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📄 i2302.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。
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t30=t25+t103;t25=t23+t34;t23=t138*t98;t34=t23+t25;t23=t145*t106;t86=t23+t34;int_v_list220[17]=t86;t23=t145*t86;t34=t23+t30;int_v_list320[23]=t34;t23=t12+t9;t9=t138*t17;t12=t145*t10;t30=t12+t9;t9=t138*t30;t12=t9+t23;t9=t138*t10;t86=t145*t14;t98=t86+t9;t9=t145*t98;t86=t9+t12;t9=3*int_v_ooze;t12=t9*0.5;t9=t12*t86;t103=t22*t30;t106=t15*t98;t113=t106+t103;t103=t7*t17;t106=int_v_oo2zeta12*t10;t118=t106+t103;t103=t138*t39;t39=t145*t17;t106=t39+t103;t39=t138*t106;t103=t39+t118;t39=t145*t30;t30=t39+t103;t39=t138*t30;t30=t39+t113;t39=t145*t86;t103=t39+t30;t30=t37*t103;t39=t30+t9;t9=t22*t98;t30=t138*t14;t106=t145*t33;t113=t106+t30;t30=t15*t113;t106=t30+t9;t9=t138*t86;t30=t9+t106;t9=t138*int_v_list003[0];t106=t145*int_v_list002[0];t113=t106+t9;t9=t138*t113;t106=t73+t9;t9=t138*int_v_list002[0];t118=t145*int_v_list001[0];t126=t118+t9;t9=t145*t126;t118=t9+t106;t9=t6*t118;t106=t138*t126;t130=t75+t106;t106=t138*int_v_list001[0];t135=t145*int_v_list000[0];t139=t135+t106;t106=t145*t139;t135=t106+t130;int_v_list200[2]=t135;t106=t8*t135;t130=t106+t9;int_v_list210[8]=t130;t9=t145*t130;t106=t9+t30;double**restrictxx int_v_list31=int_v_list3[1];double*restrictxx int_v_list310=int_v_list31[0];int_v_list310[11]=t106;t9=t44*t106;t30=t9+t39;int_v_list320[22]=t30;t9=t58*t103;t39=t78*t106;t103=t39+t9;int_v_list320[21]=t103;t9=t2*t113;t39=t41+t9;t9=t45+t39;t39=t138*t51;t41=t11+t39;t39=t145*t46;t45=t39+t41;t39=t138*t45;t41=t39+t9;t9=t138*t46;t39=t13+t9;t9=t145*t48;t106=t9+t39;t9=t145*t106;t39=t9+t41;t9=t16*t39;t41=t16*t46;t113=t138*t102;t142=t113+t41;t41=t145*t104;t113=t41+t142;t41=t22*t113;t142=t41+t9;t9=t16*t48;t41=t138*t104;t151=t41+t9;t9=t145*t107;t41=t9+t151;t9=t15*t41;t151=t9+t142;t9=t16*t45;t45=t91+t9;t9=t99+t45;t45=t16*t51;t91=t138*t112;t99=t91+t45;t45=t145*t102;t91=t45+t99;t45=t138*t91;t91=t45+t9;t9=t145*t113;t45=t9+t91;t9=t138*t45;t45=t9+t151;t9=t16*t106;t91=t105+t9;t9=t110+t91;t91=t138*t113;t99=t91+t9;t9=t145*t41;t41=t9+t99;int_v_list220[14]=t41;t9=t145*t41;t41=t9+t45;int_v_list320[20]=t41;t9=t138*t85;t45=t