| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/maxima/f77/ |
| H A D | nwxcm_c_lyp.F | 1002 t127 = -4.6279677696266674d-5*gammaaa*t30*t39*t57*t59
1125 ? t127+t126+t125+t123+t122+t117+t116+t115)+t14*t47*t48*(2.3
1366 t127 = 1.111111111111111d-1*rhob*t55+1.111111111111111d-1*rh
1371 2 760000000001d-3*gammabb*t11*t127-6.491760000000001d-3*gam
1658 = abb*t11*t127+2.3803120000000005d-2*gammaaa*t11*t125+2.380
1669 8 -5.481209360000001d-4*gammabb*t11*t127-5.481209360000001d
1681 4 3333332d-1*t128-7.5520808d-4*gammabb*t11*t127-7.5520808d-
1697 4 0001d-4*gammabb*t11*t127*t29-5.481209360000001d-4*gammaaa
1718 < -3*gammabb*t11*t127*t29-1.0962418720000001d-3*gammaaa*t11
1782 1 t11*t127)*t5*t6+t49*t5*(2.3803120000000005d-2*t11*t56+2.3
|
| H A D | nwxcm_c_m05.F | 850 1 *t21-rhob*t127)+5.0d-1*t12*t26+5.0d-1*rhob*t12*t127)*wg
2602 t127 = t45+t126
4031 t127 = t126+t125
4037 1 +0*t127*t128
4679 t127 = t62+t126
7644 t127 = t45+t126
7857 t278 = t127**2
11841 1 +0*t127*t128
12031 t264 = t127**2
13622 t127 = t62+t126
[all …]
|
| H A D | nwxcm_c_spbe.F | 971 t127 = 1/t1**2.3333333333333334d+0
978 4 .753699179395351d-3*t127)-2.625411059665811d-1*t57*t58*t5
991 3 7d-2*t128*t21*t56+2.601716490612924d-3*t127)*t6+8.7513701
1887 t127 = -t38*t89
2277 t127 = t60**2
3622 t127 = 1/t34**3
3679 @ 886d-2*rhoa*t102*t127*t64)*wght+Cmat3(iq,D3_RA_RA_GAA)
3688 8 rhoa*t107*t127*t62)*wght+Cmat3(iq,D3_RA_GAA_GAA)
3934 t127 = 1/t34**3
3991 @ 886d-2*rhob*t102*t127*t64)*wght+Cmat3(iq,D3_RB_RB_GBB)
[all …]
|
| H A D | nwxcm_x_pw91.F | 1425 t127 = t63+t62+t59-1.3333333333333333d-6*t111*t21*t22*t4
1454 t144 = -1.0d+0*t127*t20*t75-1.0d+0*t112*t20*t73-1.0d+0*t143*
1505 t186 = -1.0d+0*t185*t20*t30-2.0d+0*t112*t127*t20
1532 1 +1.3333333333333333d+0*t127*t48)+t50*(-1.0d+0*t112*t20*t6
1533 2 4-1.0d+0*t127*t20*t58-1.0d+0*t136*t20*t30)+t49*t50*(-1.33
1614 < 48*t49-2.6666666666666666d+0*t112*t127*t48*t49-2.0d+0*t12
1628 : 66666666666666d+0*t112*t48*t64-2.6666666666666666d+0*t127
1637 3 *t30*t48*t50+t27*t49*(2.6666666666666666d+0*t108*t127*t49
1640 6 7777776d+0*t107*t127*t27*t48-1.378556646443111d+0*t175*t4
1682 7 t183*t20*t75-1.0d+0*t185*t20*t73-2.0d+0*t127*t143*t20-2.0
[all …]
|
| H A D | nwxcm_x_cams12.F | 1072 t127 = t78**2
1081 4 610514726982003d+0*t127*t128*t3*t33*t40-1.323414380585386
1185 7 -1*t126*t3*t38*t40+1.8610514726982003d+0*t127*t128*t3*t33
2108 t127 = -5.583154418094601d+0*t11*t3*t33*t51*t67*t95-1.116630
2318 7 27*t21*t23*t25*t45-3.536776513153214d-2*t127*t20*t22*t26-
2319 8 5.0d-1*t127*t24*t25)-2.826440000853771d+2*t25*t32*t43*t53
2327 @ 58d+0*rhoa*t127*t25*t28*t32*t41+1.329807601338106d-1*t127
2332 5 100*t15*t16*t17*t29*t53-1.7730768017841417d-1*t127*t15*t1
2543 t127 = -3.5461536035682834d-1*t16*t17*t18*t30*t62*t70+7.0923
3854 @ 8d+0*rhoa*t127*t25*t28*t32*t41+1.329807601338106d-1*t127*
[all …]
|
| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_cs1.c | 36 double t119, t120, t121, t123, t124, t127, t128, t130; in func_unpol() local
164 t127 = 0.1e1 / t1 / t7; in func_unpol()
