/dports/science/cp2k-data/cp2k-7.1.0/src/xc/ |
H A D | xc_b97.F | 622 t374, t375, t376, t377, t396, t4, t40, t410, t42, t424, t43, t431, t433, t435, t437, & local 969 t431 = alpha_crhob*f 978 epsilon_c_unifrhob = e_c_u_0rhob + t431*t110 + t433*t110 - & 1270 … *frhoarhob*t110 - 0.4e1_dp*t287*t435 - 0.4e1_dp*t431* & 1383 … t110 + alpha_crhob*f1rhob*t110 - 0.4e1_dp*t431*t435 + & 1639 t374, t375, t376, t377, t396, t4, t40, t410, t42, t424, t43, t431, t433, t435, t437, & local 1986 t431 = alpha_crhob*f 1995 epsilon_c_unifrhob = e_c_u_0rhob + t431*t110 + t433*t110 - & 2287 … *frhoarhob*t110 - 0.4e1_dp*t287*t435 - 0.4e1_dp*t431* & 2400 … t110 + alpha_crhob*f1rhob*t110 - 0.4e1_dp*t431*t435 + &
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H A D | xc_xpbe_hole_t_c_lr.F | 497 t424, t425, t426, t429, t430, t431, t437, t44, t445, t446, t45, t451, t46, t473, t475, & local 709 t431 = t430*t331 743 … *t426 - 0.112e3_dp/0.15e2_dp*t142*t431 + t60*t370) + REAL(4* & 767 … t431 + REAL(2*t129*t524, KIND=dp) - REAL(2*t181*t527, KIND=dp)) - 0.64e2_dp/ &
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/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_lm.c | 52 double t416, t419, t425, t431, t435, t437, t440, t441; in func_unpol() local 289 …t431 = t125 * (0.32473884243452793756e0 * t416 * t132 - 0.54123140405754656260e-1 * t419 * t104 * … in func_unpol() 291 v3rhosigma2[0] = t412 * t257 / 0.108e3 + t124 * t431 / 0.144e3; in func_unpol() 331 …v4rho2sigma2[0] = t25 * t36 * t9 * t257 / 0.324e3 + t412 * t431 / 0.54e2 + t124 * t125 * t706 / 0.… in func_unpol() 393 double t415, t418, t422, t423, t426, t427, t431, t436; in func_ferr() local 626 t431 = t58 * t219 * t65; in func_ferr() 627 …7061570202877328130e-1 * t257 * t427 - 0.27061570202877328130e-1 * t257 * t431 - 0.308e3 / 0.81e2 … in func_ferr() 747 double t422, t427, t428, t431, t433, t434, t450, t452; in func_pol() local 1222 t431 = t103 * t103; in func_pol() 1223 t433 = 0.1e1 / t105 / t431; in func_pol() [all …]
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H A D | gga_x_pbea.c | 402 double t431, t433, t435, t436, t437, t438, t439, t440; in func_pol() local 844 t431 = t63 * t165; in func_pol() 845 t433 = t69 * t431 * t172; in func_pol() 1260 t1072 = t69 * t431 * t454; in func_pol() 1265 t1104 = t142 * t431 * t487; in func_pol() 1331 t1388 = t142 * t431 * t510; in func_pol() 1452 t2220 = t69 * t431 * t317; in func_pol()
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H A D | gga_x_ityh.c | 1614 t431 = t249 * t6; in func_ferr() 1616 t434 = t431 * t432 * t110; in func_ferr() 1688 t637 = t636 * t431; in func_ferr() 1790 t966 = t431 * t754; in func_ferr() 1838 t1157 = t431 * t432 * t311; in func_ferr() 1915 t1448 = t431 * t432 * t480; in func_ferr() 1964 t1672 = t666 * t431; in func_ferr() 1996 t1764 = t431 * t432 * t629; in func_ferr() 2102 t2364 = t431 * t2325; in func_ferr() 2104 t2370 = t431 * t2317; in func_ferr() [all …]
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H A D | gga_x_q2d.c | 52 double t411, t413, t418, t425, t426, t431, t433, t438; in func_unpol() local 296 t431 = t177 * t247; in func_unpol() 764 t431 = t430 * t30; in func_ferr() 1529 t431 = 0.1e1 / t187 / t71; in func_pol() 1530 t432 = t62 * t431; in func_pol() 1972 t1108 = t179 * t431; in func_pol() 2295 t1662 = t288 * t431; in func_pol() 2974 t2870 = t421 * t431; in func_pol() 3227 t4563 = t675 * t431; in func_pol() 3282 t4827 = t431 * t434; in func_pol() [all …]
