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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5940 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2011-04-14 17:40:40 +00:00
parent f7ce52785b
commit 759ee1f3e8
26 changed files with 490 additions and 259 deletions
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23
src/MOLECULE/atom_vec_angle.cpp
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@ -428,10 +428,16 @@ int AtomVecAngle::pack_border_vel(int n, int *list, double *buf,
/* ---------------------------------------------------------------------- */
int AtomVecAngle::pack_border_one(int i, double *buf)
int AtomVecAngle::pack_border_hybrid(int n, int *list, double *buf)
{
buf[0] = molecule[i];
return 1;
int i,j,m;
m = 0;
for (i = 0; i < n; i++) {
j = list[i];
buf[m++] = molecule[j];
}
return m;
}
/* ---------------------------------------------------------------------- */
@ -479,10 +485,15 @@ void AtomVecAngle::unpack_border_vel(int n, int first, double *buf)
/* ---------------------------------------------------------------------- */
int AtomVecAngle::unpack_border_one(int i, double *buf)
int AtomVecAngle::unpack_border_hybrid(int n, int first, double *buf)
{
molecule[i] = static_cast<int> (buf[0]);
return 1;
int i,m,last;
m = 0;
last = first + n;
for (i = first; i < last; i++)
molecule[i] = static_cast<int> (buf[m++]);
return m;
}
/* ----------------------------------------------------------------------