/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_pkzb.c | 3027 t3261 = t3260 * t497; in func_pol() 3028 t3262 = t3261 * t533; in func_pol() 3044 t3319 = t3261 * t542; in func_pol() 3046 t3327 = t3261 * t537; in func_pol() 3134 t3708 = t3261 * t588; in func_pol() 3145 t3783 = t3261 * t592; in func_pol() 3147 t3795 = t3261 * t596; in func_pol() 3188 t4095 = 0.55169230113973140950e-4 * t3261 * t615; in func_pol() 3213 t4145 = 0.55169230113973140950e-4 * t3261 * t625; in func_pol() 3337 t4422 = 0.21547200000000000000e0 * t3261 * t629; in func_pol() [all …]
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H A D | mgga_c_bc95.c | 2237 double t3249, t3250, t3253, t3254, t3257, t3258, t3261, t3264; in func_pol() local 5114 t3261 = t224 * t1068; in func_pol() 5127 …4 + 0.20000000000000000000e1 * t1278 * t3258 + 0.20000000000000000000e1 * t3261 * t1463 - 0.103452… in func_pol() 5549 t4128 = t3261 * t1280; in func_pol() 8231 t8257 = t3261 * t2871; in func_pol() 8401 … t99 + t8913 + t8921 + 0.240e3 * t8922 + 0.72e2 * t8924 + 0.12000000000000000000e2 * t3261 * t2807; in func_pol() 8900 …66666666666666667e1 * t10949 * t1280 * t1260 - 0.33333333333333333333e1 * t3261 * t4131 * t1260 - … in func_pol() 9007 … - 0.64327917994770140268e2 * t12360 * t1472 + 0.40000000000000000000e1 * t3261 * t4700 - 0.600000… in func_pol() 9022 …8 + 0.40000000000000000000e1 * t4676 * t3258 + 0.20000000000000000000e1 * t3261 * t4713 + t8602 + … in func_pol() 9433 t15060 = t3261 * t4952; in func_pol() [all …]
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H A D | mgga_c_kcis.c | 1680 t3261 = t135 * t390; in func_unpol() 1681 t3262 = t3261 * t970; in func_unpol() 9159 t3261 = t291 * t2207; in func_pol() 9160 t3262 = t307 * t3261; in func_pol() 9221 t3387 = t818 * t3261; in func_pol() 9253 t3465 = t934 * t3261; in func_pol() 9256 t3473 = t942 * t3261; in func_pol() 9260 t3482 = t957 * t3261; in func_pol() 9383 t3745 = t880 * t3261; in func_pol() 12188 t9646 = t3261 * t807; in func_pol() [all …]
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H A D | mgga_x_rscan.c | 17770 t3261 = t633 * t2499; in func_pol() 17775 t3266 = t3261 * t3265; in func_pol() 19590 t7285 = t3261 * t7284; in func_pol() 20450 t9421 = t3261 * t9420; in func_pol() 20459 t9432 = t3261 * t9431; in func_pol() 20473 t9447 = t3261 * t9446; in func_pol() 20515 t9496 = t3261 * t9495; in func_pol() 21713 t12501 = t3261 * t12500; in func_pol() 21722 t12512 = t3261 * t12511; in func_pol() 21750 t12545 = t3261 * t12544; in func_pol() [all …]
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H A D | mgga_c_cs.c | 776 double t3251, t3253, t3254, t3256, t3261, t3272, t3282, t3284; in func_pol() local 2601 …t3261 = -0.2596704e-1 * t74 * t1271 - t3239 - t3241 - t3244 - 0.35142349322666666666e-3 * t3246 - … in func_pol() 2609 v4rho3lapl[2] = t3235 + t3261 + t3272 + t3289; in func_pol()
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H A D | mgga_k_pc07.c | 4093 double t3216, t3235, t3252, t3261, t3265, t3288, t3291, t3292; in func_ferr() local 5567 t3261 = t186 * t194; in func_ferr() 5568 t3265 = t560 * t3261; in func_ferr() 6990 …* t2743 * t3261 - 0.1045487556e2 * t1264 * t1606 * t10198 - 0.1045487556e2 * t1264 * t1606 * t1107… in func_ferr() 7096 t11848 = t1606 * t3261 * t141; in func_ferr() 7106 t11938 = t1600 * t3261; in func_ferr() 7628 t15988 = t2827 * t3261; in func_ferr() 7632 t16005 = t2810 * t3261; in func_ferr() 8050 double t3238, t3243, t3248, t3249, t3253, t3257, t3260, t3261; in func_pol() local 10451 t3261 = 0.1e1 / t3260; in func_pol() [all …]
