Canonical form of the Hartree-Fock orbitals in open-shell systems
Author:
Funder
RFBR
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4849615
Reference56 articles.
1. Self‐Consistent Orbitals for Radicals
2. Self-Consistent Field Theory for Open Shells of Electronic Systems
3. Theory of the self-consistent field for states with open shells
4. Orientation in nucleophilic substitution in excited molecules of quaternary salts of nitrogen heterocyclics
5. General SCF operator satisfying correct variational condition
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