165 t128 = t48 * t127; in func_unpol()
234 t257 = t123 * t127; in func_unpol()
238 t265 = t26 * t127; in func_unpol()
287 t355 = t186 * t127; in func_unpol()
338 …0.18892688444444444442e-1 * t334 / t9 - 0.23266666666666666666e0 * t338 * t127 + 0.16e2 / 0.81e2 /… in func_unpol()
607 double t123, t124, t125, t126, t127, t128, t129, t130; in func_pol() local
865 t127 = t126 / 0.2e1; in func_pol()
893 vrho[0] = t34 + t62 + t88 + t3 * (t97 + t105 + t123 + t127 + t131 - t138 + t157 + t161); in func_pol()
[all …]
|
| H A D | gga_x_vmt84.c | 1038 t127 = 0.1e1 / t126; in func_pol()
1039 t128 = t15 * t127; in func_pol()
1067 t180 = t72 * t127; in func_pol()
1136 t311 = t14 * t127; in func_pol()
1191 t418 = t71 * t127; in func_pol()
1371 t821 = t304 * t127; in func_pol()
1385 t841 = t411 * t127; in func_pol()
1495 t1080 = t127 * t66; in func_pol()
1505 t1095 = t127 * t110; in func_pol()
1898 t2116 = t814 * t127; in func_pol()
[all …]
|
| H A D | gga_x_g96.c | 362 double t123, t125, t126, t127, t128, t129, t130, t132; in func_pol() local
596 t127 = 0.1e1 / t126; in func_pol()
597 t128 = t127 * t16; in func_pol()
657 t198 = t4 * t6 * t127; in func_pol()
858 t430 = t127 * t66; in func_pol()
1063 t768 = t110 * t127; in func_pol()
1285 t1102 = t127 * t152; in func_pol()
1337 t1301 = t127 * t211; in func_pol()
1385 …t1542 = -0.10e2 / 0.27e2 * t1291 + 0.32e2 / 0.3699e4 * t1296 - t7 * t127 * t1512 * t31 * t1514 / 0… in func_pol()
|
| H A D | gga_k_exp4.c | 257 double t121, t127, t136, t138, t144; in func_ferr() local
345 …t127 = t5 * (-0.18924227111111111110e2 * t10 * t40 * t17 + 0.15755207579462962962e3 * t21 * t111 *… in func_ferr()
347 v2rhosigma[0] = t105 * t64 / 0.2e1 + 0.3e1 / 0.10e2 * t37 * t127; in func_ferr()
380 v3rho2sigma[0] = t193 * t64 / 0.3e1 + t105 * t127 + 0.3e1 / 0.10e2 * t37 * t222; in func_ferr()
410 …v4rho3sigma[0] = -t147 * t2 * t64 / 0.9e1 + t193 * t127 + 0.3e1 / 0.2e1 * t105 * t222 + 0.3e1 / 0.… in func_ferr()
458 double t116, t117, t118, t120, t121, t125, t127, t128; in func_pol() local
642 t127 = t79 * t80 * t125; in func_pol()
643 t128 = t127 / 0.2e1; in func_pol()
779 v2rho2[2] = t127 + t177 + t131 + t179 + 0.3e1 / 0.5e1 * t149 + t8 * t352; in func_pol()
|
| H A D | gga_x_lspbe.c | 36 double t124, t125, t126, t127, t128, t132, t137, t140; in func_unpol() local
149 t127 = t103 * t8; in func_unpol()
151 …27e2 * t53 * t54 * t115 - 0.11e2 / 0.27e2 * t63 * t19 * t119 + 0.2e1 / 0.81e2 * t126 * t127 * t128; in func_unpol()
198 …4 * t215 + 0.154e3 / 0.81e2 * t63 * t19 * t219 - 0.22e2 / 0.81e2 * t126 * t127 * t208 * t37 + 0.8e… in func_unpol()
241 …0.2618e4 / 0.243e3 * t63 * t19 * t345 * t37 + 0.1958e4 / 0.729e3 * t126 * t127 * t339 * t37 - 0.17… in func_unpol()
294 double t125, t127, t139, t140, t145, t148, t150, t159; in func_ferr() local
393 t127 = 0.1e1 / t7 / t125; in func_ferr()
394 t139 = t89 * t127; in func_ferr()
396 …t145 = t42 * (t86 * t90 * t127 * sigma[0] / 0.108e3 - t47 * t48 * t51 / 0.9e1 + t56 * t14 * t51 * … in func_ferr()
