The cis and trans structures of the NO dimer cation

Chemical Physics Letters

Volumn 301, Issue 5-6, 1999, Pages 467-473

  Lee, Edmond P F ^a,b   Wright, Timothy G ^a  

^a UNIVERSITY OF SOUTHAMPTON   (United Kingdom)

^b HONG KONG POLYTECHNIC UNIVERSITY   (Hong Kong)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0011779377     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(99)00069-X     Document Type: Article

References (21)

1. East A.L.L. J. Chem. Phys. 109:1998;2185.
2. Duarte H., Proynov E., Salahub D.R. J. Chem. Phys. 109:1998;26.
3. East A.L.L., McKellar A.R.W., Watson J.K.G. J. Chem. Phys. 109:1998;4378.
4. Andrews L., Zhou M., Willson S.P., Kushto G.P., Snis A., Panas I. J. Chem. Phys. 109:1998;177.
5. Strobel A., Knoblauch N., Agreiter J., Smith A.M., Niedner-Schatteburg G., Bondybey V.E. J. Phys. Chem. 99:1995;872.
6. Ng C.Y., Tiedmann P.W., Mhan B.H., Lee Y.T. J. Chem. Phys. 66:1977;3985.
7. Linn S.H., Ono Y., Ng C.Y. J. Chem. Phys. 74:1981;3342.
8. Carnovale F., Peel J.B., Rothwell R.G. J. Chem. Phys. 84:1986;6526.
9. Fischer I., Strobel A., Staecker J., Niedner-Schatteburg G., Müller-Dethlefs K., Bondybey V.E. J. Chem. Phys. 96:1992;7171.
10. Jacox M.E., Thompson W.E. J. Chem. Phys. 93:1990;7609.
11. Kukolich S.G. J. Am. Chem. Soc. 104:1982;4715.
12. McKellar A.R.W., Watson J.K.G., Howard B.J. Mol. Phys. 86:1995;273.
13. Brown R.D., Boggs J.E., Hilderbrandt R., Lim K., Mills I.M., Nikitin E., Palmer M.H. Pure Appl. Chem. 68:1996;387.
14. GAUSSIAN94 (Revision E.1), M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheesemans, T.W. 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, Pittsburgh PA, 1995.
15. MOLPRO is a package of ab initio programs written by H.-J. Werner, P.J. Knowles, with contributions from J. Almlöf, R.D. Amos, A. Berning, M.J.O. Deegan, F. Eckert, S.T. Elbert, C. Hampel, R. Lindh, W. Meyer, A. Nicklass, K. Peterson, R. Pitzer, A.J. Stone, P.R. Taylor, M.E. Mura, P. Pulay, M. Schuetz, H. Stoll, T. Thorsteinsson, D.L. Cooper. With the RCCSD treatment being described in: C. Hampel, K. Peterson, H.J. Werner, Chem. Phys. Lett. 190 (1992) 1.
16. M.F. Guest, J. Kendrick, GAMESS User Manual, SERC Daresbury Laboratory, CCP1/86/1, UK. Note that for these calculations only, the 6 Cartesian d functions, and 10 f functions were used, rather than the spherical harmonics.
17. Allen W.D., Horner D.A., DeKock R.L., Remington R.B., Schaefer H.F. III Chem. Phys. 133:1989;11.
18. Heard G.L., Marsden C.J., Scuseria G.E. J. Phys. Chem. 96:1992;4359.
19. Lee T.J., Rendell A.P., Taylor P.R. J. Phys. Chem. 94:1990;5463.
20. Nobes R.H., Moncrieff D., Wong M.W., Radom L., Gill P.M.W., Pople J.A. Chem. Phys. Lett. 182:1991;216.
21. Lee E.P.F., Wright T.G. J. Phys. Chem. A. 102:1998;4007.