Skip to content
Snippets Groups Projects
Commit 40ad1ad0 authored by sjplimp's avatar sjplimp
Browse files

''

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13786 f3b2605a-c512-4ea7-a41b-209d697bcdaa
parent a4af6769
No related branches found
No related tags found
No related merge requests found
...@@ -226,6 +226,9 @@ which can lead to poor energy conservation. You can test for this in ...@@ -226,6 +226,9 @@ which can lead to poor energy conservation. You can test for this in
your system by running a constant NVE simulation with a particular set your system by running a constant NVE simulation with a particular set
of SHAKE parameters and monitoring the energy versus time. of SHAKE parameters and monitoring the energy versus time.
</P> </P>
<P>SHAKE or RATTLE should not be used to contrain an angle at 180 degrees
(e.g. linear CO2 molecule). This causes numeric difficulties.
</P>
<P><B>Related commands:</B> none <P><B>Related commands:</B> none
</P> </P>
<P><B>Default:</B> none <P><B>Default:</B> none
......
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment