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Reeves, C. M., Fletcher, R. (1965) Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. III. The Orbital Basis and Its Effect on Valence. The Journal of Chemical Physics, 42 (12) 4073-4081 doi:10.1063/1.1695896

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Reference TypeJournal (article/letter/editorial)
TitleUse of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. III. The Orbital Basis and Its Effect on Valence
JournalThe Journal of Chemical Physics
AuthorsReeves, C. M.Author
Fletcher, R.Author
Year1965 (June 15)Volume42
Issue12
PublisherAIP Publishing
DOIdoi:10.1063/1.1695896Search in ResearchGate
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Mindat Ref. ID2041574Long-form Identifiermindat:1:5:2041574:5
GUID0
Full ReferenceReeves, C. M., Fletcher, R. (1965) Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. III. The Orbital Basis and Its Effect on Valence. The Journal of Chemical Physics, 42 (12) 4073-4081 doi:10.1063/1.1695896
Plain TextReeves, C. M., Fletcher, R. (1965) Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. III. The Orbital Basis and Its Effect on Valence. The Journal of Chemical Physics, 42 (12) 4073-4081 doi:10.1063/1.1695896
In(1965, June) The Journal of Chemical Physics Vol. 42 (12) AIP Publishing

See Also

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Reeves, C. M. (1963) Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. I. Preliminary Investigations. The Journal of Chemical Physics, 39 (1) 1-10 doi:10.1063/1.1733982
Reeves, C. M., Harrison, M. C. (1963) Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. II. The Ammonia Molecule. The Journal of Chemical Physics, 39 (1) 11-17 doi:10.1063/1.1733984
Schwartz, Maurice E., Schaad, L. J. (1968) Ab InitioStudies of Small Molecules Using 1s Gaussian Basis Functions. III. LCGTO SCF MO Wavefunctions of the Three‐ and Four‐Electron Systems He2+, He2, and Linear H3, H4+, H4. The Journal of Chemical Physics, 48 (10) 4709-4715 doi:10.1063/1.1668050
Moskowitz, J. W., Harrison, M. C. (1965) Ethylene Molecule in a Gaussian Basis. I. A Self‐Consistent‐Field Calculation. The Journal of Chemical Physics, 42 (5) 1726-1731 doi:10.1063/1.1696184
Moskowitz, J. W., Harrison, M. C. (1965) Gaussian Wavefunctions for the 10‐Electron Systems. III. OH−, H2O, H3O+. The Journal of Chemical Physics, 43 (10) 3550-3555 doi:10.1063/1.1696516
Dunning, Thom. H. (1971) Gaussian Basis Functions for Use in Molecular Calculations. III. Contraction of (10s6p) Atomic Basis Sets for the First‐Row Atoms. The Journal of Chemical Physics, 55 (2) 716-723 doi:10.1063/1.1676139
Schwartz, Maurice E., Schaad, L. J. (1967) Ab Initio Studies of Small Molecules Using 1s Gaussian Basis Functions. II. H3+. The Journal of Chemical Physics, 47 (12) 5325-5334 doi:10.1063/1.1701797
Hehre, W. J., Ditchfield, R., Pople, J. A. (1972) Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic Molecules. The Journal of Chemical Physics, 56 (5) 2257-2261 doi:10.1063/1.1677527
Cacelli, Ivo, Moccia, Roberto, Rizzo, Antonio (1993) Gaussian type orbital basis sets for the calculation of continuum properties in molecules: The photoionization cross section of H2. The Journal of Chemical Physics, 98 (11). 8742-8748 doi:10.1063/1.464482
Unland, Mark L., Letcher, John H., Van Wazer, John R. (1969) Characterization of Ground‐State Wavefunctions by Measured Electronic Properties. III. A Gaussian Basis Self‐Consistent‐Field Calculation for Nitrogen Trifluoride. The Journal of Chemical Physics, 50 (8) 3214-3219 doi:10.1063/1.1671543
Pitzer, Russell M. (1967) Optimized Molecular Orbital Wavefunctions for Methane Constructed from a Minimum Basis Set. The Journal of Chemical Physics, 46 (12) 4871-4875 doi:10.1063/1.1840649
 
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