i1322.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::i1322(){
/* the cost is 1260 */
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;
t1=int_v_W0-int_v_p120;
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_p120-int_v_r10;
double*restrictxx int_v_list002=int_v_list00[2];
t4=t3*int_v_list002[0];
t5=t4+t2;
t2=0.5*int_v_ooze;
t4=t2*t5;
t5=int_v_W0-int_v_p340;
t6=t5*int_v_list003[0];
t7=int_v_p340-int_v_r30;
t8=t7*int_v_list002[0];
t9=t8+t6;
t6=int_v_zeta34*int_v_ooze;
t8=int_v_oo2zeta12*t6;
t6=(-1)*t8;
t8=t6*t9;
t10=t8+t4;
t11=t5*int_v_list002[0];
double*restrictxx int_v_list001=int_v_list00[1];
t12=t7*int_v_list001[0];
t13=t12+t11;
t11=int_v_oo2zeta12*t13;
t12=t11+t10;
t10=t2*int_v_list003[0];
double*restrictxx int_v_list004=int_v_list00[4];
t14=t5*int_v_list004[0];
t15=t7*int_v_list003[0];
t16=t15+t14;
t14=t1*t16;
t15=t14+t10;
t14=t3*t9;
t17=t14+t15;
t14=t1*t17;
t15=t14+t12;
t12=t2*int_v_list002[0];
t14=t1*t9;
t18=t14+t12;
t14=t3*t13;
t19=t14+t18;
t14=t3*t19;
t18=t14+t15;
t14=int_v_ooze*2;
t15=0.5*t14;
t20=t15*t18;
t21=t15*t9;
t22=int_v_zeta12*int_v_ooze;
t23=int_v_oo2zeta34*t22;
t22=t23*(-1);
t23=t22*int_v_list003[0];
t24=int_v_oo2zeta34*int_v_list002[0];
t25=t24+t23;
t23=t5*t16;
t24=t23+t25;
t23=t7*t9;
t26=t23+t24;
t23=t1*t26;
t24=t23+t21;
t21=t22*int_v_list002[0];
t23=int_v_oo2zeta34*int_v_list001[0];
t27=t23+t21;
t21=t5*t9;
t23=t21+t27;
t21=t7*t13;
t28=t21+t23;
t21=t3*t28;
t23=t21+t24;
t21=int_v_zeta34*t14;
t14=int_v_oo2zeta12*t21;
t21=(-1)*t14;
t14=t21*t23;
t24=t14+t20;
t14=t15*t13;
t20=t1*t28;
t29=t20+t14;
t14=t22*int_v_list001[0];
double*restrictxx int_v_list000=int_v_list00[0];
t20=int_v_oo2zeta34*int_v_list000[0];
t30=t20+t14;
t14=t5*t13;
t20=t14+t30;
t14=t5*int_v_list001[0];
t31=t7*int_v_list000[0];
t32=t31+t14;
t14=t7*t32;
t31=t14+t20;
t14=t3*t31;
t20=t14+t29;
double***restrictxx int_v_list1=int_v_list(1);
double**restrictxx int_v_list12=int_v_list1[2];
double*restrictxx int_v_list120=int_v_list12[0];
int_v_list120[17]=t20;
t14=int_v_oo2zeta12*2;
t29=t14*t20;
t33=t29+t24;
t24=t15*t17;
t29=t6*t26;
t34=t29+t24;
t24=int_v_oo2zeta12*t28;
t35=t24+t34;
t34=t15*t16;
t36=t22*int_v_list004[0];
t22=int_v_oo2zeta34*int_v_list003[0];
t37=t22+t36;
double*restrictxx int_v_list005=int_v_list00[5];
t22=t5*int_v_list005[0];
t36=t7*int_v_list004[0];
t38=t36+t22;
t22=t5*t38;
t5=t22+t37;
t22=t7*t16;
t7=t22+t5;
t5=t1*t7;
t22=t5+t34;
t5=t3*t26;
t34=t5+t22;
t5=t1*t34;
t22=t5+t35;
t5=t3*t23;
t35=t5+t22;
t5=t1*t35;
t22=t5+t33;
t5=t15*t19;
t33=t6*t28;
t36=t33+t5;
t5=int_v_oo2zeta12*t31;
t39=t5+t36;
t36=t1*t23;
t40=t36+t39;
t36=t3*t20;
t39=t36+t40;
