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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13102 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2015-02-13 18:30:07 +00:00
parent db215ba242
commit dfc6073e7a
9 changed files with 25 additions and 16 deletions
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5
src/compute_temp_chunk.cpp
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@ -32,7 +32,7 @@ ComputeTempChunk::ComputeTempChunk(LAMMPS *lmp, int narg, char **arg) :
if (narg < 4) error->all(FLERR,"Illegal compute temp/chunk command");
vector_flag = 1;
size_vector = 1;
size_vector = 0;
size_vector_variable = 1;
extvector = 0;
@ -163,6 +163,7 @@ void ComputeTempChunk::compute_vector()
int *ichunk = cchunk->ichunk;
if (nchunk > maxchunk) allocate();
size_vector = nchunk;
// calculate COM velocity for each chunk
@ -372,7 +373,7 @@ void ComputeTempChunk::allocate()
memory->destroy(keall);
memory->destroy(count);
memory->destroy(countall);
size_vector = maxchunk = nchunk;
maxchunk = nchunk;
memory->create(ke,maxchunk,"temp/chunk:ke");
memory->create(keall,maxchunk,"temp/chunk:keall");
memory->create(count,maxchunk,"temp/chunk:count");