[gmx-users] energy terms vs. temperature

Juliette N. joojoojooon at gmail.com
Tue Sep 6 21:01:11 CEST 2011


Dear users,

I have a short question about temperature dependence of enregy terms i.e
bonds, angles, torsions, vdw , electorstatics. I am curious why these
energies increase with T. Especially bonded terms that have no temperature
dependence in the functional form ( force constants), why all bonded energy
terms are increasing with T?

Thanks for you comments,
J.
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