3099, t3104, t3106; in func_ferr() local
3487 t3092 = t3091 * t353; in func_ferr()
3494 … t3084 + 0.31639733333333333332e0 * t192 * t3088 - 0.4e1 / 0.3e1 * t233 * t3092 + 0.20e2 / 0.3e1 *… in func_ferr()
4041 …1 * t3092 - 0.8e1 / 0.3e1 * t233 * t947 * t3027 * t353 + 0.40e2 / 0.3e1 * t441 * t3096 - 0.16e2 / … in func_ferr()
[all …]
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| H A D | gga_c_pw91.c | 1955 double t3088, t3090, t3091, t3092, t3093, t3094, t3096, t3098; in func_pol() local
4382 t3092 = t3091 * t1130; in func_pol()
4386 …- 0.25844881434903430496e-2 * t3085 + 0.15506928860942058298e-1 * t3088 + t3092 - t3094 - 0.775346… in func_pol()
4847 …e1 + t3042 + 0.70e2 / 0.9e1 * t3075 + 0.25844881434903430496e-2 * t4170 + t3092 - t3798 + 0.155069… in func_pol()
6986 t9754 = 0.3e1 * t3092; in func_pol()
7445 …t11818 = 0.4e1 * t3092 + t7 * (t9906 + t9931 + t10016 + t10054 + t10080 + t10115 + t10134 + t10157… in func_pol()
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| H A D | gga_c_acgga.c | 142 double t3005, t3006, t3014, t3035, t3039, t3073, t3092, t3093; in func_unpol() local
1105 t3092 = t874 * t250 * t575; in func_unpol()
1109 …8812456204e-3 * t3092 * t168 * t551 * t3093 - 0.94344276868812456204e-3 * t1296 * t168 * t551 * t2… in func_unpol()
1379 double t3079, t3084, t3087, t3092, t3093, t3105, t3112, t3134; in func_ferr() local
2330 t3092 = t955 * t243 * t566; in func_ferr()
2334 …24410870841842183e-2 * t3092 * t417 * t3093 + 0.25724410870841842183e-2 * t1282 * t417 * t3087 + 0… in func_ferr()
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| H A D | gga_x_sfat.c | 3095 double t3092, t3093, t3100, t3103, t3104, t3107, t3110, t3116; in func_pol() local
4724 t3092 = t2976 + t3091; in func_pol()
4725 t3093 = t138 * t3092; in func_pol()
6168 …t8500 + t8554) - 0.540e3 * t4028 * t8299 + 0.16e2 / 0.9e1 * t137 * t121 * t3092 - 0.32e2 / 0.9e1 *… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_bn05.c | 910 double t3089, t3090, t3092, t3093, t3096, t3097, t3105, t3107; in func_pol() local
2484 t3092 = t1370 * t257; in func_pol()
2485 t3093 = t2315 * t3092; in func_pol()
2754 t3875 = t3134 * t3092; in func_pol()
3520 …661 * t3142 * t3096 - 0.5e1 / 0.27e2 * t661 * t6046 * t3092 - 0.5e1 / 0.27e2 * t661 * t6059 * t309… in func_pol()
3912 …t8701 = -0.320e3 / 0.243e3 * t2818 * t3127 * t8167 - 0.20e2 / 0.81e2 * t661 * t6771 * t3092 - 0.8e… in func_pol()
3928 …t8801 = -0.20e2 / 0.81e2 * t47 * t199 * t791 * t1359 * t3092 + 0.20e2 / 0.243e3 * t6730 - 0.4e1 / … in func_pol()
4183 …- 0.5e1 / 0.27e2 * t661 * t6771 * t3794 - 0.5e1 / 0.27e2 * t661 * t8704 * t3092 + t661 * t3814 * t… in func_pol()
4184 …t10868 = -0.5e1 / 0.27e2 * t661 * t8673 * t3092 + 0.2e1 / 0.9e1 * t661 * t1382 * t1370 * t1357 + t… in func_pol()
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| H A D | lda_c_vwn_4.c | 874 double t3092, t3094, t3095, t3097, t3098, t3099, t3101, t3102; in func_pol() local
2134 t3092 = t1512 * t268; in func_pol()
2135 …/ 0.24e2 - t3084 - 0.24e2 * t2845 - 0.4e1 * t2848 - 0.4e1 * t2850 + t3089 - t3091 + 0.12e2 * t3092; in func_pol()
