[gmx-users] electric potential and electric field in 3d grid ?

Markus O Kaukonen mokaukon at cc.helsinki.fi
Wed Apr 30 12:57:01 CEST 2003


Dear All,

Is it possible to calculte electric potential and electric field
in a (rectancular) 3d grid using Gromacs-package?

Or even at a single xyz position in space?

Is g_potential only doing averages in 1d?

If anyone has coded that already, I'd be grateful to obtain a free copy.

Best Wishes, Markus = markus.kaukonen at iki.fi

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