Dear lammps users,
I have questions about fix press/berendsen in lammps.
I used a berendsen thermostat and barostat for NPT simulation. So I fixed temperature and pressure using a berendsen thermostat and barostat by “fix temp/berendsen” and “fix press/berendsen”.
Here’s my question.
In case of using a “fix npt” which uses a nose-hoover thermostat and barostat, this fix combines temperature and pressure coupling at once. Therefore, If I apply “fix npt” in a “fix grem” as an option for fix style, it works well.
In the case of using “fix press/berendsen” and “fix temp/berendsen”, what fix style should I use for the fix style in the “fix grem”?
With my best regards