DOI: 10.1002/qua.560080506. Equivalence‐restricted open‐shell <scp>SCF</scp> theory

Equivalence‐restricted open‐shell SCF theory

10.1002/qua.560080506

Crossref journal-article

Wiley

International Journal of Quantum Chemistry (311)

Abstract

AbstractA method is presented for generating open‐shell equivalence‐restricted SCF orbitals in high‐symmetry situations using Roothaan–Hartree–Fock programs which are adapted for lower symmetry.

Bibliography

Jackels, C. F., & Davidson, E. R. (1974). Equivalenceârestricted openâshell SCF theory. International Journal of Quantum Chemistry, 8(5), 707â714. Portico.

Authors 2

Charles F. Jackels (first)
Ernest R. Davidson (additional)

References 4 Referenced 22

Dates

Type	When
Created	20 years, 7 months ago (Dec. 31, 2004, 1:17 p.m.)
Deposited	1 year, 10 months ago (Oct. 19, 2023, 2:16 p.m.)
Indexed	1 year, 5 months ago (March 16, 2024, 4:47 p.m.)
Issued	50 years, 11 months ago (Sept. 1, 1974)
Published	50 years, 11 months ago (Sept. 1, 1974)
Published Online	20 years, 10 months ago (Oct. 19, 2004)
Published Print	50 years, 11 months ago (Sept. 1, 1974)

Funders 0

None

BibTeX

@article{Jackels_1974, title={Equivalence‐restricted open‐shell <scp>SCF</scp> theory}, volume={8}, ISSN={1097-461X}, url={http://dx.doi.org/10.1002/qua.560080506}, DOI={10.1002/qua.560080506}, number={5}, journal={International Journal of Quantum Chemistry}, publisher={Wiley}, author={Jackels, Charles F. and Davidson, Ernest R.}, year={1974}, month=sep, pages={707–714} }

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