Liquid tin tetrachloride: A Monte Carlo simulation study

Chemical Physics Letters

Volumn 316, Issue 5-6, 2000, Pages 510-516

  Rocha, Willian R ^a   De Almeida, Kátia J ^a   De Almeida, Wagner B ^a,b  

^a FEDERAL UNIVERSITY OF MINAS GERAIS   (Brazil)

^b FEDERAL UNIVERSITY OF JUIZ DE FORA   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0042727687     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(99)01311-1     Document Type: Article

References (29)

1. G.P. Van der Kelen, E.V. Van den Berghe, L. Verdonck, in: K. Sawyer (Ed.), Organotin Compounds, vol. 1, Marcel Dekker, New York, 1971, p. 81.
2. R.C. Poller, The Chemistry of Organotin Compounds, Logos, London, 1970.
3. Filgueiras C.A.L. Quim. Nova. 21:1998;176.
4. Jorgensen W.L., Madura J.D., Swenson C.J. J. Am. Chem. Soc. 106:1984;6638.
5. Jorgensen W.L., Swenson C.J. J. Am. Chem. Soc. 107:1985;1489.
6. Jorgensen W.L. J. Phys. Chem. 90:1986;1276.
7. Jorgensen W.L., Briggs J.M. Mol. Phys. 63:1988;547.
8. Petrosyan V.S. J. Organomet. Chem. 250:1983;157.
9. Frisch M.J., Head-Gordon M., Pople J.A. Chem. Phys. Lett. 166:1990;281.
10. Hay P.J., Wadt W.R. J. Chem. Phys. 82:1985;299.
11. Höllwarth A., Böhme M., Dapprich S., Ehlers A.W., Gobbi A., Jonas V., Köhler K.F., Stegmann R., Veldkamp A., Frenking G. Chem. Phys. Lett. 208:1993;237.
12. Krishnan R., Binkley J.S., Seeger R., Pople J.A. J. Chem. Phys. 72:1980;650.
13. Frisch M.J., Pople J.A., Binkley J.S. J. Chem. Phys. 80:1984;3265.
14. McLean A.D., Chandler G.S. J. Chem. Phys. 72:1980;5639.
15. Clark T., Chandrasekhar J., Spitznagel G.W., Schleyer P.v.R. J. Comput. Chem. 4:1983;294.
16. Frisch M.J., Pople J.A., Binkley J.S. Self-consistent molecular orbital methods 25: supplementary functions for Gaussian basis sets. J. Chem. Phys. 80:1984;3265.
17. Breneman C.M., Wilberg K.B. J. Comput. Chem. 11:1990;361.
18. M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, J. Cioslowski, B.B. Stefanov, A. Nanayakkara, M. Challacombe, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzalez, J.A. Pople, GAUSSIAN 94, Revision A.1, Gaussian, Pittsburgh, PA, 1995.
19. Livingston R.L., Rao C.N. J. Chem. Phys. 30:1959;339.
20. K. Nakamoto, Infrared Spectra of Inorganic and Coordination Compounds, 2nd edn., Wiley, New York, 1963.
21. W.H. Press, S.A. Tevkolsky, W.T. Vetterling, B.P. Flannery, Numerical Recipes in FORTRAN, 2nd ed., Univ. of Cambridge, Cambridge, 1992.
22. M.A. França, DATASYS Program, Laboratorio de Química Computacional e Modelagem Molecular, LQC-MM, Univ. Federal de Minas Gerais, Belo Horizonte, 1996.
23. M.P. Allen, D.J. Tildesley, Computer Simulation of Liquids, Oxford Science, Oxford, 1987.
24. Handbook of Chemistry and Physics, 73rd edn., 1992-1993, CRC Press, Boca Raton, FL, 1992.
25. K. Coutinho, S. Canuto, DICE, A General Monte Carlo Program for Liquid Simulations, Univ. São Paulo, São Paulo, 1994.
26. Sjoerdsma J.S., Van Tricht J.B. Chem. Phys. Lett. 117:1985;336.
27. Coutinho K., Canuto S. Adv. Quantum Chem. 28:1997;89.
28. Coutinho K., De Oliveira M.J., Canuto S. Int. J. Quantum Chem. 66:1998;249.
29. W.R. Rocha, K. Coutinho, W.B. De Almeida, S. Canuto, J. Comput. Chem. (submitted).