[molpro-user] Geometry specification

Lorenzo Lodi l.lodi at ucl.ac.uk
Mon Oct 9 16:32:17 BST 2006

Is there any reason why molpro should run faster specifying the geometry 
in Z-matrix format rather than as XYZ?
In XYZ format, is is possible to specify the coordinates in bohrs 
instead that in angstrom?



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