145*t80;t91=t45+t9;t9=t138*t91;t45=t81+t9;t9=t138*t80;t81=t145*t82;t99=t81+t9;t9=t145*t99;t81=t9+t45;t9=t12*t81;t12=t22*t91;t45=t15*t99;t105=t45+t12;t12=t138*t128;t45=t145*t85;t110=t45+t12;t12=t138*t110;t45=t7*t85;t110=int_v_oo2zeta12*t80;t113=t110+t45;t45=t113+t12;t12=t145*t91;t91=t12+t45;t12=t138*t91;t45=t12+t105;t12=t145*t81;t91=t12+t45;t12=t37*t91;t45=t12+t9;t9=t22*t99;t12=t138*t82;t91=t145*t125;t105=t91+t12;t12=t15*t105;t91=t12+t9;t9=t138*t81;t12=t9+t91;t9=t58*t118;t91=t78*t135;t105=t91+t9;int_v_list210[6]=t105;t9=t145*t105;t91=t9+t12;int_v_list310[9]=t91;t9=t44*t91;t12=t9+t45;int_v_list320[19]=t12;t9=t138*t121;t45=t145*t127;t91=t45+t9;t9=t22*t91;t45=t138*t127;t110=t145*t134;t113=t110+t45;t45=t15*t113;t110=t45+t9;t9=t138*t137;t45=t145*t121;t128=t45+t9;t9=t138*t128;t45=t136+t9;t9=t145*t91;t128=t9+t45;t9=t138*t128;t45=t9+t110;t9=t138*t91;t91=t141+t9;t9=t145*t113;t110=t9+t91;int_v_list220[12]=t110;t9=t145*t110;t91=t9+t45;int_v_list320[18]=t91;t9=t83*t27;t45=t36*t29;t110=t45+t9;t9=t7*t110;t45=t83*t29;t29=t36*t32;t32=t29+t45;t29=int_v_oo2zeta12*t32;t45=t29+t9;t9=t83*t40;t29=t36*t27;t27=t29+t9;t9=t138*t27;t29=t145*t110;t40=t29+t9;t9=t138*t40;t29=t9+t45;t9=t138*t110;t40=t145*t32;t45=t40+t9;int_v_list220[11]=t45;t9=t145*t45;t40=t9+t29;int_v_list320[17]=t40;t9=t83*t62;t29=t36*t65;t45=t29+t9;t9=t7*t45;t29=t83*t17;t65=t36*t10;t113=t65+t29;t29=t138*t113;t65=t83*t10;t128=t36*t14;t136=t128+t65;t65=t145*t136;t128=t65+t29;t29=t2*t128;t65=t29+t9;t9=t37*t136;t29=t83*t14;t141=t36*t33;t33=t141+t29;t29=t44*t33;t141=t29+t9;t9=int_v_oo2zeta12*t141;t29=t9+t65;t9=t83*t68;t65=t36*t62;t62=t65+t9;t9=t138*t62;t65=t2*t113;t68=t65+t9;t9=t145*t45;t142=t9+t68;t9=t138*t142;t68=t9+t29;t9=t138*t45;t29=t2*t136;t142=t29+t9;t9=t145*t141;t29=t9+t142;int_v_list220[10]=t29;t9=t145*t29;t29=t9+t68;int_v_list320[16]=t29;t9=t83*t94;t68=t2*t10;t10=t68+t9;t9=t36*t97;t68=t9+t10;t9=t7*t68;t10=t58*t136;t97=t2*t14;t14=t97+t10;t10=t78*t33;t97=t10+t14;t10=int_v_oo2zeta12*t97;t14=t10+t9;t9=t83*t100;t10=t2*t17;t17=t10+t9;t9=t36*t94;t10=t9+t17;t9=t138*t10;t17=t145*t68;t94=t17+t9;t9=t138*t94;t17=t9+t14;t9=t138*t68;t14=t145*t97;t94=t14+t9;int_v_list220[9]=t94;t9=t145*t94;t14=t9+t17;int_v_list320[15]=t14;