| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_am05.c | 1087 t224 = t7 * t86; in func_pol()
1123 vsigma[0] = t224 * t289 / 0.2e1; in func_pol()
1132 vsigma[2] = t224 * t296 / 0.2e1; in func_pol()
1328 v2rhosigma[0] = t222 * t289 / 0.2e1 + t224 * t671 / 0.2e1 + t224 * t690 / 0.2e1 + t669 / 0.2e1; in func_pol()
1353 v2rhosigma[5] = t224 * t704 / 0.2e1 + t224 * t723 / 0.2e1 + t260 * t296 / 0.2e1 + t694 / 0.2e1; in func_pol()
1360 v2sigma2[0] = t224 * t734 / 0.2e1; in func_pol()
1379 v2sigma2[5] = t224 * t744 / 0.2e1; in func_pol()
1685 …58 + t499 * t289 / 0.2e1 + t222 * t671 + t222 * t690 + t224 * t1463 / 0.2e1 + t224 * t1466 + t224 … in func_pol()
1737 …42 + t626 * t296 / 0.2e1 + t260 * t704 + t260 * t723 + t224 * t1559 / 0.2e1 + t224 * t1562 + t224 … in func_pol()
1749 …v3rhosigma2[0] = t224 * t1591 / 0.2e1 + t224 * t1607 / 0.2e1 + t222 * t734 / 0.2e1 + t1589 / 0.2e1; in func_pol()
[all …]
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| H A D | gga_x_kt.c | 640 t224 = t4 * t6 * t144; in func_pol()
643 t228 = t224 * t225 * t226; in func_pol()
767 t380 = t224 * t225 * t378; in func_pol()
839 t502 = t224 * t500 * t226; in func_pol()
843 t507 = t224 * t504 * t505; in func_pol()
851 t521 = t224 * t519 * t226; in func_pol()
853 t525 = t224 * t225 * t523; in func_pol()
907 t643 = t224 * t504 * t641; in func_pol()
911 t651 = t224 * t225 * t649; in func_pol()
934 t705 = t224 * t225 * t703; in func_pol()
[all …]
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| H A D | gga_c_op_xalpha.c | 304 double t222, t223, t224, t227, t228, t229, t232, t235; in func_pol() local
525 t224 = t223 * t78; in func_pol()
691 t516 = 0.20000000000000000000e1 * t514 * t224; in func_pol()
703 t538 = t537 * t224; in func_pol()
705 …t543 = -0.10000000000000000000e1 * t504 * t224 - 0.10000000000000000000e1 * t222 * t508 - 0.500000… in func_pol()
748 t669 = t668 * t224; in func_pol()
971 t1103 = t107 * t224; in func_pol()
981 t1133 = t104 * t28 * t224; in func_pol()
1017 …t224 - 0.21683330888888888889e0 * t536 * t537 * t511 - 0.43366661777777777778e0 * t536 * t537 * t5… in func_pol()
1075 t1638 = t189 * t28 * t224; in func_pol()
[all …]
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| H A D | gga_c_w94.c | 752 t224 = t134 * t97; in func_pol()
753 t227 = 0.2e1 * t60 * t224 * t78; in func_pol()
988 t622 = 0.2e1 * t60 * t224 * t156; in func_pol()
1062 t743 = 0.2e1 * t60 * t224 * t216; in func_pol()
1081 t771 = 0.4e1 * t60 * t224 * t231; in func_pol()
1458 t1885 = 0.2e1 * t60 * t224 * t318; in func_pol()
1511 t2060 = t49 * t224; in func_pol()
1514 t2064 = t108 * t224; in func_pol()
1634 t2449 = 0.2e1 * t60 * t224 * t584; in func_pol()
1670 t2539 = 0.4e1 * t60 * t224 * t627; in func_pol()
[all …]
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| H A D | gga_c_wl.c | 966 t583 = t61 * t224; in func_pol()
994 t640 = t146 * t224; in func_pol()
1004 t662 = t174 * t224; in func_pol()
1006 t669 = t192 * t224; in func_pol()
1180 t968 = t22 * t224; in func_pol()
