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allow for centered grid cells in proc mapping

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This commit is contained in:
Steve Plimpton
2022-10-31 15:28:39 -06:00
parent 19fad284af
commit aa777a2196
5 changed files with 623 additions and 482 deletions
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4
src/fix_ave_grid.cpp
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@ -401,7 +401,7 @@ FixAveGrid::FixAveGrid(LAMMPS *lmp, int narg, char **arg) :
// ngrid_buf12 converted to nvalues + count
grid2d->setup(ngrid_buf1, ngrid_buf2);
grid2d->setup_comm(ngrid_buf1, ngrid_buf2);
ngrid_buf1 *= nvalues + 1;
ngrid_buf2 *= nvalues + 1;
@ -418,7 +418,7 @@ FixAveGrid::FixAveGrid(LAMMPS *lmp, int narg, char **arg) :
// ngrid_buf12 converted to nvalues + count
grid3d->setup(ngrid_buf1, ngrid_buf2);
grid3d->setup_comm(ngrid_buf1, ngrid_buf2);
ngrid_buf1 *= nvalues + 1;
ngrid_buf2 *= nvalues + 1;