t9=t83*t51;t17=t36*t46;t51=t17+t9;t9=t138*t51;t17=t83*int_v_list003[0];t94=t36*int_v_list002[0];t100=t94+t17;t17=t2*t100;t94=t17+t9;t9=t83*t46;t46=t36*t48;t142=t46+t9;t9=t145*t142;t46=t9+t94;t9=t16*t46;t94=t83*t102;t151=t36*t104;t153=t151+t94;t94=t7*t153;t151=t94+t9;t9=t83*t104;t94=t36*t107;t104=t94+t9;t9=int_v_oo2zeta12*t104;t94=t9+t151;t9=t16*t51;t107=t83*t112;t112=t36*t102;t102=t112+t107;t107=t138*t102;t112=t107+t9;t9=t145*t153;t107=t9+t112;t9=t138*t107;t107=t9+t94;t9=t16*t142;t94=t138*t153;t112=t94+t9;t9=t145*t104;t94=t9+t112;int_v_list220[8]=t94;t9=t145*t94;t94=t9+t107;int_v_list320[14]=t94;t9=t83*t85;t107=t11+t9;t9=t36*t80;t11=t9+t107;t9=t138*t11;t107=t83*t80;t112=t13+t107;t13=t36*t82;t107=t13+t112;t13=t145*t107;t112=t13+t9;t9=t2*t112;t13=t37*t11;t151=t44*t107;t155=t151+t13;t13=t7*t155;t151=t13+t9;t9=t37*t107;t13=t83*t82;t157=t57+t13;t13=t36*t125;t125=t13+t157;t13=t44*t125;t157=t13+t9;t9=int_v_oo2zeta12*t157;t13=t9+t151;t9=t2*t11;t151=t83*t129;t129=t61+t151;t61=t36*t119;t119=t61+t129;t61=t138*t119;t129=t61+t9;t9=t145*t155;t61=t9+t129;t9=t138*t61;t61=t9+t13;t9=t2*t107;t13=t138*t155;t129=t13+t9;t9=t145*t157;t13=t9+t129;int_v_list220[7]=t13;t9=t145*t13;t13=t9+t61;int_v_list320[13]=t13;t9=t16*t80;t61=t83*t121;t80=t61+t9;t9=t36*t127;t61=t9+t80;t9=t7*t61;t80=t16*t82;t82=t83*t127;t127=t82+t80;t80=t36*t134;t82=t80+t127;t80=int_v_oo2zeta12*t82;t127=t80+t9;t9=t16*t85;t80=t83*t137;t85=t80+t9;t9=t36*t121;t80=t9+t85;t9=t138*t80;t85=t145*t61;t121=t85+t9;t9=t138*t121;t85=t9+t127;t9=t138*t61;t121=t145*t82;t127=t121+t9;int_v_list220[6]=t127;t9=t145*t127;t121=t9+t85;int_v_list320[12]=t121;t9=t83*t27;t27=t4+t9;t4=t36*t110;t9=t4+t27;t4=t138*t9;t27=t83*t110;t85=t25+t27;t25=t36*t32;t27=t25+t85;int_v_list220[5]=t27;t25=t145*t27;t85=t25+t4;int_v_list320[11]=t85;t4=t63+t55;t25=t83*t62;t55=t25+t4;t4=t36*t45;t25=t4+t55;t4=t138*t25;t55=t83*t113;t62=t23+t55;t23=t36*t136;t55=t23+t62;t23=t2*t55;t62=t23+t4;t4=t37*t55;t63=t83*t100;t113=t73+t63;t63=t83*int_v_list002[0];t73=t36*int_v_list001[0];t127=t73+t63;t63=t36*t127;t73=t63+t113;t63=t6*t73;t6=t83*t127;t113=t75+t6;t6=t83*int_v_list001[0];t75=t36*int_v_list000[0];t129=t75+t6;t6=t36*t129;t75=t6+t113;int_v_list200[0]=t75;t6=t8*t75