[molpro-user] CASSCF ORBITAL GUESS

[Xinzheng Yang]

Yes, I think it works.

On 6/8/05, John Sears <gtg390f at mail.gatech.edu> wrote:
> Dear ALL
> Is it possible to perform a CASSCF with a small basis set and then use these
> orbitals as guess orbitals for the same CAS with a larger basis?  Any help
> with this would be greatly appreciated.
> John
> --
> John Steven Sears
> Center for Computational Molecular Science and Technology
> School of Chemistry and Biochemistry
> Georgia Institute of Technology
> Atlanta, GA 30332-0400
> Office: Boggs 3-19
> Phone: 404-385-1310
> email: john.sears at chemistry.gatech.edu
> 
> 
> 


-- 
Xinzheng Yang
1071 Clayton Ln, Apt. 1406
Austin, TX 78723