2189 … t558 / 0.24e2 - t3083 / 0.6e1 - 0.8e1 * t2845 - 0.32e2 * t3090 - 0.8e1 * t3092 - 0.24e2 * t2852 -… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_mbrxh_bg.c | 182 double t3082, t3085, t3088, t3091, t3092, t3097, t3098, t3104; in func_unpol() local
1953 t3092 = t3091 * t929; in func_unpol()
1973 …3 + 0.6e1 * t3088 * t408 - 0.3e1 * t3092 * t2246 + t480 * t741 / 0.2e1 + t155 * t3145 / 0.2e1 + 0.… in func_unpol()
2285 …3884 + 0.2e1 / 0.3e1 * t727 * t3318 - t3092 * t3887 / 0.9e1 - t3890 + t3891 - t3892 - t3556 - t389… in func_unpol()
2296 … - 0.12e2 * t3088 * t654 - 0.2e1 / 0.3e1 * t3092 * t3903 + t645 - t663 + 0.6e1 * t3088 * t668 - 0.… in func_unpol()
5528 t23214 = t3092 * t932 * t3861; in func_unpol()
5535 t23277 = t3092 * t785 * t3911; in func_unpol()
5540 t23292 = t3092 * t932 * t3911; in func_unpol()
5542 t23306 = t3092 * t953 * t3911; in func_unpol()
5544 t23310 = t3092 * t785 * t3861; in func_unpol()
[all …]
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| H A D | mgga_x_pbe_gx.c | 1370 double t2988, t2991, t2996, t3021, t3038, t3077, t3092, t3096; in func_ferr() local
2300 t3092 = t628 * t1426; in func_ferr()
2301 …t1375 - 0.250e3 / 0.243e3 * t1633 * t1426 + 0.1250e4 / 0.2187e4 * t2741 * t3092 + 0.1250e4 / 0.243… in func_ferr()
2303 …t1392 + 0.250e3 / 0.243e3 * t1630 * t1426 + 0.1250e4 / 0.2187e4 * t2780 * t3092 - 0.1250e4 / 0.243… in func_ferr()
2578 double t3089, t3092, t3095, t3097, t3098, t3100, t3101, t3102; in func_pol() local
4560 t3092 = t1116 * t771; in func_pol()
4562 …00 * t3086 - 0.55004787808053333334e-5 * t1000 * t3089 + 0.37236796666666666667e-2 * t1000 * t3092; in func_pol()
6122 t8290 = t2933 * t3092; in func_pol()
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| H A D | mgga_x_task.c | 1625 double t3008, t3027, t3039, t3054, t3063, t3069, t3092, t3096; in func_ferr() local
2674 …t3092 = -0.100e3 * t200 * t38 * t494 * t999 + 0.60e2 * t161 * t217 * t956 + 0.60e2 * t161 * t217 *… in func_ferr()
2683 …t1031 + 0.300e2 * t505 * t420 + 0.100e2 * t231 * t1031 + (t2966 + t3054 + t3092 + t3136) * t101 * … in func_ferr()
3177 double t3078, t3081, t3084, t3087, t3092, t3093, t3096, t3099; in func_pol() local
4883 …t3092 = 0.16908761064031528664e6 * t3057 * t143 + 0.14493223769169881712e6 * t3060 * t143 + 0.2173… in func_pol()
4884 t3093 = t161 * t3092; in func_pol()
6566 …t1195 * t185 - t161 * t185 * t8156 - t2546 * t487 * t185 - 0.3e1 * t355 * t3092 * t185 + 0.12e2 * … in func_pol()
6849 …185 * t948 + 0.10e2 * t143 * t3017 * t487 * t185 + 0.10e2 * t143 * t474 * t3092 * t185 - 0.200e3 *… in func_pol()
7084 …t11631 = -t3570 * t487 * t185 - 0.2e1 * t1364 * t1195 * t185 - t563 * t3092 * t185 - t911 * t1702 … in func_pol()
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| H A D | mgga_c_revscan.c | 7756 t3094 = t91 * t362 * t3092; in func_pol()
8075 t3651 = t399 * t3092; in func_pol()
8152 t3775 = t395 * t3092; in func_pol()
8280 t4004 = t469 * t451 * t3092; in func_pol()
