A theoretical and experimental study of Sb4O6: Vibrational analysis, infrared, and Raman spectra

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 60, Issue 1-2, 2004, Pages 425-434

  Gilliam, Sean J ^a   Jensen, James O ^b   Banerjee, Ajit ^b   Zeroka, Daniel ^c   Kirkby, Scott J ^a   Merrow, Clifton N ^a  

^a MISSOURI UNIVERSITY OF SCIENCE AND TECHNOLOGY   (United States)

^b EDGEWOOD CHEMICAL BIOLOGICAL CENTER   (United States)

^c LEHIGH UNIVERSITY   (United States)

Author keywords

Antimony trioxide; Infrared spectra; Raman spectra; Sb2O3; Sb4O6; Theory; Vibrational spectra

Indexed keywords

ERROR STATISTICS; FREQUENCIES; INFRARED SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; RAMAN SCATTERING; X RAY DIFFRACTION ANALYSIS;

STANDARD DEVIATIONS; VIBRATIONAL SPECTRA;

ANTIMONY COMPOUNDS;

ANTIMONY; ANTIMONY OXIDE; ARSENIC; OXIDE; PHOSPHORUS;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER PROGRAM; ELECTRON; INFRARED SPECTROPHOTOMETRY; METHODOLOGY; NORMAL DISTRIBUTION; RAMAN SPECTROMETRY; SPECTROPHOTOMETRY;

ANTIMONY; ARSENIC; ELECTRONS; MODELS, CHEMICAL; MODELS, MOLECULAR; NORMAL DISTRIBUTION; OXIDES; PHOSPHORUS; SOFTWARE; SPECTROPHOTOMETRY; SPECTROPHOTOMETRY, INFRARED; SPECTRUM ANALYSIS, RAMAN;

EID: 0344308473     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1386-1425(03)00245-2     Document Type: Article

References (43)

1. Huheey J.E. Inorganic Chemistry: Principles of Structure and Reactivity. 3rd ed. 1983;723ff Harper & Row, New York.
2. Bart J.C.J., Daly J.J. Chem. Commun. 20:1968;1207.
3. Stetter H. Angew. Chem. 74:1962;361.
4. Muetterties E.L. Science. 196:1977;4292.
5. Kirkby S.J., Lough A.J., Ozin G.A. Z. Kristallogr. 210:1995;956.
6. Karabulut M., Marasinghe G.K., Click C.A., Metwalli E., Brow R.K., Booth C.H., Bucher J.J., Shuh D.K., Suratwala T.I., Campbell J.H. J. Am. Ceram. Soc. 85:2002;1093.
7. Soignet S.L., Frankel S.R., Douer D., Tallman M.S., Kantarjian H., Calleja E., Stone R.M., Kalaycio M., Scheinberg D.A., Steinherz P., Sievers E.L., Coutre' S., Dahlberg S., Ellison R., Warrell R.P. Jr. J. Clin. Oncol. 19:2001;3852.
8. Boryniec S., Przygocki W. Prog. Rub. Plast. Tech. 17:2001;59-80.
9. Youk J.H., Kambour R.P., MacKnight W.J. Macromolecules. 33:2000;3594-3599.
10. Zabinski J.S., Donley M.S., McDevitt N.T. Wear. 165:1993;103-108.
11. Ghosh A., Chakravorty D. J. Phys. Condens. Matter. 3:1991;3335-3342.
12. Gopalakrishnan P.S., Manohar H. J. Solid State Chem. 15:1975;61-67.
13. Miller P.J., Cody C.A. Spectrochim. Acta A. 38:1982;555-559.
14. Svensson C. Acta Crystallogr. B. 31:1975;2016-2018.
15. Wood C., Van Pelt B., Dwight A. Phys. Status Solidi B. 54:1972;701-706.
16. Akishin P.A., Spiridonov V.P. Zh. Strukt. Khim. 2:1961;542-544.
17. Mueller A., Cyvin B.N., Cyvin S.J., Pohl S., Krebs B. Spectrochim. Acta A. 32:1976;67-74.
18. Sourisseau C., Mercier R. Spectrochim. Acta A. 34:1978;173-178.
19. Konings R.J.M., Booij A.S., Cordfunke E.H.P. Chem. Phys. Lett. 210:1993;380-383.
20. Cody C.A., DiCarlo L., Darlington R.K. Inorg. Chem. 18:1979;1572-1576.
21. I.R. Beattie, K.M.S. Livingston, G.A. Ozin, D.J. Reynolds, J. Chem. Soc. A (1970) 449-451.
22. Mestl G., Ruiz P., Delmon B., Knozinger H. J. Phys. Chem. 98:1994;11276-11282.
23. Degen I.A., Newman G.A. Spectrochim. Acta A. 49:1993;859-887.
24. Jensen J.O., Banerjee A., Merrow C.N., Zeroka D., Lochner J.M. J. Mol. Struct. (Theochem.). 531:2000;323-331.
25. Hehre W.J., Radom L., Schleyer P.V.R., Pople J.A. Ab Initio Molecular Orbital Theory. 1986;Wiley, New York.
26. Møller C., Plesset M.S. Phys. Rev. 46:1934;618-622.
27. Parr R.G., Yang W. Density-Functional Theory of Atoms and Molecules. 1989;Oxford, New York.
28. Becke A.D. J. Chem. Phys. 98:1993;5648-5652.
29. Lee C., Yang W., Parr R.G. Phys. Rev. B. 37:1988;785-789.
30. Stevens W., Basch H., Krauss J. J. Chem. Phys. 81:1984;6026.
31. Stevens W.J., Krauss M., Bausch H., Jasien P.G. Can. J. Chem. 70:1992;612.
32. Cundari T.R., Stevens W.J. J. Chem. Phys. 98:1993;5555.
33. Dunning T.H. Jr., Hay P.J. Schaefer H.F. III. Modern Theoretical Chemistry. 1976;1-28 Plenum Press, New York.
34. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, N. Rega, P. Salvador, J.J. Dannenberg, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, L.G. Stefanov, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, GAUSSIAN 98, Revision A.11.2, Gaussian, Inc., Pittsburgh, PA, 2001.
35. S.J. Gilliam, S.J. Kirkby, C.N. Merrow, D. Zeroka, A. Banerjee, J.O. Jensen, J. Phys. Chem. B 107 (2003) 2892-2896.
36. S.J. Gilliam, C.N. Merrow, S.J. Kirkby, J.O. Jensen, D. Zeroka, A. Banerjee, J. Solid State Chem. 173 (2003) 57-58.
37. Standard Guide for Raman Shift Standards for Spectrometer Calibration, ASTM International, Document E1840-96, 2002.
38. Ballirano P., Maras A. Z. Kristallogr. (New Crystallogr. Struct.). 217:2002;177-178.
39. Sundararajan V., Kumar V. J. Chem. Phys. 102:1995;9631-9637.
40. Cotton F.A. Chemical Applications of Group Theory. 1971;Wiley/Interscience, New York.
41. Nielsen A.B., Holder A.J. GaussView User's Reference, Version 2.0. 1998;Gaussian, Inc, Pittsburgh, PA.
42. Jensen J.O., Zeroka D., Banerjee A. J. Mol. Struct. (Theochem.). 505:2000;31-43.
43. Jensen J.O., Zeroka D. J. Mol. Struct. (Theochem.). 487:1999;267-274.