What about taking another alkali ion (are thery any in CROMOS53?) and
adjusting sigmaepsilon to reflect smaller size of Li(+)?
Of course, lithium is a pretty polarizable guy with certain covalent
bonding ambitions, but this does not prevent people to simulate it as
a hard [+1e] sphere...
Dr.
Dear All,
I find myself requiring lithium ions in a simulation using (a variant of) the
Gromos53A6 forcefield.
Chaging forcefields is not an appealing proposition due to the time already
invested in the current one, so I was wondering had any suggestions or has
perhaps gone to the effort of
