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。

int_v_list220[24]=t240;
t194=t272*t240;
t238=t194+t243;
int_v_list320[36]=t238;
t194=t159*t44;
t240=t25*t19;
t19=t43*t73;
t73=t19+t240;
int_v_list220[23]=t73;
t19=t272*t73;
t240=t19+t194;
int_v_list320[35]=t240;
t19=t25*t11;
t11=t43*t69;
t194=t11+t19;
t11=t1*t194;
t19=t159*t226;
t243=t19+t11;
t19=t25*t68;
t68=t43*t95;
t95=t68+t19;
int_v_list220[22]=t95;
t19=t272*t95;
t68=t19+t243;
int_v_list320[34]=t68;
t19=t159*t137;
t243=t272*t267;
t250=t243+t19;
int_v_list320[33]=t250;
t19=t25*t56;
t56=t43*t77;
t243=t56+t19;
t19=t9*t243;
t56=t159*t125;
t251=t56+t19;
t19=t25*t127;
t56=t43*t160;
t127=t56+t19;
int_v_list220[20]=t127;
t19=t272*t127;
t56=t19+t251;
int_v_list320[32]=t56;
t19=t25*t91;
t91=t158+t19;
t19=t43*t252;
t158=t19+t91;
t19=t1*t158;
t91=t159*t50;
t160=t91+t19;
t19=t45*t158;
t91=t25*t252;
t251=t1*t182;
t253=t251+t91;
t91=t4*t156;
t257=t6*t233;
t258=t257+t91;
int_v_list110[6]=t258;
t91=t43*t258;
t257=t91+t253;
int_v_list210[9]=t257;
t91=t53*t257;
t253=t91+t19;
int_v_list220[19]=t253;
t19=t272*t253;
t91=t19+t160;
int_v_list320[31]=t91;
t19=t159*t201;
t160=t272*t244;
t259=t160+t19;
int_v_list320[30]=t259;
t19=t25*t44;
t44=t135+t19;
t19=t43*t73;
t73=t19+t44;
int_v_list320[29]=t73;
t19=t28+t128;
t28=t25*t226;
t44=t28+t19;
t19=t43*t95;
t28=t19+t44;
int_v_list320[28]=t28;
t19=t164+t11;
t11=t196+t19;
t19=t25*t137;
t44=t19+t11;
t11=t43*t267;
t19=t11+t44;
int_v_list320[27]=t19;
t11=t102+t202;
t44=t25*t125;
t95=t44+t11;
t11=t43*t127;
t44=t11+t95;
int_v_list320[26]=t44;
t11=t1*t243;
t95=t232+t11;
t11=t223+t95;
t95=t25*t50;
t50=t95+t11;
t11=t43*t253;
t95=t11+t50;
int_v_list320[25]=t95;
t11=t9*t158;
t50=t162+t11;
t11=t237+t50;
t50=t25*t201;
t102=t50+t11;
t11=t43*t244;
t50=t11+t102;
int_v_list320[24]=t50;
t11=t29*t191;
t102=t1*t178;
t125=t102+t11;
t11=t159*t62;
t102=t306+t11;
t11=t272*t140;
t127=t11+t102;
int_v_list120[10]=t127;
t11=t8*t127;
t102=t11+t125;
t11=t159*t180;
t125=t11+t102;
t11=t9*t192;
t102=t45*t178;
t127=t102+t11;
t11=t53*t239;
t102=t11+t127;
int_v_list220[16]=t102;
t11=t272*t102;
t102=t11+t125;
int_v_list320[22]=t102;
t11=t1*t221;
t125=t2+t11;
t2=t39+t125;
t11=t159*t249;
t39=t11+t2;
t2=t159*t57;
t11=t63+t2;
t2=t272*t120;
t63=t2+t11;
t2=t272*t63;
t11=t2+t39;
t2=t9*t11;
t39=t29*t105;
t125=t39+t2;
t2=t9*t120;
t39=t159*t119;
t127=t39+t2;
t2=t272*t217;
t39=t2+t127;
int_v_list120[8]=t39;
t2=t8*t39;
t127=t2+t125;
t2=t159*t263;
t125=t2+t127;
t2=t9*t63;
t127=t133+t2;
t2=t153+t127;
t127=t159*t105;
t105=t127+t2;
t2=t272*t39;
t39=t2+t105;
