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improved some error messages in compute_msd,fix_indent and fix_nh.cpp

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This commit is contained in:
Jiancheng Chen
2022-08-15 10:51:29 +08:00
parent 89f32e43dc
commit d047053473
3 changed files with 53 additions and 54 deletions
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9
src/compute_msd.cpp
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@ -27,8 +27,7 @@ using namespace LAMMPS_NS;
/* ---------------------------------------------------------------------- */
ComputeMSD::ComputeMSD(LAMMPS *lmp, int narg, char **arg)
: Compute(lmp, narg, arg), id_fix(nullptr)
ComputeMSD::ComputeMSD(LAMMPS *lmp, int narg, char **arg) : Compute(lmp, narg, arg), id_fix(nullptr)
{
if (narg < 3) error->all(FLERR, "Illegal compute msd command");
@ -46,15 +45,15 @@ ComputeMSD::ComputeMSD(LAMMPS *lmp, int narg, char **arg)
int iarg = 3;
while (iarg < narg) {
if (strcmp(arg[iarg], "com") == 0) {
if (iarg + 2 > narg) error->all(FLERR, "Illegal compute msd command");
if (iarg + 2 > narg) utils::missing_cmd_args(FLERR, "compute msd com", error);
comflag = utils::logical(FLERR, arg[iarg + 1], false, lmp);
iarg += 2;
} else if (strcmp(arg[iarg], "average") == 0) {
if (iarg + 2 > narg) error->all(FLERR, "Illegal compute msd command");
if (iarg + 2 > narg) utils::missing_cmd_args(FLERR, "compute msd average", error);
avflag = utils::logical(FLERR, arg[iarg + 1], false, lmp);
iarg += 2;
} else
error->all(FLERR, "Illegal compute msd command");
error->all(FLERR, "Unknown compute msd keyword: {}", arg[iarg]);
}
if (group->dynamic[igroup])