13016 t13151 = t3092 * t368; in func_pol()
13021 t13169 = t1266 * t735 * t107 * t3092; in func_pol()
13028 t13188 = t385 * t386 * t418 * t3092; in func_pol()
13075 t13320 = t7 * t3092; in func_pol()
13776 t15814 = t603 * t3092; in func_pol()
13810 t15923 = t110 * t3092; in func_pol()
[all …]
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| H A D | mgga_x_m11.c | 1564 double t3064, t3073, t3074, t3077, t3087, t3092, t3097, t3106; in func_ferr() local
2441 t3092 = t139 * t3077; in func_ferr()
2448 …t3092 - 0.504e3 * t125 * t3097 - 0.60e2 * t1600 * t3109 - 0.336e3 * t1623 * t3087 - 0.504e3 * t163… in func_ferr()
2454 … t2040 * t3109 - 0.504e3 * t2053 * t3092 - 0.120e3 * t2062 * t3112 - 0.882e3 * t888 * t3087 - 0.13… in func_ferr()
2455 …103 - 0.336e3 * t176 * t3092 - 0.504e3 * t179 * t3097 - 0.720e3 * t182 * t3122 - 0.990e3 * t185 * … in func_ferr()
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| H A D | mgga_x_mvs.c | 2025 double t3092, t3094, t3095, t3096, t3097, t3099, t3100, t3101; in func_pol() local
4181 t3092 = t2619 * t291 / 0.2048e4; in func_pol()
4196 v3sigma3[0] = t10 * (-t3090 + t3092 - t3094 + t3099 + t3105 - t3110); in func_pol()
5723 v4rhosigma3[0] = -t3090 + t3092 - t3094 + t3099 + t3105 - t3110 + t10 * (t8733 + t8777); in func_pol()
5763 v4rhosigma3[10] = t10 * t8831 - t3090 + t3092 - t3094 + t3099 + t3105 - t3110; in func_pol()
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| H A D | hyb_mgga_x_js18.c | 11406 t3093 = t3092 * t681; in func_pol()
11522 t3465 = t3092 * t913; in func_pol()
12753 t7207 = t167 * t3092; in func_pol()
13212 t8622 = t15 * t3092; in func_pol()
13386 t9261 = t3092 * t2269; in func_pol()
13573 t10006 = t3092 * t2713; in func_pol()
13654 t10260 = t252 * t3092; in func_pol()
17638 t25535 = t3092 * t389; in func_pol()
17888 t26961 = t3092 * t191; in func_pol()
18291 t29422 = t3092 * t247; in func_pol()
[all …]
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| H A D | mgga_x_mbeefvdw.c | 2027 t3093 = t87 * t3092; in func_unpol()
2060 t3163 = t253 * t3092; in func_unpol()
2121 t3293 = t175 * t3092; in func_unpol()
2267 t3665 = t150 * t3092; in func_unpol()
2269 t3669 = t197 * t3092; in func_unpol()
4240 t10523 = t3092 * t170; in func_unpol()
4460 t11201 = t73 * t3092 * t170; in func_unpol()
4987 t14290 = t1390 * t3092; in func_unpol()
5145 t14645 = t374 * t3092; in func_unpol()
5537 t16857 = t506 * t3092; in func_unpol()
[all …]
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| H A D | hyb_mgga_x_pjs18.c | 1853 double t3079, t3080, t3081, t3083, t3086, t3092, t3104, t3106; in func_ferr() local
2867 t3092 = t3066 * t61; in func_ferr()
2878 …t3141 = -0.4e1 * t1227 * t267 - 0.3e1 * t3092 * t59 + 0.3e1 / 0.4e1 * t515 * t3066 * t61 + 0.3e1 /… in func_ferr()
2908 …0.9e1 / 0.2e1 * t508 * t3092 - 0.9e1 * t3365 * t509 + 0.3e1 / 0.4e1 * t516 * t3092 - 0.48e2 * t337… in func_ferr()
2938 …8 * t509 + 0.3e1 / 0.4e1 * t597 * t3092 + 0.24e2 * t3593 * t1219 - 0.30e2 * t597 * t3333 - 0.9e1 /… in func_ferr()
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