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/**********************************************************************
Output_CompTime.c:
Output_CompTime.c is a subrutine to write computational time
to filename.TRN.
Log of Output_CompTime.c:
22/Nov/2001 Released by T.Ozaki
***********************************************************************/
#include <stdio.h>
#include <stdlib.h>
#include <time.h>
#include "openmx_common.h"
#ifdef nompi
#include "mimic_mpi.h"
#else
#include "mpi.h"
#endif
#define Num_CompTime 16
void Output_CompTime()
{
int ID,j;
int ID_Mintime1,ID_Maxtime1;
int MinID[Num_CompTime];
int MaxID[Num_CompTime];
double Mintime1,Maxtime1;
double *time0;
double *time1;
double MinCompTime[Num_CompTime];
double MaxCompTime[Num_CompTime];
char file_CompTime[YOUSO10] = ".CompTime";
FILE *fp;
int numprocs,myid;
/* MPI */
MPI_Comm_size(mpi_comm_level1,&numprocs);
MPI_Comm_rank(mpi_comm_level1,&myid);
/* allocate arrays */
time0 = (double*)malloc(sizeof(double)*numprocs);
time1 = (double*)malloc(sizeof(double)*numprocs);
/* MPI_Bcast CompTime */
for (ID=0; ID<numprocs; ID++){
MPI_Bcast(&CompTime[ID][0], Num_CompTime, MPI_DOUBLE, ID, mpi_comm_level1);
}
MPI_Barrier(mpi_comm_level1);
/* find the min and max CompTime */
for (j=0; j<Num_CompTime; j++){
MaxCompTime[j] = -10.0;
MinCompTime[j] = 1.0e+10;
for (ID=0; ID<numprocs; ID++){
if (CompTime[ID][j]<MinCompTime[j]){
MinCompTime[j] = CompTime[ID][j];
MinID[j] = ID;
}
if (MaxCompTime[j]<CompTime[ID][j]){
MaxCompTime[j] = CompTime[ID][j];
MaxID[j] = ID;
}
}
}
if (myid==Host_ID){
fnjoint(filepath,filename,file_CompTime);
for (ID=0; ID<numprocs; ID++){
time0[ID] = CompTime[ID][5]
+ CompTime[ID][6]
+ CompTime[ID][7]
+ CompTime[ID][8]
+ CompTime[ID][9]
+ CompTime[ID][10]
+ CompTime[ID][11]
+ CompTime[ID][12]
+ CompTime[ID][13]
+ CompTime[ID][14]
+ CompTime[ID][15];
time1[ID] = CompTime[ID][3] - time0[ID];
}
Maxtime1 = -100.0;
Mintime1 = 1.0e+10;
for (ID=0; ID<numprocs; ID++){
if (time1[ID]<Mintime1){
Mintime1 = time1[ID];
ID_Mintime1 = ID;
}
if (Maxtime1<time1[ID]){
Maxtime1 = time1[ID];
ID_Maxtime1 = ID;
}
}
if ((fp = fopen(file_CompTime,"w")) != NULL){
/* write */
fprintf(fp,"\n");
fprintf(fp,"***********************************************************\n");
fprintf(fp,"***********************************************************\n");
fprintf(fp," Computational Time (second) \n");
fprintf(fp,"***********************************************************\n");
fprintf(fp,"***********************************************************\n\n");
fprintf(fp," Elapsed.Time. %12.3f\n\n",MaxCompTime[0]);
fprintf(fp," Min_ID Min_Time Max_ID Max_Time\n");
fprintf(fp," Total Computational Time = %2d %12.3f %2d %12.3f\n",
MinID[0],MinCompTime[0],MaxID[0],MaxCompTime[0]);
fprintf(fp," readfile = %2d %12.3f %2d %12.3f\n",
MinID[1],MinCompTime[1],MaxID[1],MaxCompTime[1]);
fprintf(fp," truncation = %2d %12.3f %2d %12.3f\n",
MinID[2],MinCompTime[2],MaxID[2],MaxCompTime[2]);
fprintf(fp," MD_pac = %2d %12.3f %2d %12.3f\n",
MinID[4],MinCompTime[4],MaxID[4],MaxCompTime[4]);
fprintf(fp," DFT = %2d %12.3f %2d %12.3f\n",
MinID[3],MinCompTime[3],MaxID[3],MaxCompTime[3]);
fprintf(fp,"\n");
fprintf(fp,"*** In DFT ***\n\n");
fprintf(fp," Set_OLP_Kin = %2d %12.3f %2d %12.3f\n",
MinID[5],MinCompTime[5],MaxID[5],MaxCompTime[5]);
fprintf(fp," Set_Nonlocal = %2d %12.3f %2d %12.3f\n",
MinID[6],MinCompTime[6],MaxID[6],MaxCompTime[6]);
