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Ruedenberg, Klaus, Roothaan, C. C. J., Jaunzemis, Walter (1956) Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. III. A Unified Treatment of the Hybrid, Coulomb, and One‐Electron Integrals. The Journal of Chemical Physics, 24 (2) 201-220 doi:10.1063/1.1742457

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Reference TypeJournal (article/letter/editorial)
TitleStudy of Two‐Center Integrals Useful in Calculations on Molecular Structure. III. A Unified Treatment of the Hybrid, Coulomb, and One‐Electron Integrals
JournalThe Journal of Chemical Physics
AuthorsRuedenberg, KlausAuthor
Roothaan, C. C. J.Author
Jaunzemis, WalterAuthor
Year1956 (February)Volume24
Issue2
PublisherAIP Publishing
DOIdoi:10.1063/1.1742457
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Mindat Ref. ID2013108Long-form Identifiermindat:1:5:2013108:3
GUID0
Full ReferenceRuedenberg, Klaus, Roothaan, C. C. J., Jaunzemis, Walter (1956) Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. III. A Unified Treatment of the Hybrid, Coulomb, and One‐Electron Integrals. The Journal of Chemical Physics, 24 (2) 201-220 doi:10.1063/1.1742457
Plain TextRuedenberg, Klaus, Roothaan, C. C. J., Jaunzemis, Walter (1956) Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. III. A Unified Treatment of the Hybrid, Coulomb, and One‐Electron Integrals. The Journal of Chemical Physics, 24 (2) 201-220 doi:10.1063/1.1742457
In(1956, February) The Journal of Chemical Physics Vol. 24 (2) AIP Publishing

See Also

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Roothaan, C. C. J., Ruedenberg, Klaus (1954) Errata: A Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. I, II. The Journal of Chemical Physics, 22 (4) 765 doi:10.1063/1.1740187
Roothaan, C. C. J. (1956) Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. IV. The Auxiliary Functions Cαβγδε(ρa,ρb) for α≥0. The Journal of Chemical Physics, 24 (5) 947-960 doi:10.1063/1.1742721
Roothaan, C. C. J. (1951) A Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. I. The Journal of Chemical Physics, 19 (12) 1445-1458 doi:10.1063/1.1748100
Rüdenberg, Klaus (1951) A Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. II. The Two‐Center Exchange Integrals. The Journal of Chemical Physics, 19 (12) 1459-1477 doi:10.1063/1.1748101
Wahl, Arnold C., Cade, Paul E., Roothaan, C. C. J. (1964) Study of Two‐Center Integrals Useful in Calculations on Molecular Structure. V. General Methods for Diatomic Integrals Applicable to Digital Computers. The Journal of Chemical Physics, 41 (9) 2578-2599 doi:10.1063/1.1726326
LaBudde, C. D., Sahni, R. C. (1960) Study of Molecular Integrals. II. Three‐Center One‐Electron and Two‐Electron Integrals. The Journal of Chemical Physics, 33 (4) 1022-1027 doi:10.1063/1.1731326
O‐Ohata, Kiyosi, Ruedenberg, Klaus (1966) Two‐Center Coulomb Integrals between Atomic Orbitals. Journal of Mathematical Physics, 7. 547-559 doi:10.1063/1.1704965
Christoffersen, Ralph E., Ruedenberg, Klaus (1967) Two‐Center Hybrid Integrals between Slater‐Type Atomic Orbitals. The Journal of Chemical Physics, 47 (5) 1855-1856 doi:10.1063/1.1712180
Milleur, Mac B., Matcha, Robert L. (1972) Unified Treatment of Two‐Center, Two‐Electron Integrals. I. Electron‐Repulsion, Spin‐Spin, and Spin‐Orbit Integrals Over Slater Functions. The Journal of Chemical Physics, 57 (8) 3029-3034 doi:10.1063/1.1678715
Sahni, R. C., LaBudde, C. D. (1960) Study of Molecular Integrals. I. Two‐Center Exchange Integrals. The Journal of Chemical Physics, 33 (4) 1015-1021 doi:10.1063/1.1731325
Guseinov, I. I. (1977) Analytical evaluation of one‐ and two‐center Coulomb and two‐center hybrid integrals for Slater‐type orbitals. The Journal of Chemical Physics, 67 (8) 3837-3839 doi:10.1063/1.435329
 
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