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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7003 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2011-09-23 18:06:55 +00:00
parent 2d99de131d
commit 19e8c92a90
468 changed files with 4628 additions and 5204 deletions
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13
src/write_restart.cpp
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@ -38,9 +38,6 @@
using namespace LAMMPS_NS;
#define MIN(A,B) ((A) < (B)) ? (A) : (B)
#define MAX(A,B) ((A) > (B)) ? (A) : (B)
// same as read_restart.cpp and tools/restart2data.cpp
enum{VERSION,SMALLINT,TAGINT,BIGINT,
@ -76,8 +73,8 @@ WriteRestart::WriteRestart(LAMMPS *lmp) : Pointers(lmp)
void WriteRestart::command(int narg, char **arg)
{
if (domain->box_exist == 0)
error->all("Write_restart command before simulation box is defined");
if (narg != 1) error->all("Illegal write_restart command");
error->all(FLERR,"Write_restart command before simulation box is defined");
if (narg != 1) error->all(FLERR,"Illegal write_restart command");
// if filename contains a "*", replace with current timestep
@ -135,7 +132,7 @@ void WriteRestart::write(char *file)
bigint nblocal = atom->nlocal;
MPI_Allreduce(&nblocal,&natoms,1,MPI_LMP_BIGINT,MPI_SUM,world);
if (natoms != atom->natoms && output->thermo->lostflag == ERROR)
error->all("Atom count is inconsistent, cannot write restart file");
error->all(FLERR,"Atom count is inconsistent, cannot write restart file");
// check if filename contains "%"
@ -158,7 +155,7 @@ void WriteRestart::write(char *file)
if (fp == NULL) {
char str[128];
sprintf(str,"Cannot open restart file %s",hfile);
error->one(str);
error->one(FLERR,str);
}
if (multiproc) delete [] hfile;
}
@ -284,7 +281,7 @@ void WriteRestart::write(char *file)
if (fp == NULL) {
char str[128];
sprintf(str,"Cannot open restart file %s",perproc);
error->one(str);
error->one(FLERR,str);
}
delete [] perproc;
fwrite(&send_size,sizeof(int),1,fp);