[molpro-user] XYZ input

Grant Hill jghill at wsu.edu
Fri Nov 14 17:24:50 GMT 2008


Hi Jayashree,

It appears you have a small typo

On 13 Nov 2008, at 07:55, Jayashree wrote:

>  geomtype=xyz

that should be geomtyp=xyz (no 'e' at the end).

HTH,

Grant



More information about the Molpro-user mailing list