Hi all,
Does anybody know the exact expression for radial distribution function computed by forcite analysis dialog? There are different expressions for rdf known in literature and when I compute the rdf for an infinite crystal it oscillates around 1 at large distances but when I compute it for a molecular model it oscillates around 0 at large distances. Doesn anybody know the equation which is used in forcite for the rdf?
Does anybody know the exact expression for radial distribution function computed by forcite analysis dialog? There are different expressions for rdf known in literature and when I compute the rdf for an infinite crystal it oscillates around 1 at large distances but when I compute it for a molecular model it oscillates around 0 at large distances. Doesn anybody know the equation which is used in forcite for the rdf?
