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Perspective: Multireference coupled cluster theories of dynamical electron correlation.
- Source :
-
Journal of Chemical Physics . 7/21/2018, Vol. 149 Issue 3, pN.PAG-N.PAG. 13p. 1 Color Photograph, 1 Diagram, 1 Graph. - Publication Year :
- 2018
-
Abstract
- Predicting the electronic structure and properties of molecular systems that display strong electron correlation effects continues to remain a fundamental theoretical challenge. This perspective discusses the recent progress and current challenges in multireference wave function methods for dynamical electron correlation, focusing on systematically improvable methods that go beyond the limitations of configuration interaction and perturbation theory. [ABSTRACT FROM AUTHOR]
Details
- Language :
- English
- ISSN :
- 00219606
- Volume :
- 149
- Issue :
- 3
- Database :
- Academic Search Index
- Journal :
- Journal of Chemical Physics
- Publication Type :
- Academic Journal
- Accession number :
- 130857411
- Full Text :
- https://doi.org/10.1063/1.5039496