Triclinic NPT

Dear users,

I am running a tricinlic NPT simulation.

It has ran for more than 100 ns. Due to cluster walltime, job was restarted several times without any error.

But now, I am not unable to restart and resulting with the following error.

Triclinic box skew is too large.

Can someone help with this.

Thanks in advance
Karteek

http://lammps.sandia.gov/doc/box.html

But chances are your box is getting messed up due to other problem with the input.
Carlos

Thanks for the reply…
Is there any solution to restart the simulation.

Thanks
Karteek

Not sure I follow. Are you getting this message during a restart run right at the beginning of it despite using the box tilt large settings in your input?
Carlos

Sorry to update. I tried with box tilt large… Was working…

Thanks
Karteek

Try using the same command:

box tilt large

before you read the restart file.

Steve