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Re: [lammps-users] Atoms lost even in ppp conditions
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Re: [lammps-users] Atoms lost even in ppp conditions


From: Stefan Paquay <stefanpaquay@...24...>
Date: Sun, 20 Aug 2017 16:23:04 -0400

Yes! If your time integration is not numerically stable  (usually due to bad initial conditions, but it could also be a too large time step) you will lose atoms. 

On Aug 20, 2017 12:38 PM, "Rajesh" <creativeidleminds@...92......> wrote:
Dear lammps user
I am trying to simulate amorphous polyethylene in lammps using ppp conditions but always get an error of atoms lost. Is it possible that atoms may be lost even when ppp conditions are applied?


Thanks 
Rajesh

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