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Searched refs:t152 (Results 1 – 25 of 554) sorted by relevance

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/dports/science/ergo/ergo-3.8/source/dft/
H A Dfun-pw92c.c1542 t112*t152*t38*t39*t76-0.5*t152*t21*t3*t36*t42*t5+t114+t110; in pw92c_third()
1763 t28*t16*t152*t101*t112*t73+940.8858823906587*t28*t16*t152* in pw92c_third()
1985 2.781811676732402*t112*t152*t3*t39*t76*grada-1.0*t152*t21* in pw92c_third()
2008 2.781811676732402*t112*t152*t3*t39*t76*gradb-1.0*t152*t21* in pw92c_third()
2785 t14*t17*t152*t213*t82+0.019130906666667*t14*t17*t208*t152* in pw92c_third()
2797 t152*t231*t38*t39*t74*t78+0.695452919183101*t112*t152*t229* in pw92c_third()
2907 t14*t17*t152*t32*t109*t282-0.009565453333333*t14*t17*t152* in pw92c_third()
3205 t103*t152*t154*t27*t3*t33+t3*t5*t152*t27*t287*t33+t3*t5*t152* in pw92c_third()
3264 t152*t28*t30*t31*grada+66.66666666666667*t105*t12*t152*t28* in pw92c_third()
3341 t152*t28*t30*t31*gradb+66.66666666666667*t105*t12*t152*t28* in pw92c_third()
[all …]
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/
H A Dfun-pw92c.c1546 t112*t152*t38*t39*t76-0.5*t152*t21*t3*t36*t42*t5+t114+t110; in pw92c_third()
1767 t28*t16*t152*t101*t112*t73+940.8858823906587*t28*t16*t152* in pw92c_third()
1989 2.781811676732402*t112*t152*t3*t39*t76*grada-1.0*t152*t21* in pw92c_third()
2012 2.781811676732402*t112*t152*t3*t39*t76*gradb-1.0*t152*t21* in pw92c_third()
2789 t14*t17*t152*t213*t82+0.019130906666667*t14*t17*t208*t152* in pw92c_third()
2801 t152*t231*t38*t39*t74*t78+0.695452919183101*t112*t152*t229* in pw92c_third()
2911 t14*t17*t152*t32*t109*t282-0.009565453333333*t14*t17*t152* in pw92c_third()
3209 t103*t152*t154*t27*t3*t33+t3*t5*t152*t27*t287*t33+t3*t5*t152* in pw92c_third()
3268 t152*t28*t30*t31*grada+66.66666666666667*t105*t12*t152*t28* in pw92c_third()
3345 t152*t28*t30*t31*gradb+66.66666666666667*t105*t12*t152*t28* in pw92c_third()
[all …]
H A Dfun-b97-d.c748 t152-8.6234112E-6*t50*t53*t126*t152; in b97_d_second()
995 t55*t152-1.72468224E-5*gradb*t53*t126*t152+0.0020422944*t180* in b97_d_second()
1337 t152-8.6234112E-6*t50*t53*t126*t152; in b97_d_third()
1508 t126*t152-2.0696186880000003E-7*t22*t50*t39*t53*t269*t152; in b97_d_third()
1597 t55*t152-1.72468224E-5*gradb*t53*t126*t152+0.0020422944*t180* in b97_d_third()
2666 t152-8.6234112E-6*t50*t53*t126*t152; in b97_d_fourth()
2837 t126*t152-2.0696186880000003E-7*t22*t50*t39*t53*t269*t152; in b97_d_fourth()
3485 t557 = -0.1008432*t56*t152+0.0034795296*t52*t55*t152- in b97_d_fourth()
4292 t52*t269*t152-5.034767155200001E-6*t35*t50*t337*t269*t152+ in b97_d_fourth()
4531 t269*t152+1.1960097638400001E-5*t174*t50*t188*t52*t269*t152+ in b97_d_fourth()
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/
H A Dgga_x_ol2.c159 t152 = 0.1e1 / t14 / rho[0]; in func_unpol()
160 t153 = t9 * t152; in func_unpol()
698 t152 = t151 * t3; in func_pol()
856 v2rhosigma[0] = -t369 / 0.2e1 - t152 * t371 * t372 / 0.2e1 - 0.3e1 / 0.8e1 * t152 * t153 * t389; in func_pol()
881 v2rhosigma[5] = -t394 / 0.2e1 - t152 * t406 / 0.2e1 - 0.3e1 / 0.8e1 * t152 * t423; in func_pol()