;t8=t6+t63;int_v_list210[2]=t8;t6=t44*t8;t63=t6+t4;int_v_list220[4]=t63;t4=t145*t63;t6=t4+t62;int_v_list320[10]=t6;t4=t89+t65;t62=t95+t4;t4=t83*t10;t10=t4+t62;t4=t36*t68;t62=t4+t10;t4=t138*t62;t10=t16*t136;t65=t58*t55;t89=t65+t10;t10=t78*t8;t65=t10+t89;int_v_list220[3]=t65;t10=t145*t65;t89=t10+t4;int_v_list320[9]=t89;t4=t83*t51;t10=t47+t4;t4=t36*t142;t47=t4+t10;t4=t16*t47;t10=t83*t102;t95=t109+t10;t10=t36*t153;t102=t10+t95;t10=t138*t102;t95=t10+t4;t4=t83*t153;t10=t115+t4;t4=t36*t104;t109=t4+t10;int_v_list220[2]=t109;t4=t145*t109;t10=t4+t95;int_v_list320[8]=t10;t4=t67+t17;t17=t79+t4;t4=t83*t11;t67=t4+t17;t4=t36*t107;t17=t4+t67;t4=t2*t17;t67=t2*t51;t51=t111+t67;t67=t116+t51;t51=t83*t119;t79=t51+t67;t51=t36*t155;t67=t51+t79;t51=t138*t67;t79=t51+t4;t4=t37*t17;t51=t16*t127;t95=t58*t73;t111=t95+t51;t51=t78*t75;t95=t51+t111;int_v_list210[0]=t95;t51=t44*t95;t111=t51+t4;int_v_list220[1]=t111;t4=t145*t111;t51=t4+t79;int_v_list320[7]=t51;t4=t16*t11;t11=t26+t4;t4=t28+t11;t11=t83*t80;t26=t11+t4;t4=t36*t61;t11=t4+t26;t4=t138*t11;t26=t16*t107;t28=t31+t26;t26=t38+t28;t28=t83*t61;t31=t28+t26;t26=t36*t82;t28=t26+t31;int_v_list220[0]=t28;t26=t145*t28;t31=t26+t4;int_v_list320[6]=t31;t4=t22*t110;t26=t15*t32;t32=t26+t4;t4=t83*t9;t9=t4+t32;t4=t36*t27;t26=t4+t9;int_v_list320[5]=t26;t4=t22*t45;t9=t15*t141;t27=t9+t4;t4=t83*t25;t9=t4+t27;t4=t36*t63;t25=t4+t9;int_v_list320[4]=t25;t4=t22*t68;t9=t23+t4;t4=t15*t97;t23=t4+t9;t4=t83*t62;t9=t4+t23;t4=t36*t65;t23=t4+t9;int_v_list320[3]=t23;t4=t22*t153;t9=t15*t104;t27=t9+t4;t4=t83*t102;t9=t4+t27;t4=t36*t109;t27=t4+t9;int_v_list320[2]=t27;t4=t22*t155;t9=t2*t47;t32=t9+t4;t4=t15*t157;t9=t4+t32;t4=t83*t67;t32=t4+t9;t4=t36*t111;t9=t4+t32;int_v_list320[1]=t9;t4=t16*t17;t32=t22*t61;t38=t32+t4;t4=t15*t82;t32=t4+t38;t4=t83*t11;t11=t4+t32;t4=t36*t28;t28=t4+t11;int_v_list320[0]=t28;t4=t2*t74;t11=t22*t20;t32=t11+t4;t11=t15*t60;t38=t11+t32;t11=t1*t19;t32=t11+t38;t11=t3*t70;t38=t11+t32;int_v_list310[29]=t38;t11=t22*t54;t32=t1*t48;t45=t3*t108;t61=t45+t32;t32=t15*t61;t45=t32+t11;t11=t1*t53;t32=t11+t45;t11=t37*t74;t45=t44*t76;t62=t45+t11;int_v_list210[16]=t62;t11=t3*t62;t45=t11+t32;int_v_list310[28]=t45;t11=t22*t88;t32=t15*t124;t63=t32+t11;t11=t1*t87;t32