int_v_list220[14]=t39;
t2=t272*t39;
t39=t2+t125;
int_v_list320[20]=t39;
t2=t159*t169;
t105=t122+t2;
t2=t159*t92;
t92=t272*t156;
t122=t92+t2;
t2=t272*t122;
t92=t2+t105;
t2=t1*t92;
t105=t29*t93;
t93=t105+t2;
t2=t159*t155;
t105=t1*t156;
t125=t105+t2;
t2=t272*t234;
t105=t2+t125;
int_v_list120[7]=t105;
t2=t8*t105;
t105=t2+t93;
t2=t159*t206;
t93=t2+t105;
t2=t9*t122;
t105=t45*t92;
t125=t105+t2;
t2=t72*t231;
t105=t88*t241;
t127=t105+t2;
int_v_list210[6]=t127;
t2=t53*t127;
t105=t2+t125;
int_v_list220[13]=t105;
t2=t272*t105;
t105=t2+t93;
int_v_list320[19]=t105;
t2=t14*t288;
t93=int_v_oo2zeta12*t40;
t125=t93+t2;
t2=t159*t285;
t93=t2+t125;
t2=t159*t288;
t125=t272*t40;
t128=t125+t2;
int_v_list220[11]=t128;
t2=t272*t128;
t125=t2+t93;
int_v_list320[17]=t125;
t2=t14*t300;
t93=t159*t296;
t128=t272*t114;
t133=t128+t93;
t93=t1*t133;
t128=t93+t2;
t2=t25*t62;
t62=t43*t140;
t93=t62+t2;
int_v_list120[4]=t93;
t2=int_v_oo2zeta12*t93;
t62=t2+t128;
t2=t159*t59;
t59=t2+t62;
t2=t159*t300;
t62=t1*t114;
t128=t62+t2;
t2=t272*t93;
t62=t2+t128;
int_v_list220[10]=t62;
t2=t272*t62;
t62=t2+t59;
int_v_list320[16]=t62;
t2=t14*t100;
t59=int_v_oo2zeta12*t308;
t128=t59+t2;
t2=t159*t147;
t59=t2+t128;
t2=t159*t100;
t128=t272*t308;
t135=t128+t2;
int_v_list220[9]=t135;
t2=t272*t135;
t128=t2+t59;
int_v_list320[15]=t128;
t2=t159*t94;
t59=t1*t142;
t135=t59+t2;
t2=t25*t57;
t57=t43*t120;
t137=t57+t2;
t2=t272*t137;
t57=t2+t135;
t2=t9*t57;
t135=t14*t117;
t140=t135+t2;
t2=t25*t119;
t119=t43*t217;
t135=t119+t2;
int_v_list120[2]=t135;
t2=int_v_oo2zeta12*t135;
t119=t2+t140;
t2=t159*t55;
t55=t2+t119;
t2=t9*t137;
t119=t159*t117;
t140=t119+t2;
t2=t272*t135;
t119=t2+t140;
int_v_list220[8]=t119;
t2=t272*t119;
t119=t2+t55;
int_v_list320[14]=t119;
t2=t159*t17;
t55=t272*t212;
t140=t55+t2;
t2=t1*t140;
t55=t14*t195;
t147=t55+t2;
t2=t45*t212;
t55=t25*t156;
t153=t165+t55;
t55=t43*t233;
t155=t55+t153;
int_v_list110[0]=t155;
t55=t53*t155;
t153=t55+t2;
int_v_list120[1]=t153;
t2=int_v_oo2zeta12*t153;
t55=t2+t147;
t2=t159*t58;
t58=t2+t55;
t2=t1*t212;
t55=t159*t195;
t147=t55+t2;
t2=t272*t153;
t55=t2+t147;
int_v_list220[7]=t55;
t2=t272*t55;
t55=t2+t58;
int_v_list320[13]=t55;
t2=t14*t227;
t58=int_v_oo2zeta12*t247;
t147=t58+t2;
t2=t159*t229;
t58=t2+t147;
t2=t159*t227;
t147=t272*t247;
t160=t147+t2;
int_v_list220[6]=t160;
t2=t272*t160;
t147=t2+t58;
int_v_list320[12]=t147;
t2=t159*t70;
t58=t272*t21;
t160=t58+t2;
int_v_list320[11]=t160;
t2=t159*t26;
t58=t1*t89;
t162=t58+t2;
t2=t45*t89;
t164=t53*t5;
t169=t164+t2;
int_v_list220[4]=t169;
t2=t272*t169;
t164=t2+t162;
int_v_list320[10]=t164;
