van der Waals radii
A further issue in the context of van der Waals radii is that atoms in
molecules are not spherical, so one has to consider whether some sort of
spherical average is in fact appropriate, or whether the anisotropy needs to
be taken into account. The paper by Nyburg & Faerman in Acta Cryst B41
(1985)
274 gives an analysis of crystal packings that shows the anisotropies very
clearly. Sally Price and I have reviewed this issue, among others, in J. Phys.
Chem. 92 (1988) 3325.
Anthony Stone
University Chemical Laboratory, Internet: ajs1 (- at -) phx.cam.ac.uk
Lensfield Road, Phone: +44 223 336375
Cambridge CB2 1EW Fax: +44 223 336362