[molpro-user] OSV/PNO Local Methods

Matthias Heger heger at ualberta.ca
Fri Feb 17 22:17:48 CET 2017

Hello everyone,

I've started looking into OSV-/PNO-based local methods and I have two 
questions. First, when I try to call {df-lccsd(t)-f12, throsv=...} in 
Molpro 2015 as suggested in the "Getting started" manual (section 
17.4.3), I get an "OSV method not yet implemented" error. Am I missing 
something here?

Second, is there a way to save specific PNOs or OSVs from the local 
calculations for later visualization?


Dr. Matthias Heger
Department of Chemistry, University of Alberta
11227 Saskatchewan Drive NW
Edmonton, AB T6G 2G2, Canada

Office: CCIS 4-151
Email: heger at ualberta.ca

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