ASYM20: A Program for Force Constant and Normal Coordinate Calculations, with a Critical Review of the Theory Involved

Journal of molecular spectroscopy

Volumn 160, Issue 1, 1993, Pages 117-142

  Hedberg, Lise ^a   Mills, Ian M ^b  

^a OREGON STATE UNIVERSITY   (United States)

^b UNIVERSITY OF READING   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0344225778     PISSN: 00222852     EISSN: 1096083X     Source Type: Journal    
DOI: 10.1006/jmsp.1993.1162     Document Type: Article

References (25)

1. H. B. Wilson, J. C. Decius, and P. C. Cross, "Molecular Vibrations,” McGraw-Hill, New York, 1955.
2. S. Califano, “Vibrational States.” Wiley, New York, 1976.
3. A. R. Hoy, I. M. Mills, and G. Strey, Mol. Phys. 24, 1265-1290 (1972).
4. J. Aldous and I. M. Mills, Spectrochim. Acta 18, 1073-1091 (1962).
5. J. H. Wilkinson and C. Reinsch, "Handbook for Automatic Computation. Vol. II. Linear Algebra," Springer-Verlag, New York, 1971.
6. B. L. Crawford and W. H. Fletcher, J. Chem. Phys. 19, 141-142 (1951).
7. J. H. Meal and S. R. Polo, J Chem. Phys. 24, 1119-1125 and 1126-1133 (1956).
8. J. K. G. Watson, in “Vibrational Spectra and Structure" (J. R. Durig, Ed.) Vol. 6, Chap. 1, Elsevier, Amsterdam. 1977.
9. D. Kivelson and E. B. Wilson, J. Chem. Phys. 20, 1575-1579 (1952).
10. M. R. Aliev and J. K. G. Watson, J. Mol. Spectrosc. 61, 29-52 (1976).
11. S. J. Cyvin and G. Hagen, Chem. Phys. Lett. 1, 645-646 (1968).
12. I. M. Mills, in "Molecular Spectroscopy: Modern Research” (K. Narahari Rao and C. W. Matthews, Eds.). Vol. I, Chap. 3, Academic Press, New York, 1973.
13. M. R. Aliev and J. K. G. Watson, in “Molecular Spectroscopy: Modern Research" (K. Narahari Rao, Ed.). Vol. III, Chap. I, Academic Press, New York, 1985.
14. A. G. Robiette, in "Molecular Structure by Diffraction Methods.” Specialist Periodical Reports. Vol. 1. Chap. 4, The Chemical Society. London, 1973.
15. A. G. Robiette, D. L. Gray, and F. W. Birss, Mol. Phys. 32, 1591-1607 (1976).
16. D. A. McQuarrie, “Statistical Mechanics.” p. 136, Harper & Row. New York. 1976.
17. R. Stølevik, H. M. Ship, and S. J. Cyvin, Chem. Phys. Lett. 15, 263-265 (1972).
18. I. M. Mills, J. Phys. Chem. 80, 1187-1189 (1976).
19. See, for example, the Introduction to “Structure Data of Free Polyatomic Molecules,” by K. Kuchitsu et al. Landolt-Börnstein New Series Vol. 15, Springer-Verlag, New York. 1987.
20. M. Toyama, T. Oka, and Y. Morino, J. Mol Spectrosc. 13, 193-213 (1964).
21. See, for example, P. Gans, “Data Fitting in the Chemical Sciences by the Method of Least Squares,” Wiley, Chichester, 1992.
22. A. A. Chal mers and D. C. McKean, Spectrochim. Acta 22, 251-279 (1966).
23. L. S. Bartell, in “Molecular Structure by Diffraction Methods," Specialist Periodical Reports, Vol. 5, Chap. 4, The Chemical Society, London, 1975.
24. I. Miels, T. Cvitas, N. Kaelay, K. Homann, and K. Kuchitsu, "Quantities. Units and Symbols in Physical Chemistry. The IUPAC Green Book." Blackwell Scientific. Oxford. 1988 and 1993.
25. QCPE. Indiana University, Bloomington, IN.