[gmx-users] density of zinc
yen_ono at yahoo.com
Tue Aug 2 18:15:07 CEST 2005
I am trying to simulate interactions between solid walls and solvents.
First, i made model for solid and i used zinc as the material and i used ffgmx Gromacs forcefield because i found the zinc residue in ffgmx.rtp file
then when i calculated the density of zinc using g_density , i got somewhat strange result :
box (nm) density (kg/m3)
as i know the density of zinc is around 7000 kg/m3, isn't it ?? i used "freezegrps" options.
so, does anyone know how to deal with this problem ???
thanks a lot
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