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Published 20 hours ago • verified publisher icon fhh2626

use Parrinello-Rahman barostat

Open fhh2626 opened this issue 4 years ago • 0 comments

we should use Parrinello-Rahman barostat in Gromacs, as Berendsen barostat is generally thought to be bad

fhh2626 avatar Dec 28 '20 06:12 fhh2626