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H A D | hyb_mgga_x_pjs18.c | 3587 double t3248, t3253, t3256, t3257, t3259, t3260, t3261, t3262; in func_pol() local 5581 t3261 = t157 * t2225; in func_pol() 5582 t3262 = t3261 * t3115; in func_pol() 6684 t6683 = t3261 * t6682; in func_pol() 7412 t9994 = t3261 * t2226; in func_pol() 7432 t10053 = t3261 * t10052; in func_pol() 7434 t10057 = t3261 * t10056; in func_pol() 7955 t12044 = t3261 * t12043; in func_pol() 8281 t12718 = t3261 * t3621; in func_pol() 10723 …/ 0.3375e4 * t732 * t21017 * t29591 + 0.44233737333333333333e-1 * t3260 * t3261 * t29595 + 0.44233… in func_pol() [all …]
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H A D | mgga_x_ms.c | 2864 double t3258, t3260, t3261, t3267, t3269, t3271, t3273, t3275; in func_pol() local 4940 t3261 = t124 * t3260; in func_pol() 4970 …t3318 = 0.15625e5 / 0.157464e6 * t3258 - 0.6e1 * t1631 * t3261 + 0.6e1 * t630 * t313 * t989 + t118… in func_pol() 6366 …* t255 + 0.15625e5 / 0.157464e6 * t1645 * t3256 * t264 + 0.24e2 * t5066 * t3261 * t255 + 0.625e3 /… in func_pol() 6386 t9508 = t5001 * t3261; in func_pol()
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H A D | mgga_x_mvs.c | 2033 double t3260, t3261, t3262, t3264, t3268, t3270, t3279, t3287; in func_pol() local 4411 t3261 = t1328 * t3260; in func_pol() 4413 t3264 = -0.1250e4 / 0.729e3 * t3261 - 0.1250e4 / 0.729e3 * t3262; in func_pol() 6291 …t39 * t165 * (0.10000e5 / 0.729e3 * t8677 * t3320 - 0.50000e5 / 0.729e3 * t3261 + 0.10000e5 / 0.72… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_tca.c | 907 double t3251, t3256, t3257, t3261, t3262, t3263, t3265, t3266; in func_pol() local 2500 t3261 = t2334 * t1290 * t309 * t1128 * t1286; in func_pol() 2501 t3262 = 0.24146107051101581592e-4 * t3261; in func_pol() 2548 t3338 = 0.48292214102203163182e-4 * t3261; in func_pol() 2576 t3365 = 0.96584428204406326365e-4 * t3261; in func_pol() 2601 t3390 = 0.48292214102203163185e-4 * t3261; in func_pol() 2627 t3412 = 0.19316885640881265274e-3 * t3261; in func_pol() 2648 t3437 = 0.96584428204406326370e-4 * t3261; in func_pol()
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H A D | gga_c_lm.c | 873 double t3250, t3251, t3260, t3261, t3263, t3267, t3273, t3274; in func_pol() local 2373 t3261 = t1407 * t640; in func_pol() 2401 …v4rho3sigma[1] = -t3260 + t3261 / 0.108e3 + t3263 / 0.36e2 + t256 * t257 * (t3277 + t3290 + t3304 … in func_pol() 2522 …v4rho3sigma[4] = -t3260 + t3261 / 0.162e3 + t3263 / 0.108e3 + t3479 / 0.324e3 + t3482 + t256 * t25… in func_pol() 2593 …v4rho3sigma[7] = -t3260 + t3261 / 0.324e3 + t3479 / 0.162e3 + t3482 + t3660 / 0.108e3 + t256 * t25… in func_pol()
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H A D | gga_x_hjs.c | 7307 t3261 = -t2958; in func_pol() 7308 t3262 = t20 * t3261; in func_pol() 9026 t7977 = t3261 * t789; in func_pol() 9146 t8310 = t3261 * t806; in func_pol() 9651 t9846 = t1009 * t3261; in func_pol() 9663 t9872 = t3261 * t1094; in func_pol() 10582 t13064 = t3891 * t3261; in func_pol() 13821 t25387 = t442 * t3261; in func_pol() 14262 t27924 = t8 * t3261; in func_pol() 14525 t29375 = t3261 * t3261; in func_pol() [all …]