1185 t975 = t233 * t224; in func_pol()
1214 t1021 = t28 * t224; in func_pol()
1674 t2170 = t224 * t51; in func_pol()
1675 t2174 = t224 * t71; in func_pol()
1687 t2242 = t224 * t224; in func_pol()
[all …]
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| H A D | gga_x_ak13.c | 709 double t212, t224; in func_pol() local
1142 t493 = t7 * t52 * t224; in func_pol()
1144 t495 = t224 * t127; in func_pol()
1155 t505 = t494 * t224 * t144; in func_pol()
1477 t1161 = t224 * t311; in func_pol()
1478 t1165 = t224 * t320; in func_pol()
1500 t1194 = t309 * t224; in func_pol()
1502 t1199 = t494 * t224 * t8; in func_pol()
1516 t1219 = t354 * t224 * t391; in func_pol()
1518 t1226 = t494 * t224 * t400; in func_pol()
[all …]
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_x_2d.c | 190 double t218, t224, t227, t232, t236; in func_pol() local
338 t224 = -0.6e1 * t56 - 0.6e1 * t130; in func_pol()
340 t232 = -t224; in func_pol()
341 … 0.16e2 * t121 * t218 + 0.9e1 / 0.8e1 * t77 * t98 + 0.3e1 / 0.4e1 * t10 * t224 - 0.3e1 / 0.16e2 * … in func_pol()
388 …1 * t158 * t56 * t98 + 0.9e1 / 0.8e1 * t77 * t198 + 0.3e1 / 0.8e1 * t51 * t224 * t27 + 0.3e1 / 0.4… in func_pol()
398 …/ 0.8e1 * t188 * t98 + 0.9e1 / 0.8e1 * t51 * t477 + 0.3e1 / 0.2e1 * t77 * t224 + 0.3e1 / 0.4e1 * t… in func_pol()
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| H A D | lda_c_1d_loos.c | 38 double t193, t196, t207, t210, t215, t224, t228, t235; in func_unpol() local
139 t224 = t192 * t17; in func_unpol()
148 …t224 * t178 + 0.55494000000000000000e1 * t106 * t228 * t109 - 0.60000000000000000000e1 * t48 * t1 … in func_unpol()
167 …7325601163526297e0 * t6 * t247 * t319 + 0.73992000000000000000e1 * t113 * t224 * t45 - 0.739920000… in func_unpol()
212 double t193, t196, t207, t210, t215, t224, t228, t235; in func_ferr() local
313 t224 = t192 * t17; in func_ferr()
322 …t224 * t178 + 0.55494000000000000000e1 * t106 * t228 * t109 - 0.60000000000000000000e1 * t48 * t1 … in func_ferr()
341 …7325601163526297e0 * t6 * t247 * t319 + 0.73992000000000000000e1 * t113 * t224 * t45 - 0.739920000… in func_ferr()
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| H A D | lda_x_1d_exponential.c | 245 double t222, t224, t225, t228, t230, t231, t233, t234; in func_pol() local
456 t224 = -t222 * t180 + t101; in func_pol()
460 t231 = t224 * t230; in func_pol()
463 t235 = t96 * t224; in func_pol()
505 t318 = t148 * t224; in func_pol()
533 t374 = t224 * t373; in func_pol()
589 t480 = 0.2e1 * t218 * t224 * t237; in func_pol()
615 t544 = t224 * t504; in func_pol()
653 t714 = t312 * t224; in func_pol()
673 t815 = t367 * t224; in func_pol()
[all …]
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| H A D | lda_x_rel.c | 364 double t208, t209, t210, t214, t218, t221, t224, t227; in func_pol() local
542 t224 = -t218; in func_pol()
543 …127 * t214 + 0.4e1 / 0.3e1 * t15 * t218 + 0.4e1 / 0.9e1 * t139 * t221 + 0.4e1 / 0.3e1 * t18 * t224; in func_pol()
621 t418 = t139 * t224; in func_pol()