1158 …3e1 * t881 - t885 - t887 - t152 * t265 * t888 / 0.6e1 - t152 * t371 * t892 - t152 * t371 * t895 / … in func_pol()
1168 …v3rho2sigma[2] = -0.4e1 / 0.3e1 * t920 - t924 - t152 * t288 * t925 / 0.6e1 - t152 * t395 * t929 / … in func_pol()
1199 v3rho2sigma[6] = -0.4e1 / 0.3e1 * t937 - t885 - t152 * t974 / 0.6e1 - t152 * t978 / 0.2e1; in func_pol()
1212 …0.4e1 / 0.3e1 * t956 - t924 - t966 - t152 * t983 / 0.6e1 - t152 * t987 - t152 * t990 / 0.2e1 - 0.3… in func_pol()
1221 v3rhosigma2[0] = -t1013 / 0.2e1 - t152 * t1016 / 0.2e1 - 0.3e1 / 0.8e1 * t152 * t1032; in func_pol()
[all …]
H A Dgga_x_rge2.c379 t152 = t86 * t60; in func_ferr()
711 t153 = t139 * t152; in func_pol()
824 t311 = t152 * t116; in func_pol()
845 t338 = t152 * t133; in func_pol()
854 t350 = t152 * t152; in func_pol()
900 t415 = t179 * t152; in func_pol()
1040 t607 = t152 * t249; in func_pol()
1054 t631 = t152 * t258; in func_pol()
1107 t744 = t152 * t8; in func_pol()
1136 t815 = t152 * t342; in func_pol()
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/
H A Dlda_c_gk72.c36 double t134, t135, t138, t139, t150, t151, t152, t153; in func_unpol() local
134 t152 = 0.1e1 / t151; in func_unpol()
135 t153 = t2 * t152; in func_unpol()
201 double t134, t135, t138, t139, t150, t151, t152, t153; in func_ferr() local
299 t152 = 0.1e1 / t151; in func_ferr()
300 t153 = t2 * t152; in func_ferr()
474 t152 = t87 * t87; in func_pol()
475 t153 = 0.1e1 / t152; in func_pol()
501 t187 = 0.1e1 / t8 / t152; in func_pol()
503 t201 = t152 * t7; in func_pol()
[all …]
H A Dlda_c_chachiyo.c276 double t141, t142, t144, t147, t148, t149, t152, t155; in func_pol() local
417 t152 = -t144; in func_pol()
418 …136 * t137 + 0.4e1 / 0.3e1 * t40 * t144 + 0.4e1 / 0.9e1 * t148 * t149 + 0.4e1 / 0.3e1 * t43 * t152; in func_pol()
480 ….3e1 * t40 * t263 - 0.8e1 / 0.27e2 * t267 * t268 + 0.4e1 / 0.3e1 * t271 * t152 + 0.4e1 / 0.3e1 * t… in func_pol()
493 …t303 * t149 - 0.16e2 / 0.9e1 * t306 * t141 * t80 + 0.4e1 / 0.9e1 * t168 * t152 - 0.8e1 / 0.3e1 * t… in func_pol()
556 t479 = t152 * t152; in func_pol()
558 …0 * t467 + 0.40e2 / 0.81e2 * t472 * t473 - 0.16e2 / 0.9e1 * t267 * t149 * t152 + 0.4e1 / 0.3e1 * t… in func_pol()
567 … * t303 * t80 * t152 + 0.16e2 / 0.9e1 * t267 * t36 * t141 * t149 - 0.8e1 / 0.3e1 * t148 * t141 * t… in func_pol()
576 …t152 + 0.32e2 / 0.9e1 * t148 * t586 * t589 - 0.16e2 / 0.9e1 * t168 * t141 + 0.16e2 / 0.3e1 * t168 … in func_pol()
H A Dlda_c_rc04.c269 double t152, t154, t158, t160, t164, t168, t171, t174; in func_pol() local
426 …t152 = -t140 * t46 / 0.9e1 + 0.2e1 / 0.3e1 * t143 * t100 - t146 * t49 / 0.9e1 - 0.2e1 / 0.3e1 * t1… in func_pol()
427 t154 = t41 * t19 * t152; in func_pol()
503 t300 = t152 * t52; in func_pol()
514 t322 = 0.41674338062319999998e1 * t91 * t152; in func_pol()
527 t364 = t66 * t152; in func_pol()
622 …e1 * t618 * t305 + 0.6e1 * t133 * t34 * t352 * t52 + 0.6e1 * t133 * t34 * t152 * t114 + 0.2e1 * t1… in func_pol()
623 t636 = t195 * t152 * t26 * t124; in func_pol()
644 t745 = t200 * t58 * t152; in func_pol()
664 t869 = t152 * t152; in func_pol()
[all …]
H A Dlda_x_2d.c188 double t151, t152, t154, t155, t158, t168, t171, t182; in func_pol() local
316 t152 = t151 * t42; in func_pol()
