Configuration Interaction in Molecular‐Orbital Theory

Norman L. Allinger; Thomas W. Stuart

doi:10.1063/1.1701673

Configuration Interaction in Molecular‐Orbital Theory

The Journal of Chemical Physics ◽

10.1063/1.1701673 ◽

1967 ◽

Vol 47 (11) ◽

pp. 4611-4616 ◽

Cited By ~ 21

Author(s):

Norman L. Allinger ◽

Thomas W. Stuart

Keyword(s):

Molecular Orbital ◽

Configuration Interaction ◽

Molecular Orbital Theory ◽

Orbital Theory

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Further studies on configuration interaction in the molecular orbital theory of ?-systems

Theoretica Chimica Acta ◽

10.1007/bf00529345 ◽

1968 ◽

Vol 10 (3) ◽

pp. 247-253 ◽

Cited By ~ 11

Author(s):

Thomas W. Stuart ◽

Norman L. Allinger

Keyword(s):

Molecular Orbital ◽

Configuration Interaction ◽

Molecular Orbital Theory ◽

Orbital Theory

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Multi-component molecular orbital theory for electrons and nuclei including many-body effect with full configuration interaction treatment: isotope effects on hydrogen molecules

Chemical Physics Letters ◽

10.1016/s0009-2614(02)00881-3 ◽

2002 ◽

Vol 360 (5-6) ◽

pp. 494-500 ◽

Cited By ~ 78

Author(s):

Masanori Tachikawa

Keyword(s):

Molecular Orbital ◽

Configuration Interaction ◽

Isotope Effects ◽

Molecular Orbital Theory ◽

Many Body ◽

Orbital Theory ◽

Body Effect ◽

Full Configuration Interaction ◽

Hydrogen Molecules ◽

Interaction Treatment

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Bonding in Transition Metal Silyl Dimers. Molecular Orbital Theory

10.21236/ada208269 ◽

1989 ◽

Author(s):

Alfred B. Anderson ◽

Paul Shiller ◽

Eugene A. Zarate ◽

Claire A. Tessier-Youngs ◽

Wiley J. Youngs

Keyword(s):

Transition Metal ◽

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory

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Approximate molecular orbital theory for inorganic molecules

Theoretica Chimica Acta ◽

10.1007/bf00529430 ◽

1970 ◽

Vol 16 (4) ◽

pp. 291-302 ◽

Cited By ~ 14

Author(s):

R. D. Brown ◽

K. R. Roby

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory ◽

Inorganic Molecules

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Molecular Orbital Theory of Diamagnetism. IV. Anisotropic Properties of Benzene

The Journal of Chemical Physics ◽

10.1063/1.1726311 ◽

1964 ◽

Vol 41 (8) ◽

pp. 2559-2560 ◽

Cited By ~ 53

Author(s):

J. A. Pople

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory ◽

Anisotropic Properties

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Molecular Orbital Theory of Hyperconjugation. II. A Note on the Desmotropism of Pyrrole

Journal of the Chinese Chemical Society ◽

10.1002/jccs.195500014 ◽

1955 ◽

Vol 2 (2) ◽

pp. 105-110

Author(s):

Wei-Chuwan Lin

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory

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Introduction to elementary molecular orbital theory and to semiempirical methods

Journal of Molecular Structure ◽

10.1016/0022-2860(78)80106-9 ◽

1978 ◽

Vol 50 (2) ◽

pp. 402-403

Author(s):

M.R

Keyword(s):

Molecular Orbital ◽

Semiempirical Methods ◽

Molecular Orbital Theory ◽

Orbital Theory

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Interpretation of experimental M�ssbauer quadrupole splittings of iron pentacyanide complexes using molecular orbital theory

Theoretica Chimica Acta ◽

10.1007/bf00546907 ◽

1974 ◽

Vol 35 (3) ◽

pp. 231-236 ◽

Cited By ~ 12

Author(s):

Alfred Trautwein ◽

Frank E. Harris ◽

Istvan D�zsi

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory

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Approximate Self‐Consistent Molecular‐Orbital Theory. VI. INDO Calculated Equilibrium Geometries

The Journal of Chemical Physics ◽

10.1063/1.1669925 ◽

1968 ◽

Vol 49 (10) ◽

pp. 4643-4650 ◽

Cited By ~ 106

Author(s):

M. S. Gordon ◽

J. A. Pople

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory ◽

Self Consistent ◽

Equilibrium Geometries ◽

Calculated Equilibrium

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ChemInform Abstract: MOLECULAR ORBITAL THEORY OF THE HYDROGEN BOND. 20. PYRROLE AND IMIDAZOLE AS PROTON DONORS AND PROTON ACCEPTORS

Chemischer Informationsdienst ◽

10.1002/chin.197848065 ◽

1978 ◽

Vol 9 (48) ◽

Author(s):

J. E. DEL BENE ◽

I. COHEN

Keyword(s):

Hydrogen Bond ◽

Molecular Orbital ◽

Molecular Orbital Theory ◽

Orbital Theory ◽

Proton Donors

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