635 ….3e1 * t15 * t446 - 0.8e1 / 0.27e2 * t275 * t449 + 0.4e1 / 0.3e1 * t197 * t224 + 0.4e1 / 0.3e1 * t… in func_pol()
720 …e1 * t197 * t132 + 0.16e2 / 0.3e1 * t197 * t269 - 0.8e1 / 0.27e2 * t275 * t224 * t140 + 0.8e1 / 0.… in func_pol()
728 ….16e2 / 0.9e1 * t413 * t133 - 0.8e1 / 0.9e1 * t353 * t224 * t70 - 0.8e1 / 0.3e1 * t356 * t132 * t2… in func_pol()
738 t913 = t224 * t224; in func_pol()
739 …e1 * t15 * t905 + 0.40e2 / 0.81e2 * t600 * t908 - 0.16e2 / 0.9e1 * t413 * t224 + 0.4e1 / 0.3e1 * t… in func_pol()
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| H A D | lda_c_2d_prm.c | 43 double t220, t222, t224, t226, t229, t232, t233, t235; in func_unpol() local
200 t224 = t210 * t17; in func_unpol()
207 …904862254808623227e0 * t220 - 0.11780972450961724646e1 * t222 + 0.1e-18 * t224 + 0.599937487954459… in func_unpol()
232 …561944901923449292e1 * t220 - 0.47123889803846898584e1 * t222 + 0.4e-18 * t224 + 0.239974995181783… in func_unpol()
280 double t220, t222, t224, t226, t229, t232, t233, t235; in func_ferr() local
437 t224 = t210 * t17; in func_ferr()
444 …904862254808623227e0 * t220 - 0.11780972450961724646e1 * t222 + 0.1e-18 * t224 + 0.599937487954459… in func_ferr()
469 …561944901923449292e1 * t220 - 0.47123889803846898584e1 * t222 + 0.4e-18 * t224 + 0.239974995181783… in func_ferr()
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| H A D | lda_x.c | 220 double t217, t219, t224, t229, t232, t237, t240, t245; in func_pol() local
368 t224 = t66 * t117; in func_pol()
373 ….8e1 / 0.27e2 * t219 * t35 + 0.16e2 / 0.9e1 * t95 * t72 + 0.4e1 / 0.9e1 * t224 * t35 + 0.4e1 / 0.3… in func_pol()
422 … * t146 * t117 * t67 + 0.8e1 / 0.9e1 * t66 * t229 * t35 + 0.4e1 / 0.9e1 * t224 * t74 + t367 + 0.40… in func_pol()
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| H A D | lda_c_pw.c | 183 t224 = t5 * t223; in func_unpol()
406 t224 = t5 * t223; in func_ferr()
760 t224 = 0.1e1 / t223; in func_pol()
761 t225 = t104 * t224; in func_pol()
779 t260 = t224 * t239 * t259; in func_pol()
847 t375 = t224 * t373 * t259; in func_pol()
910 t483 = t143 * t224; in func_pol()
946 t529 = t219 * t224; in func_pol()
1102 t758 = t478 * t224; in func_pol()
1187 t930 = t288 * t224; in func_pol()
[all …]
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| H A D | lda_x_sloc.c | 238 double t208, t209, t213, t214, t215, t224, t225, t226; in func_pol() local
418 t224 = t22 * t7; in func_pol()
431 …e1 * t62 * t206 - t22 * t209 + t62 * t209 + 0.4e1 * t213 * t215 - 0.4e1 * t224 * t226 + 0.2e1 * t3… in func_pol()
524 …t224 * t162 * t65 * t26 - 0.6e1 * t224 * t225 * t72 + 0.6e1 * t284 * t268 * t72 + 0.3e1 * t500 * t… in func_pol()
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| /dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/ |
| H A D | fun-b97-d.c | 1946 t224*t98*t99-1.169644679491041*t70*t116*t75*t79*t224*t98*t99- in b97_d_third()
2021 t224*t98*t99-.5848223397455204*t70*t116*t75*t79*t224*t98*t99- in b97_d_third()
3279 t165*t224*t98*t99-.5848223397455204*t70*t74*t75*t110*t224* in b97_d_fourth()
