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add support for optionally including unit information in standard dump files

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This commit is contained in:
Axel Kohlmeyer
2019-09-12 14:37:42 -04:00
parent 4bbe4c73aa
commit e413aaf217
7 changed files with 51 additions and 24 deletions
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11
src/dump.cpp
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@ -87,6 +87,8 @@ Dump::Dump(LAMMPS *lmp, int /*narg*/, char **arg) : Pointers(lmp)
buffer_flag = 0;
padflag = 0;
pbcflag = 0;
unit_flag = 0;
unit_count = 0;
delay_flag = 0;
maxfiles = -1;
@ -545,6 +547,8 @@ void Dump::openfile()
if (singlefile_opened) return;
if (multifile == 0) singlefile_opened = 1;
unit_count = 0;
// if one file per timestep, replace '*' with current timestep
char *filecurrent = filename;
@ -1119,6 +1123,13 @@ void Dump::modify_params(int narg, char **arg)
}
iarg += 2;
} else if (strcmp(arg[iarg],"units") == 0) {
if (iarg+2 > narg) error->all(FLERR,"Illegal dump_modify command");
if (strcmp(arg[iarg+1],"yes") == 0) unit_flag = 1;
else if (strcmp(arg[iarg+1],"no") == 0) unit_flag = 0;
else error->all(FLERR,"Illegal dump_modify command");
iarg += 2;
} else {
int n = modify_param(narg-iarg,&arg[iarg]);
if (n == 0) error->all(FLERR,"Illegal dump_modify command");