High-level multireference methods in the quantum-chemistry program system COLUMBUS: Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin–orbit CI and parallel CI density-Reference-Cited by-同舟云学术

High-level multireference methods in the quantum-chemistry program system COLUMBUS: Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin–orbit CI and parallel CI density

Published:2001 Issue:5 Volume:3 Page:664-673
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Lischka Hans,Shepard Ron,Pitzer Russell M.,Shavitt Isaiah,Dallos Michal,Müller Thomas,Szalay Pe´ter G.,Seth Michael,Kedziora Gary S.,Yabushita Satoshi,Zhang Zhiyong

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2001/CP/B008063M

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