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H A D | gga_k_meyer.c | 54 double t428, t429, t430, t431, t435, t439, t440, t442; in func_unpol() local 327 t431 = t178 * t72; in func_unpol() 335 …5 * t417 * t175 * t178 + t424 / 0.729e3 - 0.2e1 / 0.729e3 * t429 * t430 * t431 - 0.7e1 / 0.243e3 *… in func_unpol() 384 …168 * t69 * t72 + t561 * t563 / 0.972e3 - t568 / 0.1944e4 + t429 * t560 * t431 * t24 / 0.972e3 + 0… in func_unpol() 413 … - t673 * t674 * t175 * t178 / 0.2592e4 + t681 / 0.5184e4 - t429 * t683 * t431 / 0.2592e4 - t177 *… in func_unpol() 465 … - t803 * t314 / 0.1152e4 + t806 * t809 / 0.6912e4 - t815 + t429 * t816 * t431 / 0.6912e4 - t177 *… in func_unpol() 505 t977 = t431 * t2 * t705; in func_unpol() 1229 double t429, t431, t432, t433, t435, t437, t440, t443; in func_pol() local 1652 t431 = t6 * t429 * t100; in func_pol() 1653 t432 = t431 / 0.15e2; in func_pol() [all …]
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H A D | gga_k_llp.c | 367 double t431, t440, t444, t445, t450; in func_ferr() local 560 t431 = 0.1e1 / t125; in func_ferr() 562 …t444 = 0.3e1 / 0.8e1 * t21 * t426 * t24 * t26 - 0.3e1 / 0.8e1 * t21 * t431 * t20 * t61 - t21 * t19… in func_ferr() 597 ….2e1 / 0.9e1 * t49 * t50 * t52 * (-t21 * t426 * t54 * t26 / 0.2e1 + t21 * t431 * t43 * t61 / 0.2e1… in func_ferr() 604 …* t26 + 0.15e2 / 0.16e2 * t21 / t268 * t20 * t61 + 0.5e1 / 0.16e2 * t21 * t431 * t204 * t131 + 0.3… in func_ferr() 663 double t419, t420, t424, t426, t427, t428, t431, t433; in func_pol() local 1026 t431 = t6 * t18 * t201; in func_pol() 1039 v2rhosigma[0] = t431 / 0.2e1 + t433 * t434 * t87 / 0.2e1 + 0.3e1 / 0.10e2 * t184 * t185 * t472; in func_pol() 1051 v2rhosigma[3] = t433 * t482 / 0.2e1 + t431 / 0.2e1; in func_pol()
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H A D | gga_x_am05.c | 2085 t432 = t307 * t431; in func_pol() 2369 t990 = t748 * t431; in func_pol() 2370 t994 = t754 * t431; in func_pol() 2419 t1109 = t306 * t431; in func_pol() 2422 t1129 = t431 * t431; in func_pol() 2907 t2225 = t1875 * t431 * t756; in func_pol() 3048 t2599 = t2260 * t431; in func_pol() 3143 t2859 = t1129 * t431; in func_pol() 3573 t5247 = t307 * t431 * t18 * t23; in func_pol() 3574 t5251 = t42 * t4409 * t431; in func_pol() [all …]
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H A D | gga_x_lcgau.c | 1055 double t424, t425, t427, t431, t432, t433, t434, t440; in func_pol() local 1388 t431 = t100 * t427 - 0.2e1 / 0.3e1 * t100 * t366; in func_pol() 1389 t432 = t97 * t431; in func_pol() 1708 t1320 = t431 * t431; in func_pol() 1713 t1343 = t1240 * t98 * t431; in func_pol() 1715 t1350 = t431 * t102; in func_pol() 1858 …t2311 = -0.2e1 * t2 * t431 * t102 * t88 * t50 * t2270 + 0.36e2 * t2275 * t2277 - 0.2e1 / 0.3e1 * t… in func_pol() 1865 …* t314 + t838 * t839 * t2112 * t102 * t109 / 0.2e1 + t838 * t839 * t786 * t431 * t433 / 0.2e1 + t8… in func_pol()
