i0303.cc

大型并行量子化学软件；支持密度泛函（DFT）。可以进行各种量子化学计算。支持CHARMM并行计算。非常具有应用价值。

#include <chemistry/qc/oint3/build.h>
int sc::BuildIntV3::i0303(){
/* the cost is 3407 */
double t1;
double t2;
double t3;
double t4;
double t5;
double t6;
double t7;
double t8;
double t9;
double t10;
double t11;
double t12;
double t13;
double t14;
double t15;
double t16;
double t17;
double t18;
double t19;
double t20;
double t21;
double t22;
double t23;
double t24;
double t25;
double t26;
double t27;
double t28;
double t29;
double t30;
double t31;
double t32;
double t33;
double t34;
double t35;
double t36;
double t37;
double t38;
double t39;
double t40;
double t41;
double t42;
double t43;
double t44;
double t45;
double t46;
double t47;
double t48;
double t49;
double t50;
double t51;
double t52;
double t53;
double t54;
double t55;
double t56;
double t57;
double t58;
double t59;
double t60;
double t61;
double t62;
double t63;
double t64;
double t65;
double t66;
double t67;
double t68;
double t69;
double t70;
double t71;
double t72;
double t73;
double t74;
double t75;
double t76;
double t77;
double t78;
double t79;
double t80;
double t81;
double t82;
double t83;
double t84;
double t85;
double t86;
double t87;
double t88;
double t89;
double t90;
double t91;
double t92;
double t93;
double t94;
double t95;
double t96;
double t97;
double t98;
double t99;
double t100;
double t101;
double t102;
double t103;
double t104;
double t105;
double t106;
double t107;
double t108;
double t109;
double t110;
double t111;
double t112;
double t113;
double t114;
double t115;
double t116;
double t117;
double t118;
double t119;
double t120;
double t121;
double t122;
double t123;
double t124;
double t125;
double t126;
double t127;
double t128;
double t129;
double t130;
double t131;
double t132;
double t133;
double t134;
double t135;
double t136;
double t137;
double t138;
double t139;
double t140;
double t141;
double t142;
double t143;
double t144;
double t145;
double t146;
double t147;
double t148;
double t149;
double t150;
double t151;
double t152;
double t153;
double t154;
double t155;
double t156;
double t157;
double t158;
double t159;
double t160;
double t161;
double t162;
double t163;
double t164;
double t165;
double t166;
double t167;
double t168;
double t169;
double t170;
double t171;
double t172;
double t173;
double t174;
double t175;
double t176;
double t177;
double t178;
double t179;
double t180;
double t181;
double t182;
double t183;
double t184;
double t185;
double t186;
double t187;
double t188;
double t189;
double t190;
double t191;
double t192;
double t193;
double t194;
double t195;
double t196;
double t197;
double t198;
double t199;
