Whether bonds connecting atoms are drawn or not should depend on the sum
of the atom or ionic radii, and should not have to be specified as a
distance for each atom pair. For example, instead of connecting atom sets
within a range of distances in Angstroms eg:
connect (~cations) (~anions) 0.8 2.5;
it would be good to be able to connect them within a range of fractions of
their combined ionic or atomic radii eg:
connect (~cations) (~anions) 0.8 1.2 ionic;
or
connect (~cations) (~anions) 0.8 1.2 atomic;
Alan
______________________________________________
Dr Alan Hewat, NeutronOptics, Grenoble, FRANCE
<alan.he...@neutronoptics.com> +33.476.98.41.68
http://www.NeutronOptics.com/hewat
______________________________________________
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