Natural orbitals in the CIPSI algorithm
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference20 articles.
1. Virtual Orbitals in Hartree-Fock Theory
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4. A simple procedure for the improvement of CI convergence in molecular systems
5. Correlation effects on cis—trans energy differences in open-shell systems: The hoco radical as an example
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