=t11+t63;t11=t3*t132;t63=t11+t32;int_v_list310[27]=t63;t11=t138*t19;t32=t145*t70;t65=t32+t11;int_v_list310[26]=t65;t11=t138*t53;t32=t4+t11;t11=t145*t62;t67=t11+t32;int_v_list310[25]=t67;t11=t138*t87;t32=t145*t132;t68=t32+t11;int_v_list310[24]=t68;t11=t83*t19;t19=t36*t70;t32=t19+t11;int_v_list310[23]=t32;t11=t83*t53;t19=t36*t62;t53=t19+t11;int_v_list310[22]=t53;t11=t83*t87;t19=t4+t11;t4=t36*t132;t11=t4+t19;int_v_list310[21]=t11;t4=t7*t20;t19=int_v_oo2zeta12*t60;t62=t19+t4;t4=t138*t140;t19=t4+t62;t4=t138*t20;t70=t145*t60;t79=t70+t4;int_v_list210[14]=t79;t4=t145*t79;t70=t4+t19;int_v_list310[20]=t70;t4=t138*t5;t19=t145*t71;t79=t19+t4;t4=t2*t79;t19=t7*t54;t80=t19+t4;t4=int_v_oo2zeta12*t61;t82=t4+t80;t80=t138*t158;t87=t80+t82;t80=t138*t54;t82=t120+t80;t80=t145*t61;t97=t80+t82;int_v_list210[13]=t97;t80=t145*t97;t82=t80+t87;int_v_list310[19]=t82;t80=t7*t88;t87=int_v_oo2zeta12*t124;t97=t87+t80;t102=t138*t162;t104=t102+t97;t97=t138*t88;t88=t145*t124;t102=t88+t97;int_v_list210[12]=t102;t88=t145*t102;t97=t88+t104;int_v_list310[18]=t97;t88=t138*t35;t102=t83*t20;t20=t36*t60;t60=t20+t102;int_v_list210[11]=t60;t20=t145*t60;t102=t20+t88;int_v_list310[17]=t102;t20=t83*t5;t5=t36*t71;t88=t5+t20;t5=t2*t88;t20=t138*t69;t104=t20+t5;t20=t83*t54;t54=t36*t61;t61=t54+t20;int_v_list210[10]=t61;t20=t145*t61;t54=t20+t104;int_v_list310[16]=t54;t20=t138*t24;t104=t145*t144;t109=t104+t20;int_v_list310[15]=t109;t20=t83*t35;t35=t62+t20;t20=t36*t60;t60=t20+t35;int_v_list310[14]=t60;t20=t4+t19;t4=t83*t69;t19=t4+t20;t4=t36*t61;t20=t4+t19;int_v_list310[13]=t20;t4=t80+t5;t5=t87+t4;t4=t83*t24;t19=t4+t5;t4=t36*t144;t5=t4+t19;int_v_list310[12]=t5;t4=t22*t106;t19=t2*t118;t24=t19+t4;t4=t138*t48;t19=t57+t4;t4=t145*t108;t35=t4+t19;t4=t15*t35;t19=t4+t24;t4=t138*t39;t24=t4+t19;t4=t16*t126;t19=t37*t118;t35=t19+t4;t4=t44*t135;t19=t4+t35;int_v_list210[7]=t19;t4=t145*t19;t19=t4+t24;int_v_list310[10]=t19;t4=t7*t136;t24=int_v_oo2zeta12*t33;t35=t24+t4;t4=t138*t128;t24=t4+t35;t4=t138*t136;t35=t145*t33;t39=t35+t4;int_v_list210[5]=t39;t4=t145*t39;t35=t4+t24;int_v_list310[8]=t35;t4=t7*t142;t24=t138*t100;t39=t145*t127;t57=t39+t24;t24=t2*t57;t39=t24+t4;t4=t83*t48;t24=t36*t108;t48=t24+t4;t4=int_v_oo2zeta12*t48;t24