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H A D | gga_c_wl.c | 505 double t3244, t3249, t3251, t3261, t3263, t3265, t3271, t3273; in func_pol() local 2027 t3261 = t243 * t1005; in func_pol() 2032 …0000000000000000e1 * t92 * t265 * t221 * t71 + 0.21603600000000000000e0 * t3261 + 0.19203200000000… in func_pol() 2077 …09000000000000000e-1 * t3249 - 0.21603600000000000000e0 * t3251 + 0.64810800000000000000e0 * t3261; in func_pol()
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H A D | gga_c_p86.c | 984 double t3249, t3250, t3251, t3254, t3256, t3258, t3259, t3261; in func_pol() local 2571 t3261 = t510 * t1022; in func_pol() 2577 …t3280 = -t3259 / 0.2e1 - 0.15e2 / 0.8e1 * t3261 + 0.3e1 / 0.2e1 * t3263 + 0.3e1 / 0.4e1 * t3265 + … in func_pol() 2595 …t3332 = -t3259 - 0.15e2 / 0.4e1 * t3261 + 0.3e1 * t3263 + 0.3e1 / 0.2e1 * t3265 + 0.15242029687500… in func_pol()
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H A D | gga_c_lyp.c | 564 double t3236, t3237, t3251, t3255, t3260, t3261, t3262, t3266; in func_pol() local 2041 t3261 = t68 * t3260; in func_pol() 2043 …99 * t3251 * t416 + 0.640e3 / 0.81e2 * t99 * t3255 * t1105 + 0.20e2 / 0.81e2 * t99 * t3261 * t3262; in func_pol() 2583 …6 * t5832 - 0.10e2 / 0.3e1 * t95 * t528 * t5800 + 0.20e2 / 0.81e2 * t99 * t3261 * t5821 - 0.40e2 /… in func_pol()
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H A D | gga_x_q2d.c | 1166 double t3261, t3281, t3283, t3284, t3286, t3287, t3293, t3301; in func_pol() local 3056 t3261 = t1081 * t1236; in func_pol() 3062 …2 / 0.7962624e7 - t518 * t519 * t520 * t970 / 0.576e3 - t3259 / 0.288e3 - t3261 / 0.82944e5 - t346… in func_pol() 3110 …- t3236 / 0.2592e4 + t3240 / 0.648e3 + t3242 / 0.96e2 - t3259 / 0.432e3 - t3261 / 0.124416e6 - t32… in func_pol()
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H A D | gga_x_bpccac.c | 1470 double t3261, t3265, t3268, t3269, t3271, t3274, t3277, t3280; in func_pol() local 2877 t3261 = t7 * t537 * t1385; in func_pol() 2885 …* t1068 / 0.9e1 - t3254 / 0.6e1 - 0.3e1 / 0.2e1 * t7 * t568 * t525 * t8 - t3261 / 0.2e1 + 0.25e2 /… in func_pol() 2909 …3238 - 0.41e2 / 0.9e1 * t3244 - 0.10e2 / 0.27e2 * t3247 - t3254 / 0.9e1 - t3261 / 0.3e1 + 0.41e2 /… in func_pol()
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H A D | gga_c_op_pw91.c | 861 double t3259, t3260, t3261, t3262, t3265, t3268, t3271, t3272; in func_pol() local 2498 t3261 = t153 * t3260; in func_pol() 2499 t3262 = t3259 * t3261; in func_pol() 4251 …00e0 * t3380 * t909 * t751 + 0.66789460000000000000e-1 * t3258 * t12559 * t3261 - 0.13357892000000… in func_pol() 4739 …00e0 * t3380 * t1105 * t751 - 0.13357892000000000000e0 * t3258 * t16373 * t3261 - 0.26715784000000… in func_pol() 4759 …t16521 = 0.66789460000000000000e-1 * t3258 * t16392 * t3261 - 0.10000000000000000000e1 * t1473 * t… in func_pol() 4763 …0e0 * t3380 * t16522 * t751 - 0.26715784000000000000e0 * t3258 * t16526 * t3261 - 0.26715784000000… in func_pol()
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H A D | gga_c_op_pbe.c | 819 double t3260, t3261, t3264, t3265, t3266, t3269, t3270, t3293; in func_pol() local 2608 t3261 = t3260 * t3251; in func_pol() 2614 …t3261 - 0.69384871151205917379e-5 * t177 * t3266 + 0.91682112853425403160e-6 * t731 * t3270 + 0.14… in func_pol()