4031 t241*t224*t98*t99-7.017868076946245*t70*t116*t75*t110*t224* in b97_d_fourth()
4250 t224*t97*t219*t220-155.8418030943828*t70*t116*t75*t79*t224* in b97_d_fourth()
4361 t79*t224*t98*t99-2.339289358982082*t70*t272*t75*t79*t224*t98* in b97_d_fourth()
4369 t165*t224*t98*t99-2.339289358982082*t70*t167*t75*t110*t224* in b97_d_fourth()
4374 t224*t97*t222*t99+7.017868076946245*t70*t74*t75*t110*t224* in b97_d_fourth()
4477 t224*t98*t99-3.508934038473122*t70*t74*t75*t165*t224*t98*t99- in b97_d_fourth()
4675 t224*t97*t219*t220-51.9472676981276*t70*t116*t75*t79*t224* in b97_d_fourth()
[all …]
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| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/oint3/ |
| H A D | i1323.cc | 227 double t224; in i1323() local
1085 t224=t222+t13; in i1323()
1086 t13=t44*t224; in i1323()
1139 t236=t70*t224; in i1323()
1140 t224=t47+t236; in i1323()
1147 t224=t6*t229; in i1323()
1175 t224=t32*t90; in i1323()
1182 t224=t30*t90; in i1323()
1185 t224=t70*t48; in i1323()
1189 t224=t6*t247; in i1323()
[all …]
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| H A D | i2323.cc | 227 double t224; in i2323() local
1070 t224=t221+t13; in i2323()
1071 t13=t44*t224; in i2323()
1077 t224=t221+t13; in i2323()
1078 t13=t4*t224; in i2323()
1635 t159=t25*t224; in i2323()
1745 t23=t25*t224; in i2323()
2091 t224=t13+t15; in i2323()
2113 t226=t8*t224; in i2323()
2131 t15=t29*t224; in i2323()
[all …]
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| H A D | i0313.cc | 227 double t224; in i0313() local
1108 t215=t29*t224; in i0313()
1152 t13=t6*t224; in i0313()
1159 t237=t4*t224; in i0313()
1543 t292=t14*t224; in i0313()
1718 t127=t43*t224; in i0313()
1722 t127=t25*t224; in i0313()
1736 t224=t25*t248; in i0313()
1738 t224=t43*t240; in i0313()
1743 t224=t4*t90; in i0313()
[all …]
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| H A D | i0303.cc | 227 double t224; in i0303() local
1111 t224=t4*t211; in i0303()
1113 t224=t6*t214; in i0303()
1116 t224=t6*t226; in i0303()
1127 t224=t13*t92; in i0303()
1130 t224=t45*t153; in i0303()
1132 t224=t53*t155; in i0303()
1134 t224=t6*t229; in i0303()
1137 t224=t4*t229; in i0303()
1157 t224=t8*t231; in i0303()
[all …]
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| H A D | i0323.cc | 227 double t224; in i0323() local
1097 t224=t13+t223; in i0323()
1105 t223=t13+t224; in i0323()
1107 t224=t13+t223; in i0323()
1108 t13=t4*t224; in i0323()
2536 t203=t25*t224; in i0323()
2572 t207=t14*t224; in i0323()
2828 t2=t43*t224; in i0323()
2937 t2=t29*t224; in i0323()
3229 t224=t25*t19; in i0323()
[all …]
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwxc/maxima/f77/ |
| H A D | nwxcm_c_opt.F | 1522 t224 = t223+t220+t219
1532 1 1.7121095002288222d-1*t121*t123*t125*t136*t224+t218-3.424
1921 6 5002288222d-1*t121*t123*t125*t224*t225*t283+3.42421900045
1926 ; 6*t224-3.4242190004576445d-1*t123*t126*t131*t136*t215)*t6
2002 > 50-3.4242190004576445d-1*t121*t123*t125*t224*t225*t231+7.
