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Published 20 hours ago • verified publisher icon espressomd

NPT should use normal pressure calculation

Open fweik opened this issue 5 years ago • 2 comments

Currently NPT uses it's own pressure calculation integrated into the force calculation. This is a duplication and has diverged, so that NPT does not use the same pressure as calculated by the "normal" pressure calculation. It should just use the pressure kernels.

fweik avatar Mar 01 '19 08:03 fweik

Is this fixed by #3756?

jngrad avatar Jun 15 '20 19:06 jngrad

No, unfortunately not.

fweik avatar Jun 15 '20 20:06 fweik