double***restrictxx int_v_list2=int_v_list(2);
double**restrictxx int_v_list22=int_v_list2[2];
double*restrictxx int_v_list220=int_v_list22[0];
int_v_list220[35]=t39;
t36=t3*t39;
t40=t36+t22;
double***restrictxx int_v_list3=int_v_list(3);
double**restrictxx int_v_list32=int_v_list3[2];
double*restrictxx int_v_list320=int_v_list32[0];
int_v_list320[59]=t40;
t22=int_v_W2-int_v_p342;
t36=t22*int_v_list003[0];
t41=int_v_p342-int_v_r32;
t42=t41*int_v_list002[0];
t43=t42+t36;
t36=t6*t43;
t42=t22*int_v_list002[0];
t44=t41*int_v_list001[0];
t45=t44+t42;
t42=int_v_oo2zeta12*t45;
t44=t42+t36;
t46=t22*int_v_list004[0];
t47=t41*int_v_list003[0];
t48=t47+t46;
t46=t1*t48;
t47=t3*t43;
t49=t47+t46;
t46=t1*t49;
t47=t46+t44;
t46=t1*t43;
t50=t3*t45;
t51=t50+t46;
t46=t3*t51;
t50=t46+t47;
t46=t2*t50;
t47=t22*t17;
t52=t41*t19;
t53=t52+t47;
t47=t21*t53;
t52=t47+t46;
t47=t2*t45;
t54=t22*t9;
t55=t41*t13;
t56=t55+t54;
t54=t1*t56;
t55=t54+t47;
t54=t22*t13;
t57=t41*t32;
t58=t57+t54;
t54=t3*t58;
t57=t54+t55;
int_v_list120[16]=t57;
t54=t14*t57;
t55=t54+t52;
t52=t2*t49;
t54=t22*t16;
t59=t41*t9;
t60=t59+t54;
t54=t6*t60;
t59=t54+t52;
t61=int_v_oo2zeta12*t56;
t62=t61+t59;
t59=t2*t48;
t63=t22*t38;
t64=t41*t16;
t65=t64+t63;
t63=t1*t65;
t64=t63+t59;
t63=t3*t60;
t66=t63+t64;
t63=t1*t66;
t64=t63+t62;
t62=t3*t53;
t63=t62+t64;
t62=t1*t63;
t64=t62+t55;
t55=t2*t51;
t62=t6*t56;
t67=t62+t55;
t68=int_v_oo2zeta12*t58;
t69=t68+t67;
t67=t1*t53;
t70=t67+t69;
t67=t3*t57;
t69=t67+t70;
int_v_list220[34]=t69;
t67=t3*t69;
t70=t67+t64;
int_v_list320[58]=t70;
t64=int_v_W1-int_v_p341;
t67=t64*int_v_list003[0];
t71=int_v_p341-int_v_r31;
t72=t71*int_v_list002[0];
t73=t72+t67;
t67=t6*t73;
t72=t71*int_v_list001[0];
t74=t64*int_v_list002[0];
t75=t74+t72;
t72=int_v_oo2zeta12*t75;
t74=t72+t67;
t76=t64*int_v_list004[0];
t77=t71*int_v_list003[0];
t78=t77+t76;
t76=t1*t78;
t77=t3*t73;
t79=t77+t76;
t76=t1*t79;
t77=t76+t74;
t76=t1*t73;
t80=t3*t75;
t81=t80+t76;
t76=t3*t81;
t80=t76+t77;
t76=t2*t80;
t77=t64*t17;
t82=t71*t19;
t83=t82+t77;
t77=t21*t83;
t82=t77+t76;
t77=t2*t75;
t84=t64*t9;
t85=t71*t13;
t86=t85+t84;
t84=t1*t86;
t85=t84+t77;
t84=t64*t13;
t87=t71*t32;
t32=t87+t84;
t84=t3*t32;
t87=t84+t85;
int_v_list120[15]=t87;
t84=t14*t87;
t85=t84+t82;
t82=t2*t79;
t84=t64*t16;
t88=t71*t9;
t89=t88+t84;
t84=t6*t89;
t88=t84+t82;
t90=int_v_oo2zeta12*t86;
t91=t90+t88;
t88=t2*t78;
t92=t64*t38;
t38=t71*t16;
t93=t38+t92;
t38=t1*t93;
t92=t38+t88;
t38=t3*t89;
t94=t38+t92;
t38=t1*t94;
t92=t38+t91;
t38=t3*t83;
t91=t38+t92;
t38=t1*t91;
t92=t38+t85;
t38=t2*t81;
t85=t6*t86;
t95=t85+t38;
t96=int_v_oo2zeta12*t32;
t97=t96+t95;
t95=t1*t83;
t98=t95+t97;