444 …t272 = t42 * (-t178 * t257 * sigma[0] / 0.144e3 + t86 * t90 * t127 / 0.54e2 - t112 * t139 * t32 / … in func_ferr()
|
| H A D | gga_c_regtpss.c | 245 t127 = t39 * t126; in func_unpol()
246 t128 = t127 * t77; in func_unpol()
259 t150 = t127 * t63; in func_unpol()
287 t197 = t127 * t61; in func_unpol()
364 t320 = t127 * t185; in func_unpol()
366 t324 = t127 * t323; in func_unpol()
385 t364 = t127 * t55; in func_unpol()
425 t466 = t127 * t465; in func_unpol()
446 t519 = t127 * t229; in func_unpol()
450 t530 = t127 * t224; in func_unpol()
[all …]
|
| H A D | gga_x_ol2.c | 34 double t125, t127, t131, t134, t135, t138, t139, t140; in func_unpol() local
139 t127 = t105 * t20; in func_unpol()
140 … 0.2e1 / 0.3e1 * t66 * t49 + 0.8e1 * t69 * t42 * t54 - 0.128e3 / 0.3e1 * params->cc * t125 * t127); in func_unpol()
179 …* t94 - 0.296e3 / 0.9e1 * t69 * t87 * t54 + 0.384e3 * params->cc * t103 * t127 - 0.2048e4 / 0.3e1 … in func_unpol()
214 …6e4 / 0.9e1 * t69 * t164 * t54 - 0.81152e5 / 0.27e2 * params->cc * t178 * t127 + 0.100352e6 / 0.9e… in func_unpol()
481 double t127, t128, t130, t135, t138, t139, t140, t141; in func_pol() local
683 t127 = t126 / 0.2e1; in func_pol()
695 vrho[1] = -t67 - t68 + t9 * (-t122 - t84 - t127 - t114 - t147); in func_pol()
808 v2rho2[1] = t9 * t311 - t104 - t110 - t122 - t127 - t147 - t181 - t183 - t78; in func_pol()
|
| H A D | gga_x_pw91.c | 1149 t127 = 0.1e1 / t126; in func_pol()
1150 t128 = t15 * t127; in func_pol()
1187 t193 = t71 * t127; in func_pol()
1278 t339 = t14 * t127; in func_pol()
1336 t441 = t70 * t127; in func_pol()
1537 t801 = t332 * t127; in func_pol()
1551 t821 = t434 * t127; in func_pol()
1657 t1028 = t127 * t110; in func_pol()
1664 t1038 = t127 * t65; in func_pol()
2104 t2054 = t814 * t127; in func_pol()
[all …]
|
| H A D | gga_c_tca.c | 37 double t122, t126, t127, t128, t131, t132, t133, t134; in func_unpol() local
168 t127 = t27 * t65; in func_unpol()
169 t128 = t26 * t127; in func_unpol()
238 t274 = t127 * t12 * t243; in func_unpol()
525 t127 = t27 * t65; in func_ferr()
526 t128 = t26 * t127; in func_ferr()
595 t274 = t127 * t12 * t243; in func_ferr()
1067 t127 = t34 * t63; in func_pol()
1068 t130 = 0.16056217211729236738e-2 * t32 * t127 * t93; in func_pol()
1279 t412 = t273 * t127; in func_pol()
[all …]
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/maxima/f77/ |
| H A D | nwxcm_c_m05.F | 850 1 *t21-rhob*t127)+5.0d-1*t12*t26+5.0d-1*rhob*t12*t127)*wg
2602 t127 = t45+t126
4031 t127 = t126+t125
4037 1 +0*t127*t128
4679 t127 = t62+t126
7644 t127 = t45+t126
7857 t278 = t127**2
11841 1 +0*t127*t128
12031 t264 = t127**2
13622 t127 = t62+t126
[all …]
|
| H A D | nwxcm_c_spbe.F | 971 t127 = 1/t1**2.3333333333333334d+0
978 4 .753699179395351d-3*t127)-2.625411059665811d-1*t57*t58*t5
991 3 7d-2*t128*t21*t56+2.601716490612924d-3*t127)*t6+8.7513701
1887 t127 = -t38*t89
2277 t127 = t60**2
3622 t127 = 1/t34**3
3679 @ 886d-2*rhoa*t102*t127*t64)*wght+Cmat3(iq,D3_RA_RA_GAA)
3688 8 rhoa*t107*t127*t62)*wght+Cmat3(iq,D3_RA_GAA_GAA)
3934 t127 = 1/t34**3
