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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

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Reference TypeJournal (article/letter/editorial)
TitleStudy of Two‐Center Integrals Useful in Calculations on Molecular Structure. V. General Methods for Diatomic Integrals Applicable to Digital Computers
JournalThe Journal of Chemical Physics
AuthorsWahl, Arnold C.Author
Cade, Paul E.Author
Roothaan, C. C. J.Author
Year1964 (November)Volume41
Issue9
PublisherAIP Publishing
DOIdoi:10.1063/1.1726326Search in ResearchGate
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Mindat Ref. ID2040700Long-form Identifiermindat:1:5:2040700:1
GUID0
Full ReferenceWahl, 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
Plain TextWahl, 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
In(1964, November) The Journal of Chemical Physics Vol. 41 (9) AIP Publishing

See Also

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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
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
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
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
Roothaan, C. C. J. (1958) Evaluation of Molecular Integrals by Digital Computer. The Journal of Chemical Physics, 28 (5) 982-983 doi:10.1063/1.1744313
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
Browne, J. C., Miller, James (1962) General One‐Center Two‐Electron Integrals for Laguerre Functions. The Journal of Chemical Physics, 36 (9) 2324-2325 doi:10.1063/1.1732884
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
Wahl, Arnold C. (1964) Analytic Self‐Consistent Field Wavefunctions and Computed Properties for Homonuclear Diatomic Molecules. The Journal of Chemical Physics, 41 (9) 2600-2611 doi:10.1063/1.1726327
Cade, Paul E., Sales, K. D., Wahl, Arnold C. (1966) Electronic Structure of Diatomic Molecules. III. A. Hartree—Fock Wavefunctions and Energy Quantities for N2(X1Σg+) and N2+(X2Σg+, A2Πu, B2Σu+) Molecular Ions. The Journal of Chemical Physics, 44 (5) 1973-2003 doi:10.1063/1.1726972
 
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