Comparison between the performances of the spin-projected Hartree-Fock, generalized valence-bond, and spin-coupled approaches
Author:
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/qua.22004/fullpdf
Reference39 articles.
1. Spin-Coupled Study of the Electronic Mechanism of the Hetero-Diels−Alder Reaction of Acrolein and Ethene
2. A spin-coupled study of the Claisen rearrangement of allyl vinyl ether
3. The unusual electronic mechanism of the [1,5] hydrogen shift in (Z)-1,3-pentadiene predicted by modern valence bond theory
4. Quantum Theory of Many-Particle Systems. III. Extension of the Hartree-Fock Scheme to Include Degenerate Systems and Correlation Effects
5. Single determinant wave functions
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