double t200;
double t201;
double t202;
double t203;
double t204;
double t205;
double t206;
double t207;
double t208;
double t209;
double t210;
double t211;
double t212;
double t213;
double t214;
double t215;
double t216;
double t217;
double t218;
double t219;
double t220;
double t221;
double t222;
double t223;
double t224;
double t225;
double t226;
double t227;
double t228;
double t229;
double t230;
double t231;
double t232;
double t233;
double t234;
double t235;
double t236;
double t237;
double t238;
double t239;
double t240;
double t241;
double t242;
double t243;
double t244;
double t245;
double t246;
double t247;
double t248;
double t249;
double t250;
double t251;
double t252;
double t253;
double t254;
double t255;
double t256;
double t257;
double t258;
double t259;
double t260;
double t261;
double t262;
double t263;
double t264;
double t265;
double t266;
double t267;
double t268;
double t269;
double t270;
double t271;
double t272;
double t273;
double t274;
double t275;
double t276;
double t277;
double t278;
double t279;
double t280;
double t281;
double t282;
double t283;
double t284;
double t285;
double t286;
double t287;
double t288;
double t289;
double t290;
double t291;
double t292;
double t293;
double t294;
double t295;
double t296;
double t297;
double t298;
double t299;
double t300;
double t301;
double t302;
double t303;
double t304;
double t305;
double t306;
double t307;
double t308;
double t309;
double t310;
t1=0.5*int_v_ooze;
double***restrictxx int_v_list0=int_v_list(0);
double**restrictxx int_v_list00=int_v_list0[0];
double*restrictxx int_v_list003=int_v_list00[3];
t2=t1*int_v_list003[0];
t3=int_v_W0-int_v_p340;
double*restrictxx int_v_list004=int_v_list00[4];
t4=t3*int_v_list004[0];
t5=int_v_p340-int_v_r30;
t6=t5*int_v_list003[0];
t7=t6+t4;
t4=int_v_W0-int_v_p120;
t6=t4*t7;
t8=t6+t2;
t6=t3*int_v_list003[0];
double*restrictxx int_v_list002=int_v_list00[2];
t9=t5*int_v_list002[0];
t10=t9+t6;
t6=int_v_p120-int_v_r10;
t9=t6*t10;
t11=t9+t8;
t8=2*int_v_ooze;
t9=t8*0.5;
t12=t9*t11;
t13=int_v_zeta12*int_v_ooze;
t14=int_v_oo2zeta34*t13;
t13=(-1)*t14;
t14=t13*int_v_list003[0];
t15=int_v_oo2zeta34*int_v_list002[0];
t16=t15+t14;
t14=t3*t7;
t15=t14+t16;
t14=t5*t10;
t17=t14+t15;
t14=int_v_zeta34*int_v_ooze;
t15=int_v_oo2zeta12*t14;
t14=(-1)*t15;
t15=t14*t17;
t18=t15+t12;
t12=t13*int_v_list002[0];
double*restrictxx int_v_list001=int_v_list00[1];
t19=int_v_oo2zeta34*int_v_list001[0];
t20=t19+t12;
t12=t3*t10;
t19=t12+t20;
t12=t3*int_v_list002[0];
t21=t5*int_v_list001[0];
t22=t21+t12;
t12=t5*t22;
t21=t12+t19;
t12=int_v_oo2zeta12*t21;
t19=t12+t18;
t18=t9*t7;
t23=t13*int_v_list004[0];
