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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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8
src/compute_improper_local.cpp
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@ -34,10 +34,10 @@ using namespace LAMMPS_NS;
ComputeImproperLocal::ComputeImproperLocal(LAMMPS *lmp, int narg, char **arg) :
Compute(lmp, narg, arg)
{
if (narg < 4) error->all("Illegal compute improper/local command");
if (narg < 4) error->all(FLERR,"Illegal compute improper/local command");
if (atom->avec->impropers_allow == 0)
error->all("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;
@ -51,7 +51,7 @@ ComputeImproperLocal::ComputeImproperLocal(LAMMPS *lmp, int narg, char **arg) :
for (int iarg = 3; iarg < narg; iarg++) {
i = iarg-3;
if (strcmp(arg[iarg],"chi") == 0) cflag = nvalues++;
else error->all("Invalid keyword in compute improper/local command");
else error->all(FLERR,"Invalid keyword in compute improper/local command");
}
nmax = 0;
@ -72,7 +72,7 @@ ComputeImproperLocal::~ComputeImproperLocal()
void ComputeImproperLocal::init()
{
if (force->improper == NULL)
error->all("No improper style is defined for compute improper/local");
error->all(FLERR,"No improper style is defined for compute improper/local");
// do initial memory allocation so that memory_usage() is correct