[molpro-user] Print Diag S eigenvalues
aaron at spawn.scs.uiuc.edu
Tue Sep 27 21:16:31 BST 2005
By 'iprint.gt.0' they mean 'Set iprint to greater than or equal to
should both work.
On Tue, 2005-09-27 at 15:03, Ben Mintz wrote:
> I am trying to diagonalize and then print the eigenvalues of the overlap
> matrix. I have done the following
> and this is what I am getting
> PROGRAM * MATROP
> Overlap matrix loaded to S
> Matrix S diagonalized with eigenvectors EIGVEC and eigenvalues EIGVAL
> but it is not printing the eigenvalues. How do you print the eigenvalues?
> Ben Mintz
Aaron Virshup Martinez Group
Department of Physics Phone: 217-244-7383
University of Illinois at Urbana-Champaign
1110 W. Green St.
Urbana, IL 61801 aaron at spawn.scs.uiuc.edu
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