Split-localized orbitals can yield stronger configuration interaction convergence than natural orbitals
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1610434
Reference50 articles.
1. The Configuration Interaction Method: Advances in Highly Correlated Approaches
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4. Natural Orbitals in the Quantum Theory of Two-Electron Systems
5. Properties and Uses of Natural Orbitals
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