324 v3rho3[1] = -0.2e1 * t112 - 0.2e1 * t115 + t120 - t152 - t154 - 0.4e1 / 0.3e1 * t23 * t182; in func_pol()
335 v3rho3[2] = -0.2e1 * t152 - t154 - t115 + t120 - 0.2e1 * t186 - 0.4e1 / 0.3e1 * t23 * t213; in func_pol()
343 v3rho3[3] = -0.3e1 * t152 - 0.6e1 * t186 + t120 - 0.4e1 / 0.3e1 * t23 * t236; in func_pol()
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/maxima/f77/
H A Dnwxcm_x_wpbe.F718 t152 = 1/rhoa**5
2106 t244 = t152**2
2219 9 *t152*t209*t58*t62-t105*t115*t152*t62-t114*t115*t136*t62-
2581 3 ammaaa*t152
3016 3 d-4*t152
3175 7 *t152*t165*t25+5.333333333333333d+0*gammaaa*t152*t162*t16
3198 > *t152*t165*t25*t61*t65+8.7761641845443d-2*gammaaa*t152*t1
8077 3 d-4*t152
8842 2 8.7761641845443d-2*t152*t165*t25+8.7761641845443d-2*t152*
9624 ? *t152*t163*t165*t298*t61*t65-8.7761641845443d-2*t152*t165
[all …]
/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/maxima/f77/
H A Dnwxcm_x_wpbe.F718 t152 = 1/rhoa**5
2106 t244 = t152**2
2219 9 *t152*t209*t58*t62-t105*t115*t152*t62-t114*t115*t136*t62-
2581 3 ammaaa*t152
3016 3 d-4*t152
3175 7 *t152*t165*t25+5.333333333333333d+0*gammaaa*t152*t162*t16
3198 > *t152*t165*t25*t61*t65+8.7761641845443d-2*gammaaa*t152*t1
8077 3 d-4*t152
8842 2 8.7761641845443d-2*t152*t165*t25+8.7761641845443d-2*t152*
9624 ? *t152*t163*t165*t298*t61*t65-8.7761641845443d-2*t152*t165
[all …]
/dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/oint3/
H A Di0312.cc155 double t152; in i0312() local
672 t152=t79+t147; in i0312()
681 t152=t36*t79; in i0312()
686 t152=t79*t64; in i0312()
688 t73=t64+t152; in i0312()
749 t152=t7*t86; in i0312()
932 t4=t152+t18; in i0312()
1309 t152=t96+t8; in i0312()
1315 t96=t8+t152; in i0312()
1351 t152=t13+t8; in i0312()
[all …]
H A Di1312.cc155 double t152; in i1312() local
661 t152=t79+t147; in i1312()
670 t152=t36*t79; in i1312()
675 t152=t79*t64; in i1312()
677 t73=t64+t152; in i1312()
738 t152=t7*t86; in i1312()
921 t4=t152+t18; in i1312()
1296 t152=t96+t8; in i1312()
1302 t96=t8+t152; in i1312()
1338 t152=t13+t8; in i1312()
[all …]
H A Di0302.cc155 double t152; in i0302() local
694 t152=t36*t83; in i0302()
699 t152=t83*t66; in i0302()
701 t72=t66+t152; in i0302()
762 t152=t7*t90; in i0302()
950 t4=t152+t18; in i0302()
1110 t152=t41+t9; in i0302()
1112 t41=t9+t152; in i0302()
1115 t152=t9+t143; in i0302()
1129 t45=t9+t152; in i0302()
[all …]
H A Di1302.cc155 double t152; in i1302() local
683 t152=t36*t83; in i1302()
688 t152=t83*t66; in i1302()
690 t72=t66+t152; in i1302()
751 t152=t7*t90; in i1302()
939 t4=t152+t18; in i1302()
1099 t152=t41+t9; in i1302()
1101 t41=t9+t152; in i1302()
1104 t152=t9+t143; in i1302()
1118 t45=t9+t152; in i1302()
[all …]
H A Di0333AB.cc155 double t152; in i0333eAB() local
641 t152=t64*t83; in i0333eAB()
645 t112=t4*t152; in i0333eAB()
660 t154=t12*t152; in i0333eAB()
1423 t46=t18*t152; in i0333eAB()
1439 t163=t2+t152; in i0333eAB()
1444 t152=t48+t2; in i0333eAB()
1445 t2=t9*t152; in i0333eAB()
1448 t48=t12*t152; in i0333eAB()
1640 t14=t27*t152; in i0333eAB()
[all …]
H A Di1333AB.cc155 double t152; in i1333eAB() local
641 t152=t64*t83; in i1333eAB()
645 t112=t4*t152; in i1333eAB()
660 t154=t12*t152; in i1333eAB()
1423 t46=t18*t152; in i1333eAB()