t2=t159*t12;
t162=t272*t10;
t180=t162+t2;
int_v_list320[9]=t180;
t2=t25*t94;
t94=t47+t2;
t2=t43*t137;
t47=t2+t94;
t2=t9*t47;
t94=t159*t118;
t162=t94+t2;
t2=t25*t117;
t94=t173+t2;
t2=t43*t135;
t173=t2+t94;
int_v_list220[2]=t173;
t2=t272*t173;
t94=t2+t162;
int_v_list320[8]=t94;
t2=t65+t59;
t59=t82+t2;
t2=t25*t17;
t17=t2+t59;
t2=t43*t212;
t59=t2+t17;
t2=t1*t59;
t17=t159*t145;
t65=t17+t2;
t2=t45*t59;
t17=t9*t150;
t82=t72*t143;
t162=t82+t17;
t17=t88*t154;
t82=t17+t162;
int_v_list210[0]=t82;
t17=t53*t82;
t162=t17+t2;
int_v_list220[1]=t162;
t2=t272*t162;
t17=t2+t65;
int_v_list320[7]=t17;
t2=t159*t16;
t65=t272*t170;
t191=t65+t2;
int_v_list320[6]=t191;
t2=t29*t288;
t65=t8*t40;
t40=t65+t2;
t2=t25*t70;
t65=t2+t40;
t2=t43*t21;
t21=t2+t65;
int_v_list320[5]=t21;
t2=t29*t300;
t40=t8*t93;
t65=t40+t2;
t2=t25*t26;
t26=t2+t65;
t2=t43*t169;
t40=t2+t26;
int_v_list320[4]=t40;
t2=t29*t100;
t26=t58+t2;
t2=t8*t308;
t58=t2+t26;
t2=t25*t12;
t12=t2+t58;
t2=t43*t10;
t10=t2+t12;
int_v_list320[3]=t10;
t2=t29*t117;
t12=t8*t135;
t26=t12+t2;
t2=t25*t118;
t12=t2+t26;
t2=t43*t173;
t26=t2+t12;
int_v_list320[2]=t26;
t2=t29*t195;
t12=t1*t47;
t58=t12+t2;
t2=t8*t153;
t12=t2+t58;
t2=t25*t145;
t58=t2+t12;
t2=t43*t162;
t12=t2+t58;
int_v_list320[1]=t12;
t2=t9*t59;
t58=t29*t227;
t65=t58+t2;
t2=t8*t247;
t58=t2+t65;
t2=t25*t16;
t16=t2+t58;
t2=t43*t170;
t58=t2+t16;
int_v_list320[0]=t58;
t2=t1*t185;
t16=t29*t69;
t65=t16+t2;
t16=t8*t168;
t70=t16+t65;
t16=t4*t179;
t65=t16+t70;
t16=t6*t181;
t70=t16+t65;
double**restrictxx int_v_list31=int_v_list3[1];
double*restrictxx int_v_list310=int_v_list31[0];
int_v_list310[29]=t70;
t16=t29*t77;
t65=t4*t120;
t93=t6*t216;
t100=t93+t65;
int_v_list110[7]=t100;
t65=t8*t100;
t93=t65+t16;
t16=t4*t76;
t65=t16+t93;
t16=t45*t185;
t93=t53*t187;
t117=t93+t16;
int_v_list210[16]=t117;
t16=t6*t117;
t93=t16+t65;
int_v_list310[28]=t93;
t16=t29*t252;
t65=t8*t258;
t118=t65+t16;
t16=t4*t134;
t65=t16+t118;
t16=t6*t204;
t118=t16+t65;
int_v_list310[27]=t118;
t16=t159*t179;
t65=t272*t181;
t135=t65+t16;
int_v_list310[26]=t135;
t16=t159*t76;
t65=t2+t16;
t16=t272*t117;
t145=t16+t65;
int_v_list310[25]=t145;
t16=t159*t134;
t65=t272*t204;
t153=t65+t16;
int_v_list310[24]=t153;
t16=t25*t179;
t65=t43*t181;
t162=t65+t16;
int_v_list310[23]=t162;
t16=t25*t76;
t65=t43*t117;
t76=t65+t16;
int_v_list310[22]=t76;
t16=t25*t134;
t65=t2+t16;
t2=t43*t204;
t16=t2+t65;
int_v_list310[21]=t16;
t2=t14*t69;
t65=int_v_oo2zeta12*t168;
t117=t65+t2;
t2=t159*t183;
t65=t2+t117;
t2=t159*t69;
t134=t272*t168;
t169=t134+t2;
int_v_list210[14]=t169;
t2=t272*t169;
