git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2709 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2009-03-26 15:16:32 +00:00
parent db816408f4
commit c12b42237c
2 changed files with 10 additions and 8 deletions

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@ -3102,10 +3102,11 @@ boundary of a processor's sub-domain has moved more than 1/2 the
rebuilt and atoms being migrated to new processors. This also means rebuilt and atoms being migrated to new processors. This also means
you may be missing pairwise interactions that need to be computed. you may be missing pairwise interactions that need to be computed.
The solution is to change the re-neighboring criteria via the The solution is to change the re-neighboring criteria via the
<A HREF = "neigh_modify">neigh_modify</A> command. Second, it may mean that an atom <A HREF = "neigh_modify">neigh_modify</A> command. The safest settings are "delay 0
has moved far outside a processor's sub-domain or even the entire every 1 check yes". Second, it may mean that an atom has moved far
simulation box. This indicates bad physics, e.g. due to highly outside a processor's sub-domain or even the entire simulation box.
overlapping atoms, too large a timestep, etc. This indicates bad physics, e.g. due to highly overlapping atoms, too
large a timestep, etc.
<DT><I>POEMS fix must come before NPT/NPH fix</I> <DT><I>POEMS fix must come before NPT/NPH fix</I>

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@ -3099,10 +3099,11 @@ boundary of a processor's sub-domain has moved more than 1/2 the
rebuilt and atoms being migrated to new processors. This also means rebuilt and atoms being migrated to new processors. This also means
you may be missing pairwise interactions that need to be computed. you may be missing pairwise interactions that need to be computed.
The solution is to change the re-neighboring criteria via the The solution is to change the re-neighboring criteria via the
"neigh_modify"_neigh_modify command. Second, it may mean that an atom "neigh_modify"_neigh_modify command. The safest settings are "delay 0
has moved far outside a processor's sub-domain or even the entire every 1 check yes". Second, it may mean that an atom has moved far
simulation box. This indicates bad physics, e.g. due to highly outside a processor's sub-domain or even the entire simulation box.
overlapping atoms, too large a timestep, etc. :dd This indicates bad physics, e.g. due to highly overlapping atoms, too
large a timestep, etc. :dd
{POEMS fix must come before NPT/NPH fix} :dt {POEMS fix must come before NPT/NPH fix} :dt