t95=t3*t87;
t97=t95+t98;
int_v_list220[33]=t97;
t95=t3*t97;
t98=t95+t92;
int_v_list320[57]=t98;
t92=t22*t48;
t95=t25+t92;
t92=t41*t43;
t99=t92+t95;
t92=t1*t99;
t95=t22*t43;
t100=t27+t95;
t95=t41*t45;
t101=t95+t100;
t95=t3*t101;
t100=t95+t92;
t92=t21*t100;
t95=t1*t101;
t102=t22*t45;
t103=t30+t102;
t102=t22*int_v_list001[0];
t104=t41*int_v_list000[0];
t105=t104+t102;
t102=t41*t105;
t104=t102+t103;
t102=t3*t104;
t103=t102+t95;
int_v_list120[14]=t103;
t95=t14*t103;
t102=t95+t92;
t92=t6*t99;
t95=int_v_oo2zeta12*t101;
t105=t95+t92;
t106=t22*int_v_list005[0];
t107=t41*int_v_list004[0];
t108=t107+t106;
t106=t22*t108;
t107=t37+t106;
t106=t41*t48;
t108=t106+t107;
t106=t1*t108;
t107=t3*t99;
t109=t107+t106;
t106=t1*t109;
t107=t106+t105;
t106=t3*t100;
t110=t106+t107;
t106=t1*t110;
t107=t106+t102;
t102=t6*t101;
t106=int_v_oo2zeta12*t104;
t111=t106+t102;
t112=t1*t100;
t113=t112+t111;
t112=t3*t103;
t114=t112+t113;
int_v_list220[32]=t114;
t112=t3*t114;
t113=t112+t107;
int_v_list320[56]=t113;
t107=t22*t78;
t112=t41*t73;
t115=t112+t107;
t107=t1*t115;
t112=t22*t73;
t116=t41*t75;
t117=t116+t112;
t112=t3*t117;
t116=t112+t107;
t107=t21*t116;
t112=t1*t117;
t118=t22*t75;
t119=t64*int_v_list001[0];
t120=t71*int_v_list000[0];
t121=t120+t119;
t119=t41*t121;
t120=t119+t118;
t118=t3*t120;
t119=t118+t112;
int_v_list120[13]=t119;
t112=t14*t119;
t118=t112+t107;
t107=t6*t115;
t112=int_v_oo2zeta12*t117;
t122=t112+t107;
t123=t64*int_v_list005[0];
t124=t71*int_v_list004[0];
t125=t124+t123;
t123=t22*t125;
t124=t41*t78;
t126=t124+t123;
t123=t1*t126;
t124=t3*t115;
t127=t124+t123;
t123=t1*t127;
t124=t123+t122;
t122=t3*t116;
t123=t122+t124;
t122=t1*t123;
t124=t122+t118;
t118=t6*t117;
t122=int_v_oo2zeta12*t120;
t128=t122+t118;
t129=t1*t116;
t130=t129+t128;
t128=t3*t119;
t129=t128+t130;
int_v_list220[31]=t129;
t128=t3*t129;
t130=t128+t124;
int_v_list320[55]=t130;
t124=t64*t78;
t128=t25+t124;
t25=t71*t73;
t124=t25+t128;
t25=t1*t124;
t128=t64*t73;
t131=t27+t128;
t27=t71*t75;
t128=t27+t131;
t27=t3*t128;
t131=t27+t25;
t25=t21*t131;
t27=t1*t128;
t132=t64*t75;
t133=t30+t132;
t30=t71*t121;
t121=t30+t133;
t30=t3*t121;
t132=t30+t27;
int_v_list120[12]=t132;
t27=t14*t132;
t30=t27+t25;
t25=t6*t124;
t27=int_v_oo2zeta12*t128;
t133=t27+t25;
t134=t64*t125;
t64=t37+t134;
t37=t71*t78;
t71=t37+t64;
t37=t1*t71;
t64=t3*t124;
t125=t64+t37;
t37=t1*t125;
t64=t37+t133;
t37=t3*t131;
t134=t37+t64;
t37=t1*t134;
t64=t37+t30;
t30=t6*t128;
t37=int_v_oo2zeta12*t121;
t135=t37+t30;
t136=t1*t131;
t1=t136+t135;
t136=t3*t132;
t137=t136+t1;
int_v_list220[30]=t137;
t1=t3*t137;
t3=t1+t64;
int_v_list320[54]=t3;
t1=int_v_W2-int_v_p122;
