[gmx-users] .itp file for an electrode

Negar Ashari Astani negarastani at gmail.com
Wed Jun 3 10:21:30 CEST 2009


Hello everbody

I'm trying to repeat a simulation which is reported in a paper. I'm going to
model an electrode according to this exact method reported in this paper
"the electrodes were modeled as two parallel XY square lattices made of
charged Lennard-Jones spheres with radii 0.11 nm. Surface charge densities
on the electrodes  were varied  by the partial  charge of the lattice
spheres."
I'm looking for the .itp file for a metalic electrode.
Does anyone by any chance have such a file?

Thank you all so much

-- 
Negar Ashari Astani
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