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H A D | gga_x_pbeint.c | 378 double t415, t418, t420, t423, t424, t431, t436, t440; in func_ferr() local 591 t431 = t144 * sigma[0]; in func_ferr() 593 t440 = (t142 * t144 * t220 * t152 / 0.384e3 - t282 * t431 * t436 / 0.9216e4) * t11; in func_ferr() 631 …3e1 / 0.8e1 * t48 * t50 * t52 * ((-t282 * t144 * t436 / 0.2304e4 + t516 * t431 / t7 / t286 * t525 … in func_ferr() 692 double t429, t430, t431, t433, t434, t435, t436, t438; in func_pol() local 1087 t431 = t83 * t430; in func_pol() 1088 t433 = t7 * t347 * t431; in func_pol() 1371 t928 = t7 * t775 * t431; in func_pol() 1840 t2189 = t7 * t1685 * t431; 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 | 2542 t431 = t139 * t102; in func_ferr() 2543 t432 = t54 * t431; in func_ferr() 2981 t1660 = t226 * t431; in func_ferr() 2984 t1667 = t237 * t431; in func_ferr() 4808 t432 = t401 * t431; in func_pol() 4830 t469 = t29 * t431; in func_pol() 4837 t484 = t26 * t431; in func_pol() 4854 t518 = t423 * t431; in func_pol() 5707 t2106 = t2105 * t431; in func_pol() 5733 t2189 = t2188 * t431; in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_xc_teter93.c | 367 double t415, t416, t417, t425, t426, t427, t428, t431; in func_pol() local 642 t431 = t214 * t127; in func_pol() 643 t432 = t431 * t239; in func_pol() 803 …* t108 * t426 * t215 * t239 - 0.6e1 * t108 * t214 * t840 - 0.8e1 * t108 * t431 * t459 - 0.4e1 * t8… in func_pol()
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H A D | lda_c_vwn_3.c | 57 double t424, t425, t426, t431, t432, t459, t461, t464; in func_unpol() local 307 t431 = t248 * rho[0]; in func_unpol() 308 t432 = 0.1e1 / t431; in func_unpol() 319 t488 = 0.1e1 / t7 / t431; in func_unpol() 403 double t424, t425, t426, t431, t432, t457, t459, t462; in func_ferr() local 653 t431 = t248 * rho[0]; in func_ferr() 654 t432 = 0.1e1 / t431; in func_ferr() 665 t486 = 0.1e1 / t7 / t431; in func_ferr() 752 double t428, t429, t430, t431, t434, t435, t436, t437; in func_pol() local 1279 t431 = t370 / 0.12e2; in func_pol() [all …]
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/dports/science/buddy/buddy-2.4/examples/bddcalc/examples/ |
H A D | c1908.cal | 443 t431 = t430 nand t416; 447 t435 = t431 and t434;
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H A D | c2670.cal | 455 t431 = t427 or t430; 456 t432 = t431 and t160; 619 t595 = t431 nand t594; 620 t596 = not t431;
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/dports/math/spot/spot-2.10.2/buddy/examples/bddcalc/examples/ |
H A D | c1908.cal | 443 t431 = t430 nand t416; 447 t435 = t431 and t434;
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H A D | c2670.cal | 455 t431 = t427 or t430; 456 t432 = t431 and t160; 619 t595 = t431 nand t594; 620 t596 = not t431;
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/dports/math/py-spot/spot-2.10.2/buddy/examples/bddcalc/examples/ |
H A D | c1908.cal | 443 t431 = t430 nand t416; 447 t435 = t431 and t434;
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H A D | c2670.cal | 455 t431 = t427 or t430; 456 t432 = t431 and t160; 619 t595 = t431 nand t594; 620 t596 = not t431;
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/ |
H A D | xc_xpbe_hole_t_c_lr.F | 497 t424, t425, t426, t429, t430, t431, t437, t44, t445, t446, t45, t451, t46, t473, t475, & local 709 t431 = t430*t331 743 … *t426 - 0.112e3_dp/0.15e2_dp*t142*t431 + t60*t370) + REAL(4* & 767 … t431 + REAL(2*t129*t524, KIND=dp) - REAL(2*t181*t527, KIND=dp)) - 0.64e2_dp/ &