t134=t2+t65;
int_v_list310[20]=t134;
t2=t159*t176;
t65=t272*t182;
t169=t65+t2;
t2=t1*t169;
t65=t14*t77;
t170=t65+t2;
t2=int_v_oo2zeta12*t100;
t173=t2+t170;
t170=t159*t222;
t179=t170+t173;
t170=t159*t77;
t173=t251+t170;
t170=t272*t100;
t181=t170+t173;
int_v_list210[13]=t181;
t170=t272*t181;
t173=t170+t179;
int_v_list310[19]=t173;
t170=t14*t252;
t179=int_v_oo2zeta12*t258;
t181=t179+t170;
t183=t159*t236;
t195=t183+t181;
t181=t159*t252;
t183=t272*t258;
t196=t183+t181;
int_v_list210[12]=t196;
t181=t272*t196;
t183=t181+t195;
int_v_list310[18]=t183;
t181=t159*t194;
t195=t25*t69;
t69=t43*t168;
t168=t69+t195;
int_v_list210[11]=t168;
t69=t272*t168;
t195=t69+t181;
int_v_list310[17]=t195;
t69=t25*t176;
t176=t43*t182;
t181=t176+t69;
t69=t1*t181;
t176=t159*t243;
t196=t176+t69;
t176=t25*t77;
t77=t43*t100;
t100=t77+t176;
int_v_list210[10]=t100;
t77=t272*t100;
t176=t77+t196;
int_v_list310[16]=t176;
t77=t159*t158;
t196=t272*t257;
t201=t196+t77;
int_v_list310[15]=t201;
t77=t25*t194;
t194=t117+t77;
t77=t43*t168;
t117=t77+t194;
int_v_list310[14]=t117;
t77=t2+t65;
t2=t25*t243;
t65=t2+t77;
t2=t43*t100;
t77=t2+t65;
int_v_list310[13]=t77;
t2=t170+t69;
t65=t179+t2;
t2=t25*t158;
t69=t2+t65;
t2=t43*t257;
t65=t2+t69;
int_v_list310[12]=t65;
t2=t29*t192;
t69=t159*t22;
t100=t272*t38;
t158=t100+t69;
int_v_list110[5]=t158;
t69=t8*t158;
t100=t69+t2;
t2=t159*t178;
t69=t2+t100;
t2=t272*t239;
t100=t2+t69;
int_v_list310[11]=t100;
t2=t29*t63;
t63=t1*t231;
t69=t63+t2;
t2=t159*t120;
t63=t165+t2;
t2=t272*t216;
t158=t2+t63;
int_v_list110[4]=t158;
t2=t8*t158;
t63=t2+t69;
t2=t159*t11;
t11=t2+t63;
t2=t9*t235;
t63=t45*t231;
t69=t63+t2;
t2=t53*t241;
t63=t2+t69;
int_v_list210[7]=t63;
t2=t272*t63;
t63=t2+t11;
int_v_list310[10]=t63;
t2=t29*t122;
t11=t159*t156;
t69=t272*t233;
t122=t69+t11;
int_v_list110[3]=t122;
t11=t8*t122;
t69=t11+t2;
t2=t159*t92;
t11=t2+t69;
t2=t272*t127;
t69=t2+t11;
int_v_list310[9]=t69;
t2=t14*t114;
t11=t25*t22;
t22=t43*t38;
t38=t22+t11;
int_v_list110[2]=t38;
t11=int_v_oo2zeta12*t38;
t22=t11+t2;
t2=t159*t133;
t11=t2+t22;
t2=t159*t114;
t22=t272*t38;
t92=t22+t2;
int_v_list210[5]=t92;
t2=t272*t92;
t22=t2+t11;
int_v_list310[8]=t22;
t2=t14*t137;
t11=t159*t142;
t92=t272*t150;
t122=t92+t11;
t11=t1*t122;
t92=t11+t2;
t2=t25*t120;
t11=t43*t216;
t120=t11+t2;
int_v_list110[1]=t120;
t2=int_v_oo2zeta12*t120;
t11=t2+t92;
t2=t159*t57;
t57=t2+t11;
t2=t159*t137;
t11=t1*t150;
t92=t11+t2;
t2=t272*t120;
t11=t2+t92;
int_v_list210[4]=t11;
t2=t272*t11;
t11=t2+t57;
int_v_list310[7]=t11;
t2=t14*t212;
t57=int_v_oo2zeta12*t155;
t92=t57+t2;
t2=t159*t140;
