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

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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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9
doc/Section_errors.html
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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
you may be missing pairwise interactions that need to be computed.
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
has moved far outside a processor's sub-domain or even the entire
simulation box. This indicates bad physics, e.g. due to highly
overlapping atoms, too large a timestep, etc.
<A HREF = "neigh_modify">neigh_modify</A> command. The safest settings are "delay 0
every 1 check yes". Second, it may mean that an atom has moved far
outside a processor's sub-domain or even the entire simulation box.
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>

9
doc/Section_errors.txt
View File

@ -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
you may be missing pairwise interactions that need to be computed.
The solution is to change the re-neighboring criteria via the
"neigh_modify"_neigh_modify command. Second, it may mean that an atom
has moved far outside a processor's sub-domain or even the entire
simulation box. This indicates bad physics, e.g. due to highly
overlapping atoms, too large a timestep, etc. :dd
"neigh_modify"_neigh_modify command. The safest settings are "delay 0
every 1 check yes". Second, it may mean that an atom has moved far
outside a processor's sub-domain or even the entire simulation box.
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