Effects of the higher electron correlation correction on the calculated intermolecular interaction energies of benzene and naphthalene dimers: Comparison between MP2 and CCSD(T) calculations

Chemical Physics Letters

Volumn 319, Issue 5-6, 2000, Pages 547-554

  Tsuzuki, Seiji ^a   Uchimaru, Tadafumi ^a   Matsumura, Kazunari ^a   Mikami, Masuhiro ^a   Tanabe, Kazutoshi ^a  

^a NATL INST OF MAT AND CHEM RES   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000712654     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)00170-6     Document Type: Article

References (31)

1. Cox J.D., Andon R.J.L. J. Chem. Soc., Faraday Trans. 2. 54:1958;1622.
2. Williams D.E. J. Chem. Phys. 45:1966;3770.
3. Evans D.J., Watts R.O. Mol. Phys. 29:1975;777.
4. Krause K., Emstberger B., Neusser H.J. Chem. Phys. Lett. 184:1991;411.
5. Karlstrom G., Linse P., Wallqvist A., Jonsson B. J. Am. Chem. Soc. 105:1983;3777.
6. Tsuzuki S., Uchimaru T., Tanabe K. J. Mol. Struct. (Theochem). 307:1994;107.
7. Hobza P., Selzle H.L., Schlag E.W. J. Am. Chem. Soc. 116:1994;3500.
8. Tsuzuki S., Uchimaru T., Mikami M., Tanabe K. Chem. Phys. Lett. 252:1996;206.
9. Jaffe R.L., Smith G.D. J. Chem. Phys. 105:1996;2780.
10. Hobza P., Selzle H.L., Schlag E.W. J. Phys. Chem. 100:1996;18790.
11. Hunter C.A., Sanders J.K.M. J. Am. Chem. Soc. 112:1990;5525.
12. Jorgensen W.L., Severance D.L. J. Am. Chem. Soc. 112:1990;4768.
13. Allinger N.L., Lii J.-H. J. Comput. Chem. 8:1987;1146.
14. Williams D.E. Acta Crystallogr. 36:1980;715.
15. A.J. Stone, The Theory of Intermolecular Forces, Clarendon, Oxford, 1996.
16. Sponer J., Hobza P. Chem. Phys. Lett. 267:1997;263.
17. Woon D.E., Dunning T.H. Jr. J. Chem. Phys. 98:1993;1358.
18. Tsuzuki S., Uchimaru T., Mikami M., Tanabe K. J. Phys. Chem. 102:1998;2091.
19. McCarthy W., Plokhotnichenko A.M., Radchenko E.D., Smets J., Smith D.M.A., Stepanian S.G., Adamovicz L. J. Phys. Chem. A. 101:1997;7208.
20. Brameld K., Dasgupta S., Goddard W.A. III J. Phys. Chem. B. 101:1997;4851.
21. M.J. Frisch et al., GAUSSIAN 94, Gaussian, Inc., Pittsburgh, PA, 1994.
22. Møller C., Plesset M.S. Phys. Rev. 46:1934;618.
23. Krishnan R., Pople J.A. Int. J. Quantum Chem. 14:1978;91.
24. Pople J.A., Head-Gordon M., Raghavachari K. J. Chem. Phys. 87:1987;5968.
25. Ransil B.J. J. Chem. Phys. 34:1961;2109.
26. Boys S.F., Bernardi F. Mol. Phys. 19:1970;553.
27. R.D. Amos, CADPAC: The Cambridge Analytical Derivatives Package, Issue 6, Tech. Rep., Univ. of Cambridge, Cambridge, 1995, A suite of quantum chemistry programs developed by R.D. Amos with contributions from I.L. Alberts et al.
28. A.J. Stone, A. Dullweber, M.P. Hodges, P.L.A. Popelier, D.J. Wales, ORIENT: A Program for Studying Interactions Between Molecules Version 3.2., Univ. of Cambridge, Cambridge, 1995.
29. Tsuzuki S., Uchimaru T., Tanabe K. Chem. Phys. Lett. 287:1998;202.
30. Stanton J.F., Bartlett R.J. J. Chem. Phys. 99:1993;5178.
31. Feller D. J. Chem. Phys. 96:1992;6104.