=t4+t39;t4=t138*t46;t39=t4+t24;t4=t138*t142;t24=t2*t127;t46=t24+t4;t4=t145*t48;t24=t4+t46;int_v_list210[4]=t24;t4=t145*t24;t24=t4+t39;int_v_list310[7]=t24;t4=t7*t107;t39=int_v_oo2zeta12*t125;t46=t39+t4;t4=t138*t112;t39=t4+t46;t4=t138*t107;t46=t145*t125;t61=t46+t4;int_v_list210[3]=t61;t4=t145*t61;t46=t4+t39;int_v_list310[6]=t46;t4=t138*t55;t39=t145*t8;t61=t39+t4;int_v_list310[5]=t61;t4=t138*t47;t39=t2*t73;t2=t39+t4;t4=t37*t73;t62=t44*t75;t69=t62+t4;int_v_list210[1]=t69;t4=t145*t69;t62=t4+t2;int_v_list310[4]=t62;t2=t138*t17;t4=t145*t95;t80=t4+t2;int_v_list310[3]=t80;t2=t22*t136;t4=t15*t33;t33=t4+t2;t2=t83*t55;t4=t2+t33;t2=t36*t8;t8=t2+t4;int_v_list310[2]=t8;t2=t22*t142;t4=t15*t48;t33=t4+t2;t2=t83*t47;t4=t2+t33;t2=t36*t69;t33=t2+t4;int_v_list310[1]=t33;t2=t22*t107;t4=t39+t2;t2=t15*t125;t39=t2+t4;t2=t83*t17;t4=t2+t39;t2=t36*t95;t17=t2+t4;int_v_list310[0]=t17;t2=t22*t71;t4=t15*t77;t39=t4+t2;t2=t1*t74;t1=t2+t39;t2=t3*t76;t3=t2+t1;double**restrictxx int_v_list30=int_v_list3[0];double*restrictxx int_v_list300=int_v_list30[0];int_v_list300[9]=t3;t1=t138*t74;t2=t145*t76;t4=t2+t1;int_v_list300[8]=t4;t1=t83*t74;t2=t36*t76;t39=t2+t1;int_v_list300[7]=t39;t1=t7*t71;t2=int_v_oo2zeta12*t77;t47=t2+t1;t1=t138*t79;t2=t1+t47;t1=t138*t71;t48=t145*t77;t55=t48+t1;int_v_list200[4]=t55;t1=t145*t55;t48=t1+t2;int_v_list300[6]=t48;t1=t138*t88;t2=t83*t71;t55=t36*t77;t69=t55+t2;int_v_list200[3]=t69;t2=t145*t69;t55=t2+t1;int_v_list300[5]=t55;t1=t83*t88;t2=t47+t1;t1=t36*t69;t47=t1+t2;int_v_list300[4]=t47;t1=t22*t126;t2=t15*t139;t69=t2+t1;t1=t138*t118;t2=t1+t69;t1=t145*t135;t69=t1+t2;int_v_list300[3]=t69;t1=t7*t127;t2=int_v_oo2zeta12*t129;t7=t2+t1;t1=t138*t57;t2=t1+t7;t1=t138*t127;t7=t145*t129;t57=t7+t1;int_v_list200[1]=t57;t1=t145*t57;t7=t1+t2;int_v_list300[2]=t7;t1=t138*t73;t2=t145*t75;t57=t2+t1;int_v_list300[1]=t57;t1=t22*t127;t2=t15*t129;t15=t2+t1;t1=t83*t73;t2=t1+t15;t1=t36*t75;t15=t1+t2;int_v_list300[0]=t15;t1=t16*t98;t2=t37*t86;t22=t2+t1;t1=t44*t130;t2=t1+t22;int_v_list220[16]=t2;t1=t58*t86;t22=t78*t130;t36=t22+t1;int_v_list220[15]=t36;t1=t16*t99;t16=t37*t81;t22=t16+t1;t1=t44*t105;t16=t1+t22;int_v_list220[13]=t16;return 1;}

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