ICODE-ADC/lammps
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5836 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2011-03-26 00:50:29 +00:00
parent fbb475b9cd
commit 1f2a7add78
131 changed files with 1278 additions and 1496 deletions
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5
src/compute_property_molecule.cpp
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@ -54,8 +54,7 @@ ComputePropertyMolecule(LAMMPS *lmp, int narg, char **arg) :
array = NULL;
if (nvalues == 1) {
vector = (double *) memory->smalloc(nmolecules*sizeof(double),
"property/molecule:vector");
memory->create(vector,nmolecules,"property/molecule:vector");
vector_flag = 1;
size_vector = nmolecules;
extvector = 0;
@ -84,7 +83,7 @@ ComputePropertyMolecule(LAMMPS *lmp, int narg, char **arg) :
ComputePropertyMolecule::~ComputePropertyMolecule()
{
delete [] pack_choice;
memory->sfree(vector);
memory->destroy(vector);
memory->destroy(array);
}