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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2623 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2009-03-05 20:55:21 +00:00
parent cb90e03944
commit eb8c707f99
2 changed files with 6 additions and 3 deletions
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3
src/compute_pressure.cpp
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@ -84,8 +84,7 @@ ComputePressure::ComputePressure(LAMMPS *lmp, int narg, char **arg) :
pairflag = 1; pairflag = 1;
bondflag = angleflag = dihedralflag = improperflag = 1; bondflag = angleflag = dihedralflag = improperflag = 1;
kspaceflag = fixflag = 1; kspaceflag = fixflag = 1;
} } else error->all("Illegal compute pressure command");
else error->all("Illegal compute pressure command");
iarg++; iarg++;
} }
} }

6
src/compute_stress_atom.cpp
View File

@ -62,7 +62,11 @@ ComputeStressAtom::ComputeStressAtom(LAMMPS *lmp, int narg, char **arg) :
else if (strcmp(arg[iarg],"dihedral") == 0) dihedralflag = 1; else if (strcmp(arg[iarg],"dihedral") == 0) dihedralflag = 1;
else if (strcmp(arg[iarg],"improper") == 0) improperflag = 1; else if (strcmp(arg[iarg],"improper") == 0) improperflag = 1;
else if (strcmp(arg[iarg],"fix") == 0) fixflag = 1; else if (strcmp(arg[iarg],"fix") == 0) fixflag = 1;
else error->all("Illegal compute stress/atom command"); else if (strcmp(arg[iarg],"virial") == 0) {
pairflag = 1;
bondflag = angleflag = dihedralflag = improperflag = 1;
fixflag = 1;
} else error->all("Illegal compute stress/atom command");
iarg++; iarg++;
} }
} }