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_c_scan.c | 5420 t431 = t168 * t420; in func_pol() 5421 t432 = t431 * t423; in func_pol() 5490 t556 = t431 * t551; in func_pol() 5630 t744 = t431 * t725; in func_pol() 6034 t1477 = t431 * t1453; in func_pol() 6135 t1697 = t431 * t1682; in func_pol() 6214 t1803 = t431 * t1802; in func_pol() 6314 t1931 = t431 * t1930; in func_pol() 6426 t2106 = t431 * t2105; in func_pol() 6775 t2599 = t431 * t2579; in func_pol() [all …]
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/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/ |
H A D | fun-hcth120.c | 1263 real t428, t429, t430, t431, t432, t433, t434; in hcth120_third() local 1930 t431 = -24.0*t82*t84; in hcth120_third() 2083 .0197517897025652*(t431+t430+t429-240.0*t127*t273)*t81*t86* in hcth120_third() 2683 real t428, t429, t430, t431, t432, t433, t434; in hcth120_fourth() local 3394 t431 = -4.36336574074074*t14*t15*t16*t408-3.757288888888889* in hcth120_fourth() 3397 t432 = -.5848223397455204*t81*t85*t431*t86*t110*t90*t111; in hcth120_fourth() 3975 t632 = -2.339289358982082*t81*t85*t431*t86*t110*t90*t111; in hcth120_fourth() 4048 69.26302359750346*t81*t85*t431*t109*t86*t245*t90*t246; in hcth120_fourth() 4060 t81*t85*t431*t109*t86*t249*t90*t111; in hcth120_fourth() 4061 t693 = .0867486470622522*t81*t1*t2*t3*t103*t85*t431*t110* in hcth120_fourth() [all …]
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H A D | fun-hcth407.c | 1263 real t428, t429, t430, t431, t432, t433, t434; in hcth407_third() local 1929 t431 = -24.0*t82*t84; in hcth407_third() 2082 .0197517897025652*(t431+t430+t429-240.0*t127*t273)*t81*t86* in hcth407_third() 2683 real t428, t429, t430, t431, t432, t433, t434; in hcth407_fourth() local 3393 t431 = -4.36336574074074*t14*t15*t16*t408-3.757288888888889* in hcth407_fourth() 3396 t432 = -.5848223397455204*t81*t85*t431*t86*t110*t90*t111; in hcth407_fourth() 3973 t632 = -2.339289358982082*t81*t85*t431*t86*t110*t90*t111; in hcth407_fourth() 4046 69.26302359750346*t81*t85*t431*t109*t86*t245*t90*t246; in hcth407_fourth() 4058 t81*t85*t431*t109*t86*t249*t90*t111; in hcth407_fourth() 4059 t693 = .0867486470622522*t81*t1*t2*t3*t103*t85*t431*t110* in hcth407_fourth() [all …]
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H A D | fun-hcth407p.c | 1267 real t428, t429, t430, t431, t432, t433, t434; in hcth407p_third() local 1931 t431 = -24.0*t82*t84; in hcth407p_third() 2083 0.019751789702565*(t431+t430+t429-240.0*t127*t273)*t81*t86* in hcth407p_third() 2680 real t428, t429, t430, t431, t432, t433, t434; in hcth407p_fourth() local 3388 t431 = -4.36336574074074*t14*t15*t16*t408-3.757288888888889* in hcth407p_fourth() 3391 t432 = -0.58482233974552*t81*t85*t431*t86*t110*t90*t111; in hcth407p_fourth() 3968 t632 = -2.339289358982082*t81*t85*t431*t86*t110*t90*t111; in hcth407p_fourth() 4041 69.26302359750346*t81*t85*t431*t109*t86*t245*t90*t246; in hcth407p_fourth() 4053 t81*t85*t431*t109*t86*t249*t90*t111; in hcth407p_fourth() 4054 t693 = 0.086748647062252*t81*t1*t2*t3*t103*t85*t431*t110* in hcth407p_fourth() [all …]
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