1439 t163=t2+t152; in i1333eAB()
1444 t152=t48+t2; in i1333eAB()
1445 t2=t9*t152; in i1333eAB()
1448 t48=t12*t152; in i1333eAB()
1640 t14=t27*t152; in i1333eAB()
[all …]
H A Di2333AB.cc155 double t152; in i2333eAB() local
633 t152=t64*t83; in i2333eAB()
637 t112=t4*t152; in i2333eAB()
651 t154=t12*t152; in i2333eAB()
1394 t46=t18*t152; in i2333eAB()
1409 t163=t2+t152; in i2333eAB()
1414 t152=t48+t2; in i2333eAB()
1415 t2=t9*t152; in i2333eAB()
1418 t48=t12*t152; in i2333eAB()
1607 t14=t27*t152; in i2333eAB()
[all …]
H A Di1323.cc155 double t152; in i1323() local
790 t152=t51*t154; in i1323()
805 t152=t4*t151; in i1323()
808 t152=t6*t160; in i1323()
810 t152=t1*t155; in i1323()
816 t152=t44*t100; in i1323()
829 t152=t8*t164; in i1323()
831 t152=t1*t159; in i1323()
837 t152=t44*t92; in i1323()
2705 t87=t152+t93; in i1323()
[all …]
H A Di0323.cc155 double t152; in i0323() local
799 t152=t51*t154; in i0323()
814 t152=t4*t151; in i0323()
817 t152=t6*t160; in i0323()
819 t152=t1*t155; in i0323()
825 t152=t44*t100; in i0323()
839 t152=t8*t164; in i0323()
841 t152=t1*t159; in i0323()
847 t152=t44*t92; in i0323()
2725 t87=t152+t93; in i0323()
[all …]
H A Di1302AB.cc155 double t152; in i1302eAB() local
1068 t152=t151+t38; in i1302eAB()
1072 t153=t151+t152; in i1302eAB()
1080 t152=t85+t151; in i1302eAB()
1111 t38=t12*t152; in i1302eAB()
1122 t153=t12*t152; in i1302eAB()
1135 t152=t155+t48; in i1302eAB()
1137 t43=t48+t152; in i1302eAB()
1145 t155=t19*t152; in i1302eAB()
1398 t27=t3*t152; in i1302eAB()
[all …]
H A Di0302AB.cc155 double t152; in i0302eAB() local
1068 t152=t151+t38; in i0302eAB()
1072 t153=t151+t152; in i0302eAB()
1080 t152=t85+t151; in i0302eAB()
1111 t38=t12*t152; in i0302eAB()
1122 t153=t12*t152; in i0302eAB()
1135 t152=t155+t48; in i0302eAB()
1137 t43=t48+t152; in i0302eAB()
1145 t155=t19*t152; in i0302eAB()
1411 t27=t3*t152; in i0302eAB()
[all …]
H A Di2302AB.cc155 double t152; in i2302eAB() local
1038 t152=t151+t38; in i2302eAB()
1041 t153=t151+t152; in i2302eAB()
1049 t152=t85+t151; in i2302eAB()
1079 t38=t12*t152; in i2302eAB()
1087 t153=t12*t152; in i2302eAB()
1100 t152=t155+t48; in i2302eAB()
1102 t43=t48+t152; in i2302eAB()
1110 t155=t19*t152; in i2302eAB()
1361 t27=t3*t152; in i2302eAB()
[all …]
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_x_tpss.c311 t152 = t24 * t151; in func_unpol()
4073 t395 = t152 * t394; in func_pol()
4151 t557 = t152 * t556; in func_pol()
4202 t667 = t152 * t666; in func_pol()
4394 t1005 = t152 * t390; in func_pol()
4399 t1012 = t152 * t1011; in func_pol()
4515 t1283 = t152 * t555; in func_pol()
4618 t1519 = t152 * t665; in func_pol()
5126 t2548 = t152 * t992; in func_pol()
5129 t2562 = t152 * t1002; in func_pol()
[all …]
H A Dmgga_x_pkzb.c665 t152 = t33 * t134; in func_ferr()
1305 t153 = t126 * t152; in func_pol()
1407 t289 = t152 * t114; in func_pol()
1424 t312 = t152 * t152; in func_pol()
1466 t383 = t152 * t170; in func_pol()
1539 t505 = t226 * t152; in func_pol()
1594 t567 = t253 * t152; in func_pol()
1743 t670 = t152 * t277; in func_pol()
1751 t682 = t152 * t296; in func_pol()
1759 t692 = t152 * t345; in func_pol()
[all …]

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