2005 1 84433440117d-1*t121*t125*t136*t216*t217*t224-6.8484380009
2006 2 15289d-1*t121*t123*t126*t136*t215*t224+1.5979688668802342
3357 9 aaa*t114*t193*t224*t30*t94-6.794511054369952d-2*t104*t224
3721 t224 = t223+t220+t219
5109 t916 = -7.98984433440117d-1*t125*t136*t216*t217*t224
[all …]
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| H A D | nwxcm_c_m11.F | 1995 t224 = 2.0d+0*t102*t38
2383 9 +2.0d+0*t142*t54+t261+t260+t224+t223+2.0d+0*t1*t102*t142)
2423 6 142*t54+t261+t260+t224+t223+1.0d+0*t1*t102*t182+1.0d+0*t1
2450 9 4+2.0d+0*t182*t54+t261+t260+t224+t223+2.0d+0*t1*t102*t182
3999 t224 = -2.2726465173623778d-3*t101*t102*t202*t77
4005 2 72+t227+t225+t224+t223+t220+t217+t215+t213+t212+t211+t210
4020 2 t72+t236+t235+t233+t232+t227+t225+t224+t223+t213+t211+t21
5402 t224 = 1/t223
5403 t225 = -3.190260000209101d+0*t224*t40*t43*t91-4.579991491020
8413 2 3652d+0*t124*t23*t62+t21*t224*t23
[all …]
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwxc/maxima/f77/ |
| H A D | nwxcm_c_opt.F | 1522 t224 = t223+t220+t219
1532 1 1.7121095002288222d-1*t121*t123*t125*t136*t224+t218-3.424
1921 6 5002288222d-1*t121*t123*t125*t224*t225*t283+3.42421900045
1926 ; 6*t224-3.4242190004576445d-1*t123*t126*t131*t136*t215)*t6
2002 > 50-3.4242190004576445d-1*t121*t123*t125*t224*t225*t231+7.
2005 1 84433440117d-1*t121*t125*t136*t216*t217*t224-6.8484380009
2006 2 15289d-1*t121*t123*t126*t136*t215*t224+1.5979688668802342
3357 9 aaa*t114*t193*t224*t30*t94-6.794511054369952d-2*t104*t224
3721 t224 = t223+t220+t219
5109 t916 = -7.98984433440117d-1*t125*t136*t216*t217*t224
[all …]
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| H A D | nwxcm_c_m11.F | 1995 t224 = 2.0d+0*t102*t38
2383 9 +2.0d+0*t142*t54+t261+t260+t224+t223+2.0d+0*t1*t102*t142)
2423 6 142*t54+t261+t260+t224+t223+1.0d+0*t1*t102*t182+1.0d+0*t1
2450 9 4+2.0d+0*t182*t54+t261+t260+t224+t223+2.0d+0*t1*t102*t182
3999 t224 = -2.2726465173623778d-3*t101*t102*t202*t77
4005 2 72+t227+t225+t224+t223+t220+t217+t215+t213+t212+t211+t210
4020 2 t72+t236+t235+t233+t232+t227+t225+t224+t223+t213+t211+t21
5402 t224 = 1/t223
5403 t225 = -3.190260000209101d+0*t224*t40*t43*t91-4.579991491020
8413 2 3652d+0*t124*t23*t62+t21*t224*t23
[all …]
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| /dports/science/tinker/tinker/other/ |
| H A D | drotpole.f | 189 real*8 t219,t224,t226,t228 local
337 t224 = -t209*t5*t9 - t59 + 0.5d0*t70*t205
338 t226 = 2.0d0 * (t64*t213 + t68*t219 + t72*t224)
344 t238 = t224 * t76
568 real*8 t217,t220,t222,t224 local
756 t224 = -t217*t28*t40 + 0.5d0*(t220*t210 + t169*t222)
757 t225 = t224 * t186
760 t240 = 2.0d0 * (t174*t224 + t178*t232 + t182*t238)
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