t24=int_v_oo2zeta34*int_v_list003[0];
t25=t24+t23;
double*restrictxx int_v_list005=int_v_list00[5];
t23=t3*int_v_list005[0];
t24=t5*int_v_list004[0];
t26=t24+t23;
t23=t3*t26;
t24=t23+t25;
t23=t5*t7;
t27=t23+t24;
t23=t4*t27;
t24=t23+t18;
t18=t6*t17;
t23=t18+t24;
t18=t4*t23;
t24=t18+t19;
t18=t9*t10;
t19=t4*t17;
t28=t19+t18;
t18=t6*t21;
t19=t18+t28;
t18=t6*t19;
t28=t18+t24;
t18=int_v_ooze*3;
t24=0.5*t18;
t18=t24*t28;
t29=t24*t17;
t30=int_v_zeta12*t8;
t31=int_v_oo2zeta34*t30;
t30=t31*(-1);
t31=t30*t7;
t32=int_v_oo2zeta34*2;
t33=t32*t10;
t34=t33+t31;
t31=t3*t27;
t33=t31+t34;
t31=t5*t17;
t34=t31+t33;
t31=t4*t34;
t33=t31+t29;
t29=t30*t10;
t31=t32*t22;
t35=t31+t29;
t29=t3*t17;
t31=t29+t35;
t29=t5*t21;
t35=t29+t31;
t29=t6*t35;
t31=t29+t33;
t29=int_v_zeta34*t8;
t8=int_v_oo2zeta12*t29;
t29=(-1)*t8;
t8=t29*t31;
t33=t8+t18;
t8=t24*t21;
t18=t4*t35;
t36=t18+t8;
t8=t30*t22;
t18=t3*int_v_list001[0];
double*restrictxx int_v_list000=int_v_list00[0];
t37=t5*int_v_list000[0];
t38=t37+t18;
double**restrictxx int_v_list01=int_v_list0[1];
double*restrictxx int_v_list010=int_v_list01[0];
int_v_list010[2]=t38;
t18=t32*t38;
t37=t18+t8;
t8=t3*t21;
t18=t8+t37;
t8=t13*int_v_list001[0];
t37=int_v_oo2zeta34*int_v_list000[0];
t39=t37+t8;
t8=t3*t22;
t37=t8+t39;
t8=t5*t38;
t40=t8+t37;
double**restrictxx int_v_list02=int_v_list0[2];
double*restrictxx int_v_list020=int_v_list02[0];
int_v_list020[5]=t40;
t8=t5*t40;
t37=t8+t18;
double**restrictxx int_v_list03=int_v_list0[3];
double*restrictxx int_v_list030=int_v_list03[0];
int_v_list030[9]=t37;
t8=t6*t37;
t18=t8+t36;
double***restrictxx int_v_list1=int_v_list(1);
double**restrictxx int_v_list13=int_v_list1[3];
double*restrictxx int_v_list130=int_v_list13[0];
int_v_list130[29]=t18;
t8=int_v_oo2zeta12*2;
t36=t8*t18;
t41=t36+t33;
t33=t24*t23;
t36=t14*t34;
t42=t36+t33;
t33=int_v_oo2zeta12*t35;
t43=t33+t42;
t42=t24*t27;
t44=t30*t26;
t45=t32*t7;
t46=t45+t44;
t44=t13*int_v_list005[0];
t45=int_v_oo2zeta34*int_v_list004[0];
t47=t45+t44;
double*restrictxx int_v_list006=int_v_list00[6];
t44=t3*int_v_list006[0];
t45=t5*int_v_list005[0];
t48=t45+t44;
t44=t3*t48;
t45=t44+t47;
t44=t5*t26;
t49=t44+t45;
t44=t3*t49;
t45=t44+t46;
t44=t5*t27;
t46=t44+t45;
t44=t4*t46;
t45=t44+t42;
t42=t6*t34;
t44=t42+t45;
t42=t4*t44;
t45=t42+t43;
t42=t6*t31;
t43=t42+t45;
t42=t4*t43;
t45=t42+t41;
t41=t24*t19;
t42=t14*t35;
t50=t42+t41;
t41=int_v_oo2zeta12*t37;
t51=t41+t50;
t50=t4*t31;
t52=t50+t51;
t50=t6*t18;
t51=t50+t52;
double***restrictxx int_v_list2=int_v_list(2);
double**restrictxx int_v_list23=int_v_list2[3];
double*restrictxx int_v_list230=int_v_list23[0];
int_v_list230[59]=t51;
t50=t6*t51;
t52=t50+t45;
