[gmx-users] strain-stress, Young modulus, etc

Vitaly Chaban vvchaban at gmail.com
Thu Jul 15 14:39:51 CEST 2010


Hi all,

We want to calculate strain-stress relationships with gromacs. Can
anybody please provide some links about how it can be done in terms of
gromacs utilities and keywords?

What is the efficient way to apply strain to the system (expand it)?

Thank you.
Vitaly



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