Abstract
In the previous chapter we were largely concerned with those properties of molecules that are associated with their rotational and vibrational degrees of freedom. In the present chapter, we again take up electronic structure, discussed earlier in Chapter 2 for diatomic molecules and in Chapter 4 via electron density theory. Though polyatomic molecules were embraced by the electron density treatment, it is still of importance to describe orbital theories of such molecules, which is the main purpose of the present chapter.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
Preview
Unable to display preview. Download preview PDF.
References
M. I. Al-Joburg and D. W. Turner Jr., J. Chem. Soc. 43, 616 (1965).
N. C. Baird and M. J. S. Dewar, J. Chem. Phys. 50, 1262 (1969).
L. C. Balbás, A. Rubio, J. A. Alonso, N. H. March, and G. Borstel, J. Phys. Chem. Solids 49, 1013 (1988).
W. Bingel, J. Chem. Phys. 30, 1250, 1254 (1959).
R. C. Bingham, M. J. S. Dewar, and D. H. Lo, J. Am. Chem. Soc. 97, 1285 (1975).
R. Botter and H. M. Rosenstock, J. Res. Nat. Bur. Stand. 73a, 313 (1969).
I. D. Clark and D. C. Frost, J. Am. Chem. Soc. 89, 244 (1967).
W. Cochran, Acta Crys. 9, 924 (1956).
C. A. Coulson, Valence, 2nd Ed., Oxford University Press, New York, Oxford (1961).
M. A. Copian, J. H. Moore, and J. A. Tossell, J. Chem. Phys. 68, 329 (1978).
C. W. N. Cumper, Wave Mechanics for Chemists, Academic, New York (1966).
M. J. S. Dewar and E. Haselbach, J. Am. Chem. Soc. 92, 590 (1970).
M. J. S. Dewar and G. Klopman, J. Am. Chem. Soc. 89, 3089 (1967).
R. N. Dixon, G. Duxbury, M. Horani, and J. Rostas, Mol. Phys. 22, 977 (1971).
H. H. Greenwood, Computing Methods in Quantum Organic Chemistry, Wiley-Interscience, New York (1972).
G. Herzberg and E. Teller, Z. Phys. Chem. B21, 410 (1933).
P. J. Hiett, F. Flores, P. J. Grout, N. H. March, A. Martin Rodero, and G. Senatore, Surf. Sci. 140, 400 (1984).
R. Hoffmann, J. Chem. Phys. 39, 1397 (1963).
J. M. Hollas, High Resolution Spectroscopy, Butterworths, London (1982).
R. O. Jones and O. Gunnarsson, Rev. Mod. Phys. 61, 689 (1989).
L. Karlsson, L. Mattsson, R. Jadry, T. Bergmark, and K. Siegbahn, Phys. Scrip. 14, 230 (1976).
W. Kohn and L. J. Sham, Phys. Rev. 140, Al 133 (1965).
J. P. Lowe, Quantum Chemistry, Academic, New York (1978).
N. H. March, Acta Crys. 5, 187 (1952).
N. H. March, Specialist Periodical Reports, Theoretical Chemistry, Vol. A, Royal Society of Chemistry, London (1981).
I. E. McCarthy and E. Weigold, Contemporary Physics 24, 163 (1983).
A. D. McLean and M. Yoshimine, Tables of Linear Molecule Wave Functions, IBM, Hopewell Junction, New York (1967).
R. McWeeny, Coulson’s Valence, 3rd Ed., Oxford University Press, Oxford (1979).
A. J. Merer and R. S. Mulliken, Chem. Rev. 69, 639 (1969).
J. N. Murrell and A. J. Harget, Semi-Empirical Self-Consistent Field Theory, Wiley-Interscience, New York (1972).
W. von Niessen, L. S. Cederbaum, and W. P. Kraemer, J. Chem. Phys. 65, 1378 (1976).
R. Pariser, J. Chem. Phys. 21, 568 (1953).
R. G. Parr, The Quantum Theory of Molecular Electronic Structure, Benjamin, New York (1963).
J. A. Pople, Trans. Faraday Soc. 49, 1375 (1953).
J. A. Pople, G. P. Santry, and G. A. Segal, J. Chem. Phys. 43, 5129 (1965).
J. A. Pople and G. A. Segal, J. Chem. Phys. 43 (suppl) 136 (1965).
J. A. Pople and G. A. Segal, J. Chem. Phys. 44, 3289 (1966).
R. Renner, Z. Phys. 92, 172 (1934).
W. G. Richards. Quantum Pharmacology, 2nd Ed., Butterworths, London (1983).
W. G. Richards and D. L. Cooper, Ab Initio MO Calculations, 2nd Ed., Clarendon Press, Oxford (1983).
L. Salem, Molecular Orbital Theory of Conjugated Systems, Benjamin, New York (1966).
J. M. Schulman and J. W. Moskowitz, J. Chem. Phys. 47, 3491 (1967).
J. C. Slater, Phys. Rev. 81, 385 (1951).
B. Stenhouse, P. J. Grout, N. H. March, and J. Wenzel, Phil. Mag. 36, 129 (1977).
A. Strietwieser, Molecular Orbital Theory for Organic Chemists, John Wiley and Sons, New York (1961).
D. W. Turner, C. Baker, A. D. Baker, and C. R. Brundle, Molecular Photoelectron Spectroscopy, John Wiley and Sons, London (1970).
J. H. Van Vleck and P. C. Cross, J. Chem. Phys. 1, 357 (1933).
B. G. Williams (ed.) Compton Scattering: The Investigation of Electron Momentum Distribution, McGraw-Hill, New York (1977).
M. C. Zerner, Theor. Chim. Acta 32, 111 (1973);
M. C. Zerner, Theor. Chim. Acta 53, 21 (1979).
Author information
Authors and Affiliations
Rights and permissions
Copyright information
© 1993 Springer Science+Business Media New York
About this chapter
Cite this chapter
March, N.H., Mucci, J.F. (1993). Molecular Orbital Methods and Polyatomic Molecules. In: Chemical Physics of Free Molecules. Springer, Boston, MA. https://doi.org/10.1007/978-1-4757-9646-9_6
Download citation
DOI: https://doi.org/10.1007/978-1-4757-9646-9_6
Publisher Name: Springer, Boston, MA
Print ISBN: 978-1-4757-9648-3
Online ISBN: 978-1-4757-9646-9
eBook Packages: Springer Book Archive