double***restrictxx int_v_list3=int_v_list(3);
double**restrictxx int_v_list33=int_v_list3[3];
double*restrictxx int_v_list330=int_v_list33[0];
int_v_list330[99]=t52;
t45=int_v_W2-int_v_p342;
t50=t45*int_v_list004[0];
t53=int_v_p342-int_v_r32;
t54=t53*int_v_list003[0];
t55=t54+t50;
t50=t4*t55;
t54=t45*int_v_list003[0];
t56=t53*int_v_list002[0];
t57=t56+t54;
t54=t6*t57;
t56=t54+t50;
t50=t1*t56;
t54=t45*t7;
t58=t53*t10;
t59=t58+t54;
t54=t14*t59;
t58=t54+t50;
t60=t45*t10;
t61=t53*t22;
t62=t61+t60;
t60=int_v_oo2zeta12*t62;
t61=t60+t58;
t58=t1*t55;
t63=t45*t26;
t64=t53*t7;
t65=t64+t63;
t63=t4*t65;
t64=t63+t58;
t63=t6*t59;
t66=t63+t64;
t63=t4*t66;
t64=t63+t61;
t61=t45*t11;
t63=t1*int_v_list002[0];
t67=t4*t10;
t68=t67+t63;
t67=t6*t22;
t69=t67+t68;
t67=t53*t69;
t68=t67+t61;
t61=t6*t68;
t67=t61+t64;
t61=t9*t67;
t64=t45*t23;
t70=t53*t19;
t71=t70+t64;
t64=t29*t71;
t70=t64+t61;
t64=t45*t19;
t72=t9*t22;
t73=t4*t21;
t74=t73+t72;
t72=t6*t40;
t73=t72+t74;
double**restrictxx int_v_list12=int_v_list1[2];
double*restrictxx int_v_list120=int_v_list12[0];
int_v_list120[17]=t73;
t72=t53*t73;
t74=t72+t64;
int_v_list130[28]=t74;
t64=t8*t74;
t72=t64+t70;
t64=t9*t66;
t70=t45*t27;
t75=t53*t17;
t76=t75+t70;
t70=t14*t76;
t75=t70+t64;
t77=t45*t17;
t78=t53*t21;
t79=t78+t77;
t77=int_v_oo2zeta12*t79;
t78=t77+t75;
t75=t9*t65;
t80=t45*t49;
t81=t53*t27;
t82=t81+t80;
t80=t4*t82;
t81=t80+t75;
t80=t6*t76;
t83=t80+t81;
t80=t4*t83;
t81=t80+t78;
t78=t6*t71;
t80=t78+t81;
t78=t4*t80;
t81=t78+t72;
t72=t45*t28;
t78=t9*t69;
t84=t14*t21;
t85=t84+t78;
t78=int_v_oo2zeta12*t40;
t86=t78+t85;
t85=t4*t19;
t87=t85+t86;
t85=t6*t73;
t86=t85+t87;
double**restrictxx int_v_list22=int_v_list2[2];
double*restrictxx int_v_list220=int_v_list22[0];
int_v_list220[35]=t86;
t85=t53*t86;
t87=t85+t72;
int_v_list230[58]=t87;
t72=t6*t87;
t85=t72+t81;
int_v_list330[98]=t85;
t72=int_v_W1-int_v_p341;
t81=t72*int_v_list004[0];
t88=int_v_p341-int_v_r31;
t89=t88*int_v_list003[0];
t90=t89+t81;
t81=t4*t90;
t89=t72*int_v_list003[0];
t91=t88*int_v_list002[0];
t92=t91+t89;
t89=t6*t92;
t91=t89+t81;
t81=t1*t91;
t89=t72*t7;
t93=t88*t10;
t94=t93+t89;
t89=t14*t94;
t93=t89+t81;
t95=t72*t10;
t96=t88*t22;
t97=t96+t95;
t95=int_v_oo2zeta12*t97;
t96=t95+t93;
t93=t1*t90;
t98=t72*t26;
t99=t88*t7;
t100=t99+t98;
t98=t4*t100;
t99=t98+t93;
t98=t6*t94;
t101=t98+t99;
t98=t4*t101;
t99=t98+t96;
t96=t72*t11;
t98=t88*t69;
t102=t98+t96;
t96=t6*t102;
t98=t96+t99;
t96=t9*t98;
t99=t72*t23;
t103=t88*t19;
t104=t103+t99;
t99=t29*t104;
t103=t99+t96;
t99=t72*t19;
t105=t88*t73;
t106=t105+t99;
int_v_list130[27]=t106;
t99=t8*t106;
t105=t99+t103;
t99=t9*t101;
t103=t72*t27;
t107=t88*t17;
t108=t107+t103;
t103=t14*t108;