t64=t1*t35;
t136=int_v_p122-int_v_r12;
t138=t136*t39;
t139=t138+t64;
int_v_list320[53]=t139;
t64=t2*t18;
t18=t1*t63;
t138=t18+t64;
t18=t136*t69;
t140=t18+t138;
int_v_list320[52]=t140;
t18=t1*t91;
t138=t136*t97;
t141=t138+t18;
int_v_list320[51]=t141;
t18=t15*t50;
t50=t1*t110;
t138=t50+t18;
t18=t136*t114;
t50=t18+t138;
int_v_list320[50]=t50;
t18=t1*t123;
t138=t76+t18;
t18=t136*t129;
t76=t18+t138;
int_v_list320[49]=t76;
t18=t1*t134;
t138=t136*t137;
t142=t138+t18;
int_v_list320[48]=t142;
t18=int_v_W1-int_v_p121;
t138=t35*t18;
t35=int_v_p121-int_v_r11;
t143=t35*t39;
t39=t143+t138;
int_v_list320[47]=t39;
t138=t18*t63;
t63=t35*t69;
t69=t63+t138;
int_v_list320[46]=t69;
t63=t18*t91;
t91=t64+t63;
t63=t35*t97;
t64=t63+t91;
int_v_list320[45]=t64;
t63=t18*t110;
t91=t35*t114;
t97=t91+t63;
int_v_list320[44]=t97;
t63=t18*t123;
t91=t46+t63;
t46=t35*t129;
t63=t46+t91;
int_v_list320[43]=t63;
t46=t15*t80;
t80=t18*t134;
t91=t80+t46;
t46=t35*t137;
t80=t46+t91;
int_v_list320[42]=t80;
t46=t6*t23;
t91=int_v_oo2zeta12*t20;
t110=t91+t46;
t46=t1*t34;
t91=t136*t23;
t114=t91+t46;
t46=t1*t114;
t91=t46+t110;
t46=t1*t23;
t114=t136*t20;
t123=t114+t46;
int_v_list220[29]=t123;
t46=t136*t123;
t114=t46+t91;
int_v_list320[41]=t114;
t46=t1*t17;
t91=t136*t19;
t123=t91+t46;
t46=t2*t123;
t91=t6*t53;
t123=t91+t46;
t46=int_v_oo2zeta12*t57;
t129=t46+t123;
t123=t2*t17;
t134=t1*t66;
t137=t134+t123;
t134=t136*t53;
t138=t134+t137;
t134=t1*t138;
t137=t134+t129;
t129=t2*t19;
t134=t1*t53;
t138=t134+t129;
t134=t136*t57;
t143=t134+t138;
int_v_list220[28]=t143;
t134=t136*t143;
t138=t134+t137;
int_v_list320[40]=t138;
t134=t6*t83;
t137=int_v_oo2zeta12*t87;
t143=t137+t134;
t144=t1*t94;
t145=t136*t83;
t146=t145+t144;
t144=t1*t146;
t145=t144+t143;
t143=t1*t83;
t144=t136*t87;
t146=t144+t143;
int_v_list220[27]=t146;
t143=t136*t146;
t144=t143+t145;
int_v_list320[39]=t144;
t143=t1*t49;
t145=t4+t143;
t143=t136*t51;
t146=t143+t145;
t143=t15*t146;
t145=t6*t100;
t146=t145+t143;
t143=int_v_oo2zeta12*t103;
t147=t143+t146;
t146=t15*t49;
t148=t1*t109;
t149=t148+t146;
t146=t136*t100;
t148=t146+t149;
t146=t1*t148;
t148=t146+t147;
t146=t15*t51;
t147=t1*t100;
t149=t147+t146;
t146=t136*t103;
t147=t146+t149;
int_v_list220[26]=t147;
t146=t136*t147;
t147=t146+t148;
int_v_list320[38]=t147;
t146=t1*t79;
t148=t136*t81;
t149=t148+t146;
t146=t2*t149;
t148=t6*t116;
t149=t148+t146;
t146=int_v_oo2zeta12*t119;
t150=t146+t149;
t149=t1*t127;
t151=t82+t149;
t82=t136*t116;
t149=t82+t151;
t82=t1*t149;
t149=t82+t150;
t82=t1*t116;
t150=t38+t82;
t38=t136*t119;
t82=t38+t150;
int_v_list220[25]=t82;
t38=t136*t82;
t82=t38+t149;
int_v_list320[37]=t82;