Posted by Valera on November 04, 2013 at 14:31:18:
In Reply to: write a molden file for caspt2 or mrci calculation posted by José Jara on November 02, 2013 at 12:12:38:
"Standard" molcas format for the orbitals is the Orbital file, e.g. ScfOrb, Pt2Orb, etc.
For example they are used to calculate .grid files for visualization.
If you need a molden file, you can for example, run SCF,requesting 0 iteration, and use Orbital file as INPORB.
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