Interactions of Mz-X complexes (M = Cu, Ag, and Au; X = He, Ne, and Ar; And z =±1)

Journal of Chemical Physics

Volumn 134, Issue 2, 2011, Pages

  Tong, Xiao Fei ^a   Yang, Chuan Lu ^a   Wang, Mei Shan ^a   Ma, Xiao Guang ^a   Wang, De Hua ^a  

^a LUDONG UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BASIS SET SUPERPOSITION ERRORS; BOND FUNCTIONS; COUPLED-CLUSTER SINGLES AND DOUBLES; INTERACTION ENERGIES; PERTURBATIVE TREATMENT; POTENTIAL ENERGY CURVES; SPECTROSCOPIC PARAMETERS; TRIPLE EXCITATION; VIBRATIONAL ENERGY LEVELS;

NEON; POTENTIAL ENERGY FUNCTIONS;

COMPLEXATION;

EID: 78751529386     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3526955     Document Type: Article

References (38)

1. S. H. Pullins, C. T. Scurlock, J. E. Reddic, and M. A. Duncan, J. Chem. Phys. 104, 7518 (1996).
2. F. Spiegelman, L. Maron, W. H. Breckenridge, J.-M. Mestdagh, and J.-P. Visticot, J. Chem. Phys. 117, 7534 (2002).
3. E. Qing, L. A. Viehland, E. P. F. Lee, and T. G. Wright, J. Chem. Phys. 124, 044316 (2006).
4. E. P. F. Lee, B. R. Gray, N. A. Joyner, S. H. Johnson, L. A. Viehland, W. H. Breckenridge, and T. G. Wright, Chem. Phys. Lett. 450, 19 (2007).
5. M. F. McGuirk, L. A. Viehland, E. P. F. Lee, W. H. Breckenridge, C. D. Withers, A. M. Gardner, R. J. Plowright, and T. G. Wright, J. Chem. Phys. 130, 194305 (2009).
6. K. Franzreb, R. P. Diez, and J. A. Alonso, J. Chem. Phys. 130, 144312 (2009).
7. A. M. Gardner, C. D. Withers, T. G. Wright, K. I. Kaplan, C. Y. N. Chapman, L. A. Viehland, E. P. F. Lee, and W. H. Breckenridge, J. Chem. Phys. 132, 054302 (2010).
8. D. Tzeli and A. Mavridis, J. Chem. Phys. 132, 194312 (2010).
9. M. A. Duncan, Annu. Rev. Phys. Chem. 48, 69 (1997).
10. N. Brahms, B. Newman, C. Johnson, T. Greytak, D. Kleppner, and J. Doyle, Phys. Rev. Lett. 101, 103002 (2008).
11. D. Patterson, J. Rasmussen, and J. M. Doyle, New J. Phys. 11, 055018 (2009).
12. F. Cargnoni, T. Kus, M. Mella, and R. J. Bartlett, J. Chem. Phys. 129, 204307 (2008).
13. X. F. Tong, C. L. Yang, Y. P. An, M. S. Wang, X. G. Ma, and D. H. Wang, J. Chem. Phys. 131, 244304 (2009).
14. A. M. Gardner, R. J. Plowright, M. J. Watkins, T. G. Wright, and W. H. Breckenridge, J. Chem. Phys. 132, 184301 (2010).
15. R. J. Plowright, A. M. Gardner, C. D. Withers, T. G. Wright, M. D. Morse, and W. H. Breckenridge, J. Phys. Chem. A 114, 3103 (2010).
16. W. S. Hopkins, A. P. Woodham, R. J. Plowright, T. G. Wright, and S. R. Mackenzie, J. Chem. Phys. 132, 214303 (2010).
17. B. L. Hammond, W. A. Lester, Jr., M. Braga, and C. A. Taft, Phys. Rev. B 41, 10447 (1990).
18. H. Partridge, C. W. Bauschlicher, Jr., and S. R. Langhoff, J. Phys. Chem. 96, 5350 (1992).
19. P. Pyykkö, J. Am. Chem. Soc. 117, 2067 (1995).
20. L. R. Brock and M. A. Duncan, J. Chem. Phys. 103, 9200 (1995)
21. A. Freitag, Ch. Van Wüllen, and V. Staemmler, Chem. Phys. 192, 267 (1995)
22. Y. Shen and J. J. BelBruno, J. Phys. Chem. A 109, 10077 (2005)
23. A.Yousef, S. Shrestha, and L. A. Viehland, E. P. F. Lee, B. R. Gray, V. L. Ayles, T. G. Wright, and W. H. Breckenridge, J. Chem. Phys. 127, 154309 (2007)
24. W. H. Breckenridge, V. L. Ayles, and T. G. Wright, J. Phys. Chem. A 112, 4209 (2008)
25. T. G. Wright andW. H. Breckenridge, J. Phys. Chem. A 114, 3182 (2010)
26. K. Raghavachari, G. W. Trucks, J. A. Pople, and M. Head-Gordon, Chem. Phys. Lett. 157, 479 (1989)
27. D. Figgen, G. Rauhut, M. Dolg, and H. Stoll, Chem. Phys. 311, 227 (2005)
28. F. M. Tao, Int. Rev. Phys. Chem. 20, 617 (2001)
29. S. M. Cybulski and R. R. Toczylowski, J. Chem. Phys. 111, 10520 (1999)
30. F. M. Tao and Y. K. Pan, J. Chem. Phys. 97, 4989 (1992)
31. S. F. Boys and F. Bernardi, Mol. Phys. 19, 553 (1970)
32. R. D. Amos, A. Bernhardsson, A. Berning et al., MOLPRO version 2002.6, A Package of ab initio Programs Designed by H.-J. Werner and P. J. Knowles
33. R. J. Le Roy, Chemical Physics Research Report CP-555R, University of Waterloo,1996
34. R. Ahlrichs, H. J. Böhm, S. Brode, K. T. Tang, and J. P. Toennies, J. Chem. Phys. 88, 6290 (1988)
35. D. Bellert and W. H. Breckenridge, Chem. Rev. 102, 1595 (2002)
36. C. L. Yang, Z. H. Zhu, R. Wang, and X. Y. Liu, J. Mol. Struct.: THEOCHEM 548, 47 (2001)
37. See supplementary material at http://dx.doi.org/10.1063/1.3526955 for the potential energies of MZ-X. (M = Cu, Ag, and Au, X = He, Ne, and Ar, and z=±1)
38. G. E. Froudakis, M. Muhlhauser, S. C. Farantos, A. Sfounis, and M. Velegrakis, Chem. Phys. 280, 43 (2002).