[ESPResSo-users] Fwd: Columns for tabulated non-bonded potentials

[Olaf Lenz]

Hi everybody!

Can anybody help Steven? I am on holidays, and I can't check from here...

Olaf

-------- Original Message --------
Subject: Columns for tabulated non-bonded potentials
Date: Fri, 19 Aug 2011 05:02:38 +0000
From: Steven Kirk <address@hidden>
To: Olaf Lenz <address@hidden>

Hello Olaf,

I just wanted to confirm with you the necessary order of columns in a
tabulated potential file for non-bonded interactions in the current Espresso
release 3.0.1.

The manual currently says that the order is:
r, F(r), V(r)

where F(r) = (-1/r)(dV/dr)

Is this correct?

Steven Kirk
address@hidden

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