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