t107=t103+t99;
t109=t72*t17;
t110=t88*t21;
t111=t110+t109;
t109=int_v_oo2zeta12*t111;
t110=t109+t107;
t107=t9*t100;
t112=t72*t49;
t113=t88*t27;
t114=t113+t112;
t112=t4*t114;
t113=t112+t107;
t112=t6*t108;
t115=t112+t113;
t112=t4*t115;
t113=t112+t110;
t110=t6*t104;
t112=t110+t113;
t110=t4*t112;
t113=t110+t105;
t105=t72*t28;
t110=t88*t86;
t116=t110+t105;
int_v_list230[57]=t116;
t105=t6*t116;
t110=t105+t113;
int_v_list330[97]=t110;
t105=t45*t55;
t113=t16+t105;
t105=t53*t57;
t117=t105+t113;
t105=t14*t117;
t113=t45*t57;
t118=t20+t113;
t113=t45*int_v_list002[0];
t119=t53*int_v_list001[0];
t120=t119+t113;
t113=t53*t120;
t119=t113+t118;
t113=int_v_oo2zeta12*t119;
t118=t113+t105;
t121=t45*int_v_list005[0];
t122=t53*int_v_list004[0];
t123=t122+t121;
t121=t45*t123;
t122=t25+t121;
t121=t53*t55;
t124=t121+t122;
t121=t4*t124;
t122=t6*t117;
t125=t122+t121;
t121=t4*t125;
t122=t121+t118;
t121=t4*t117;
t126=t6*t119;
t127=t126+t121;
t121=t6*t127;
t126=t121+t122;
t121=t1*t126;
t122=t1*t117;
t128=t13*t7;
t129=int_v_oo2zeta34*t10;
t130=t129+t128;
t128=t45*t65;
t129=t128+t130;
t128=t53*t59;
t131=t128+t129;
t128=t4*t131;
t129=t128+t122;
t128=t13*t10;
t132=int_v_oo2zeta34*t22;
t133=t132+t128;
t128=t45*t59;
t132=t128+t133;
t128=t53*t62;
t134=t128+t132;
t128=t6*t134;
t132=t128+t129;
t128=t29*t132;
t129=t128+t121;
t128=t1*t119;
t135=t4*t134;
t136=t135+t128;
t135=t13*t22;
t137=int_v_oo2zeta34*t38;
t138=t137+t135;
t135=t45*t62;
t137=t135+t138;
t135=t45*t22;
t139=t53*t38;
t140=t139+t135;
int_v_list020[4]=t140;
t135=t53*t140;
t139=t135+t137;
int_v_list030[6]=t139;
t135=t6*t139;
t137=t135+t136;
int_v_list130[26]=t137;
t135=t8*t137;
t136=t135+t129;
t129=t1*t125;
t135=t14*t131;
t141=t135+t129;
t142=int_v_oo2zeta12*t134;
t143=t142+t141;
t141=t1*t124;
t144=t13*t26;
t145=int_v_oo2zeta34*t7;
t146=t145+t144;
t144=t45*t48;
t145=t53*t26;
t147=t145+t144;
t144=t45*t147;
t145=t144+t146;
t144=t53*t65;
t147=t144+t145;
t144=t4*t147;
t145=t144+t141;
t144=t6*t131;
t148=t144+t145;
t144=t4*t148;
t145=t144+t143;
t143=t6*t132;
t144=t143+t145;
t143=t4*t144;
t145=t143+t136;
t136=t1*t127;
t143=t14*t134;
t149=t143+t136;
t150=int_v_oo2zeta12*t139;
t151=t150+t149;
t149=t4*t132;
t152=t149+t151;
t149=t6*t137;
t151=t149+t152;
int_v_list230[56]=t151;
t149=t6*t151;
t152=t149+t145;
int_v_list330[96]=t152;
t145=t45*t90;
t149=t53*t92;
t153=t149+t145;
t145=t14*t153;
t149=t45*t92;
t154=t72*int_v_list002[0];
t155=t88*int_v_list001[0];
t156=t155+t154;
t154=t53*t156;
t155=t154+t149;
t149=int_v_oo2zeta12*t155;
t154=t149+t145;
t157=t72*int_v_list005[0];
t158=t88*int_v_list004[0];
t159=t158+t157;
t157=t45*t159;
t158=t53*t90;
t160=t158+t157;
t157=t4*t160;
t158=t6*t153;