Spin-polarized self-consistent-field equations for paired orbitals
Author:
Publisher
American Physical Society (APS)
Subject
Atomic and Molecular Physics, and Optics
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevA.82.042505/fulltext
Reference31 articles.
1. Magnetic Effects and the Hartree-Fock Equation
2. Quantum Theory of Many-Particle Systems. III. Extension of the Hartree-Fock Scheme to Include Degenerate Systems and Correlation Effects
3. Band Theory, Valence Bond, and Tight‐Binding Calculations
4. Single determinant wave functions
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1. PROJECTION OF SINGLE-DETERMINANT SOLUTIONS OF SPIN-POLARIZED SELF-CONSISTENT FIELD EQUATIONS IN THE BASIS SET OF SPIN-PAIRED ORBITALS;Journal of Structural Chemistry;2021-08
2. Analysis of spin-polarized solutions in the basis set of paired orbitals;Journal of Structural Chemistry;2016-09
3. Nitric oxide as a non-innocent ligand in (bio-)inorganic complexes: Spin and electron transfer in FeIINO bond;Journal of Inorganic Biochemistry;2014-07
4. Net spin and polarization components of the spin density for the single determinant in the basis of paired orbitals;International Journal of Quantum Chemistry;2012-06-14
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