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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9416 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2013-02-08 21:38:50 +00:00
parent 906a57d529
commit 7a286596d8
12 changed files with 166 additions and 25 deletions
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12
src/modify.cpp
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@ -56,7 +56,7 @@ Modify::Modify(LAMMPS *lmp) : Pointers(lmp)
list_initial_integrate_respa = list_post_integrate_respa = NULL;
list_pre_force_respa = list_post_force_respa = NULL;
list_final_integrate_respa = NULL;
list_min_pre_exchange = list_pre_neighbor = NULL;
list_min_pre_exchange = list_min_pre_neighbor = NULL;
list_min_pre_force = list_min_post_force = NULL;
list_min_energy = NULL;
@ -454,6 +454,16 @@ void Modify::min_pre_exchange()
fix[list_min_pre_exchange[i]]->min_pre_exchange();
}
/* ----------------------------------------------------------------------
minimizer pre-neighbor call, only for relevant fixes
------------------------------------------------------------------------- */
void Modify::min_pre_neighbor()
{
for (int i = 0; i < n_min_pre_neighbor; i++)
fix[list_min_pre_neighbor[i]]->min_pre_neighbor();
}
/* ----------------------------------------------------------------------
minimizer pre-force call, only for relevant fixes
------------------------------------------------------------------------- */