fprintf(fp," Set_Hamiltonian = %2d %12.3f %2d %12.3f\n",
MinID[7],MinCompTime[7],MaxID[7],MaxCompTime[7]);
fprintf(fp," Poisson = %2d %12.3f %2d %12.3f\n",
MinID[8],MinCompTime[8],MaxID[8],MaxCompTime[8]);
fprintf(fp," Diagonalization = %2d %12.3f %2d %12.3f\n",
MinID[9],MinCompTime[9],MaxID[9],MaxCompTime[9]);
fprintf(fp," Mixing_DM = %2d %12.3f %2d %12.3f\n",
MinID[10],MinCompTime[10],MaxID[10],MaxCompTime[10]);
fprintf(fp," Force = %2d %12.3f %2d %12.3f\n",
MinID[11],MinCompTime[11],MaxID[11],MaxCompTime[11]);
fprintf(fp," Total_Energy = %2d %12.3f %2d %12.3f\n",
MinID[12],MinCompTime[12],MaxID[12],MaxCompTime[12]);
fprintf(fp," Set_Aden_Grid = %2d %12.3f %2d %12.3f\n",
MinID[13],MinCompTime[13],MaxID[13],MaxCompTime[13]);
fprintf(fp," Set_Orbitals_Grid = %2d %12.3f %2d %12.3f\n",
MinID[14],MinCompTime[14],MaxID[14],MaxCompTime[14]);
fprintf(fp," Set_Density_Grid = %2d %12.3f %2d %12.3f\n",
MinID[15],MinCompTime[15],MaxID[15],MaxCompTime[15]);
fprintf(fp," Others = %2d %12.3f %2d %12.3f\n",
ID_Mintime1,Mintime1,ID_Maxtime1,Maxtime1);
fclose(fp);
/* stdout */
printf("\n");
printf("***********************************************************\n");
printf("***********************************************************\n");
printf(" Computational Time (second) \n");
printf("***********************************************************\n");
printf("***********************************************************\n\n");
printf(" Min_ID Min_Time Max_ID Max_Time\n");
printf(" Total Computational Time = %2d %12.3f %2d %12.3f\n",
MinID[0],MinCompTime[0],MaxID[0],MaxCompTime[0]);
printf(" readfile = %2d %12.3f %2d %12.3f\n",
MinID[1],MinCompTime[1],MaxID[1],MaxCompTime[1]);
printf(" truncation = %2d %12.3f %2d %12.3f\n",
MinID[2],MinCompTime[2],MaxID[2],MaxCompTime[2]);
printf(" MD_pac = %2d %12.3f %2d %12.3f\n",
MinID[4],MinCompTime[4],MaxID[4],MaxCompTime[4]);
printf(" DFT = %2d %12.3f %2d %12.3f\n",
MinID[3],MinCompTime[3],MaxID[3],MaxCompTime[3]);
printf("\n");
printf("*** In DFT ***\n\n");
printf(" Set_OLP_Kin = %2d %12.3f %2d %12.3f\n",
MinID[5],MinCompTime[5],MaxID[5],MaxCompTime[5]);
printf(" Set_Nonlocal = %2d %12.3f %2d %12.3f\n",
MinID[6],MinCompTime[6],MaxID[6],MaxCompTime[6]);
printf(" Set_Hamiltonian = %2d %12.3f %2d %12.3f\n",
MinID[7],MinCompTime[7],MaxID[7],MaxCompTime[7]);
printf(" Poisson = %2d %12.3f %2d %12.3f\n",
MinID[8],MinCompTime[8],MaxID[8],MaxCompTime[8]);
printf(" Diagonalization = %2d %12.3f %2d %12.3f\n",
MinID[9],MinCompTime[9],MaxID[9],MaxCompTime[9]);
printf(" Mixing_DM = %2d %12.3f %2d %12.3f\n",
MinID[10],MinCompTime[10],MaxID[10],MaxCompTime[10]);
printf(" Force = %2d %12.3f %2d %12.3f\n",
MinID[11],MinCompTime[11],MaxID[11],MaxCompTime[11]);
printf(" Total_Energy = %2d %12.3f %2d %12.3f\n",
MinID[12],MinCompTime[12],MaxID[12],MaxCompTime[12]);
printf(" Set_Aden_Grid = %2d %12.3f %2d %12.3f\n",
MinID[13],MinCompTime[13],MaxID[13],MaxCompTime[13]);
printf(" Set_Orbitals_Grid = %2d %12.3f %2d %12.3f\n",
MinID[14],MinCompTime[14],MaxID[14],MaxCompTime[14]);
printf(" Set_Density_Grid = %2d %12.3f %2d %12.3f\n",
MinID[15],MinCompTime[15],MaxID[15],MaxCompTime[15]);
printf(" Others = %2d %12.3f %2d %12.3f\n",
ID_Mintime1,Mintime1,ID_Maxtime1,Maxtime1);
}
else{
printf("could not save the CompTime file.\n");
}
}
/* free arrays */
free(time0);
free(time1);
}
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