ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

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

Browse Source
This commit is contained in:
sjplimp
2013-02-08 21:38:50 +00:00
parent 906a57d529
commit 7a286596d8
12 changed files with 166 additions and 25 deletions
Download Patch File Download Diff File Expand all files Collapse all files

3
src/min.cpp
View File

@ -234,6 +234,7 @@ void Min::setup()
if (atom->sortfreq > 0) atom->sort();
comm->borders();
if (triclinic) domain->lamda2x(atom->nlocal+atom->nghost);
domain->image_check();
domain->box_too_small_check();
modify->setup_pre_neighbor();
neighbor->build();
@ -321,6 +322,7 @@ void Min::setup_minimal(int flag)
comm->exchange();
comm->borders();
if (triclinic) domain->lamda2x(atom->nlocal+atom->nghost);
domain->image_check();
domain->box_too_small_check();
modify->setup_pre_neighbor();
neighbor->build();
@ -436,7 +438,6 @@ void Min::cleanup()
// delete fix at end of run, so its atom arrays won't persist
modify->delete_fix("MINIMIZE");
domain->box_too_small_check();
}