[gmx-users] gmx morse potential in manual

Robson da Silva rooliboni at gmail.com
Wed Oct 29 17:52:46 CET 2014


Hi gmx users, is there an error in gmx manual about the Morse potential
derivative (page 89, 5.0.2 manual)?
In the expression there is an r_{ij} in the numerator, is it correct?

I implemented a morse potential in a small program and it agrees with gmx
results only when I discarded it.

Best
Robson

-- 
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Robson da Silva
mail: rooliboni at gmail.com


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