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H A D | gga_c_acggap.c | 4053 double t3251, t3253, t3254, t3256, t3258, t3261, t3263, t3266; in func_pol() local 7877 t3261 = t165 * t887; in func_pol() 7878 t3263 = t1150 * t3261 * t1151; in func_pol() 7885 t3277 = t1099 * t3261 * t1144; in func_pol() 8000 t3522 = t1099 * t3261 * t1483; in func_pol() 8058 t3640 = t1099 * t3261 * t3638; in func_pol() 8060 t3645 = t1150 * t3261 * t3643; in func_pol() 12239 t12952 = t1097 * t1150 * t3261 * t3755; in func_pol() 12396 t13488 = t3760 * t1099 * t3261 * t3761; in func_pol() 20157 t45175 = t10102 * t10103 * t3261 * t148; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_x_erf.c | 526 double t3256, t3261, t3264, t3267, t3269, t3271, t3273, t3275; in func_pol() local 1902 t3261 = t115 * t553 * t1144; in func_pol() 1912 …t3283 = -0.3e1 / 0.32e2 * t3256 + t2215 / 0.24e2 + t1776 / 0.48e2 - t3261 / 0.12e2 - t3264 / 0.24e… in func_pol() 2040 …t1270 - 0.3e1 / 0.32e2 * t2686 - t3710 - 0.3e1 / 0.32e2 * t2974 + t3712 - t3261 / 0.4e1 - t3264 / … in func_pol() 2906 …t8591 = t2219 / 0.2e1 + t1776 / 0.8e1 - t3261 / 0.6e1 - t3264 / 0.12e2 - t2224 / 0.4e1 - t2228 / 0… in func_pol() 3053 …1 * (t9276 + t9900 + t9935 + t9969 + t10018 + t10046 + t10078 + t10094) - t3261 / 0.2e1 - t3264 / … in func_pol() 3105 …85 - 0.3e1 / 0.8e1 * t2686 - 0.3e1 / 0.8e1 * t3709 - 0.3e1 / 0.8e1 * t2974 + t2215 / 0.4e1 - t3261; in func_pol()
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H A D | lda_c_vwn_2.c | 880 double t3164, t3181, t3198, t3207, t3215, t3254, t3257, t3261; in func_pol() local 2224 t3261 = t147 * t1072 * t303 * t306; in func_pol() 2233 …t3307 = 0.70e2 / 0.81e2 * t3257 + 0.28e2 / 0.27e2 * t3261 + 0.4e1 / 0.3e1 * t3265 - 0.2e1 / 0.3e1 … in func_pol() 2249 …6 / 0.108e3 - 0.11e2 / 0.648e3 * t1346 * t2812 * t101 + 0.11e2 / 0.54e2 * t3261 - t3268 / 0.12e2 +… in func_pol()
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H A D | lda_c_ml1.c | 403 double t3251, t3252, t3254, t3257, t3260, t3261, t3264, t3265; in func_pol() local 2000 t3261 = t461 * t3260; in func_pol() 2008 …0.36247780241750000000e1 * t89 * t3257 + 0.72495560483500000000e1 * t89 * t3261 - 0.65246004435150… in func_pol() 3543 …0000000e1 * t89 * t461 * t1005 * t270 + 0.14499112096700000000e2 * t437 * t3261 - 0.13049200887030… in func_pol() 3872 …21748668145050000000e2 * t588 * t3302 + 0.21748668145050000000e2 * t588 * t3261 - 0.19573801330545… in func_pol()
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 260 t3224,t3226,t3234,t3249,t3261,t3274,t3287,t3297,t3302,t3315,t3327,t3329,& local 1774 … t3261 = .CONVERT."-0.236419301841813090000E21" * t56 + .CONVERT."0.118209650920906545000E21" & 1821 + t3287 + t2998 + t3098 + t3302 + t3234 + t3158 + t2962 + t3261 &
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/dports/science/cp2k-data/cp2k-7.1.0/tools/Fun2D/ |
H A D | mpfr_cutoff_gamma.f90 | 260 t3224,t3226,t3234,t3249,t3261,t3274,t3287,t3297,t3302,t3315,t3327,t3329,& local 1774 … t3261 = .CONVERT."-0.236419301841813090000E21" * t56 + .CONVERT."0.118209650920906545000E21" & 1821 + t3287 + t2998 + t3098 + t3302 + t3234 + t3158 + t2962 + t3261 &
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