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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8348 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2012-06-20 13:46:30 +00:00
parent b96c9934ca
commit 7000d43d10
5 changed files with 68 additions and 34 deletions
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6
src/compute_improper_local.cpp
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@ -39,7 +39,8 @@ ComputeImproperLocal::ComputeImproperLocal(LAMMPS *lmp, int narg, char **arg) :
if (narg < 4) error->all(FLERR,"Illegal compute improper/local command");
if (atom->avec->impropers_allow == 0)
error->all(FLERR,"Compute improper/local used when impropers are not allowed");
error->all(FLERR,
"Compute improper/local used when impropers are not allowed");
local_flag = 1;
nvalues = narg - 3;
@ -127,7 +128,8 @@ int ComputeImproperLocal::compute_impropers(int flag)
if (nvalues == 1) {
if (cflag >= 0) cbuf = vector;
} else {
if (cflag >= 0) cbuf = &array[0][cflag];
if (cflag >= 0 && array) cbuf = &array[0][cflag];
else cbuf = NULL;
}
}