3991 @ 886d-2*rhob*t102*t127*t64)*wght+Cmat3(iq,D3_RB_RB_GBB)
[all …]
|
| H A D | nwxcm_x_pw91.F | 1425 t127 = t63+t62+t59-1.3333333333333333d-6*t111*t21*t22*t4
1454 t144 = -1.0d+0*t127*t20*t75-1.0d+0*t112*t20*t73-1.0d+0*t143*
1505 t186 = -1.0d+0*t185*t20*t30-2.0d+0*t112*t127*t20
1532 1 +1.3333333333333333d+0*t127*t48)+t50*(-1.0d+0*t112*t20*t6
1533 2 4-1.0d+0*t127*t20*t58-1.0d+0*t136*t20*t30)+t49*t50*(-1.33
1614 < 48*t49-2.6666666666666666d+0*t112*t127*t48*t49-2.0d+0*t12
1628 : 66666666666666d+0*t112*t48*t64-2.6666666666666666d+0*t127
1637 3 *t30*t48*t50+t27*t49*(2.6666666666666666d+0*t108*t127*t49
1640 6 7777776d+0*t107*t127*t27*t48-1.378556646443111d+0*t175*t4
1682 7 t183*t20*t75-1.0d+0*t185*t20*t73-2.0d+0*t127*t143*t20-2.0
[all …]
|
| H A D | nwxcm_x_cams12.F | 1072 t127 = t78**2
1081 4 610514726982003d+0*t127*t128*t3*t33*t40-1.323414380585386
1185 7 -1*t126*t3*t38*t40+1.8610514726982003d+0*t127*t128*t3*t33
2108 t127 = -5.583154418094601d+0*t11*t3*t33*t51*t67*t95-1.116630
2318 7 27*t21*t23*t25*t45-3.536776513153214d-2*t127*t20*t22*t26-
2319 8 5.0d-1*t127*t24*t25)-2.826440000853771d+2*t25*t32*t43*t53
2327 @ 58d+0*rhoa*t127*t25*t28*t32*t41+1.329807601338106d-1*t127
2332 5 100*t15*t16*t17*t29*t53-1.7730768017841417d-1*t127*t15*t1
2543 t127 = -3.5461536035682834d-1*t16*t17*t18*t30*t62*t70+7.0923
3854 @ 8d+0*rhoa*t127*t25*t28*t32*t41+1.329807601338106d-1*t127*
[all …]
|
| /dports/science/multiwfn/gMultiwfn-3.4.1-0-14-ge873677/src/ |
| H A D | DFTxclib.F | 3119 t127 = t126*t6
5546 t127 = 1/t126
8637 #*t127
8816 #*t127
12208 t136 = t127**2
12542 t136 = t127**2
12708 #/t127*t526
12841 t127 = 1/t126
12996 t127 = 1/t126
13170 t136 = t127**2
[all …]
|
| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/oint3/ |
| H A D | i3322.cc | 130 double t127; in i3322() local
532 t127=t124+t123; in i3322()
533 t123=t1*t127; in i3322()
740 t149=t1*t127; in i3322()
824 t51=t18*t127; in i3322()
|
| /dports/science/buddy/buddy-2.4/examples/bddcalc/examples/ |
| H A D | c3540.cal | 559 t127 = not t2;
560 t1036 = not t127;
562 t1038 = t5 and t127;
662 t389 = t127 and t4;
1189 t1377 = t127 and t1376;
1526 t1696 = t127 and t1695;
1531 t1701 = t127 and t996;
1564 t1734 = t127 and t1028;
1687 t128 = t4 nand t127;
|
| H A D | c499.cal | 139 t127 = ic3;
140 t128 = t127 and t10;
|
| /dports/math/spot/spot-2.10.2/buddy/examples/bddcalc/examples/ |
| H A D | c3540.cal | 559 t127 = not t2;
560 t1036 = not t127;
562 t1038 = t5 and t127;
662 t389 = t127 and t4;
1189 t1377 = t127 and t1376;
1526 t1696 = t127 and t1695;
1531 t1701 = t127 and t996;
1564 t1734 = t127 and t1028;
1687 t128 = t4 nand t127;
|
| H A D | c499.cal | 139 t127 = ic3;
140 t128 = t127 and t10;
|
| /dports/math/py-spot/spot-2.10.2/buddy/examples/bddcalc/examples/ |
| H A D | c3540.cal | 559 t127 = not t2;
560 t1036 = not t127;
562 t1038 = t5 and t127;
662 t389 = t127 and t4;
1189 t1377 = t127 and t1376;
1526 t1696 = t127 and t1695;
1531 t1701 = t127 and t996;
1564 t1734 = t127 and t1028;
1687 t128 = t4 nand t127;
|