t57=t2+t92;
t2=t159*t212;
t92=t272*t155;
t127=t92+t2;
int_v_list210[3]=t127;
t2=t272*t127;
t92=t2+t57;
int_v_list310[6]=t92;
t2=t159*t89;
t57=t272*t5;
t127=t57+t2;
int_v_list310[5]=t127;
t2=t159*t47;
t57=t1*t143;
t133=t57+t2;
t2=t45*t143;
t140=t53*t154;
t142=t140+t2;
int_v_list210[1]=t142;
t2=t272*t142;
t140=t2+t133;
int_v_list310[4]=t140;
t2=t159*t59;
t133=t272*t82;
t156=t133+t2;
int_v_list310[3]=t156;
t2=t29*t114;
t114=t8*t38;
t38=t114+t2;
t2=t25*t89;
t89=t2+t38;
t2=t43*t5;
t5=t2+t89;
int_v_list310[2]=t5;
t2=t29*t137;
t38=t8*t120;
t89=t38+t2;
t2=t25*t47;
t38=t2+t89;
t2=t43*t142;
t47=t2+t38;
int_v_list310[1]=t47;
t2=t29*t212;
t38=t57+t2;
t2=t8*t155;
t57=t2+t38;
t2=t25*t59;
t38=t2+t57;
t2=t43*t82;
t57=t2+t38;
int_v_list310[0]=t57;
t2=t29*t182;
t38=t8*t188;
t59=t38+t2;
t2=t4*t185;
t4=t2+t59;
t2=t6*t187;
t6=t2+t4;
double**restrictxx int_v_list30=int_v_list3[0];
double*restrictxx int_v_list300=int_v_list30[0];
int_v_list300[9]=t6;
t2=t159*t185;
t4=t272*t187;
t38=t4+t2;
int_v_list300[8]=t38;
t2=t25*t185;
t4=t43*t187;
t59=t4+t2;
int_v_list300[7]=t59;
t2=t14*t182;
t4=int_v_oo2zeta12*t188;
t82=t4+t2;
t2=t159*t169;
t4=t2+t82;
t2=t159*t182;
t89=t272*t188;
t114=t89+t2;
int_v_list200[4]=t114;
t2=t272*t114;
t89=t2+t4;
int_v_list300[6]=t89;
t2=t159*t181;
t4=t25*t182;
t114=t43*t188;
t120=t114+t4;
int_v_list200[3]=t120;
t4=t272*t120;
t114=t4+t2;
int_v_list300[5]=t114;
t2=t25*t181;
t4=t82+t2;
t2=t43*t120;
t82=t2+t4;
int_v_list300[4]=t82;
t2=t29*t235;
t4=t8*t246;
t120=t4+t2;
t2=t159*t231;
t4=t2+t120;
t2=t272*t241;
t120=t2+t4;
int_v_list300[3]=t120;
t2=t14*t150;
t4=int_v_oo2zeta12*t163;
t14=t4+t2;
t2=t159*t122;
t4=t2+t14;
t2=t159*t150;
t14=t272*t163;
t122=t14+t2;
int_v_list200[1]=t122;
t2=t272*t122;
t14=t2+t4;
int_v_list300[2]=t14;
t2=t159*t143;
t4=t272*t154;
t122=t4+t2;
int_v_list300[1]=t122;
t2=t29*t150;
t4=t8*t163;
t8=t4+t2;
t2=t25*t143;
t4=t2+t8;
t2=t43*t154;
t8=t2+t4;
int_v_list300[0]=t8;
t2=t9*t136;
t4=t45*t132;
t25=t4+t2;
t2=t53*t138;
t4=t2+t25;
int_v_list230[28]=t4;
t2=t72*t132;
t25=t88*t138;
t29=t25+t2;
int_v_list230[27]=t29;
t2=t9*t203;
t25=t45*t75;
t43=t25+t2;
t2=t53*t211;
t25=t2+t43;
int_v_list230[25]=t25;
t2=t9*t271;
t9=t45*t189;
t43=t9+t2;
t2=t53*t254;
t9=t2+t43;
int_v_list230[21]=t9;
t2=t159*t79;
t43=t293+t2;
t2=t272*t290;
t72=t2+t43;
int_v_list130[18]=t72;
t2=t159*t111;
t43=t272*t298;
t75=t43+t2;
int_v_list130[17]=t75;
t2=t1*t97;
t1=t159*t172;
t43=t1+t2;
t1=t45*t97;
t2=t53*t200;
t45=t2+t1;
int_v_list030[5]=t45;
t1=t272*t45;
t2=t1+t43;
int_v_list130[15]=t2;
t1=t159*t245;
t43=t130+t1;
t1=t27