Infrared spectra of polycyclic aromatic hydrocarbons: Nitrogen substitution

Chemical Physics

Volumn 234, Issue 1-3, 1998, Pages 87-94

  Bauschlicher Jr , Charles W ^a  

^a NASA AMES RESEARCH CENTER   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0039993670     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0301-0104(98)00139-6     Document Type: Article

References (26)

1. Allamandola L.J., Tielens A.G.G.M., Barker J.R. Astrophys. J. Supp. 71:1989;733.
2. Szczepanski J., Vala M. Nature. 363:1993;699.
3. Leger A., Puget J.L. Astron. Astrophys. 137:1984;L5.
4. Barker J.R., Allamandola L.J., Tielens A.G.G.M. Astrophys. J. 315:1987;L61.
5. Jourdain de Muizon M., d'Hendecourt L.B., Geballe T.R. Astron. Astrophys. 235:1990;367.
6. Bernstein M.P., Sandford S.A., Allamandola L.J. Astrophys. J. 472:1996;L127. and references therein.
7. Langhoff S.R. J. Phys. Chem. 100:1996;2819.
8. Bauschlicher C.W., Langhoff S.R. Spectrochim. Acta A. 53:1997;1225.
9. Langhoff S.R., Bauschlicher C.W., Hudgins D.M., Sandford S.A., Allamandola L.J. J. Phys. Chem. 102:1998;1632.
10. Bauschlicher C.W., Langhoff S.R., Sandford S.A., Hudgins D.M. J. Phys. Chem. 101:1997;2414.
11. Clemett S., Maechling C., Zare R.N., Swan P., Walker R. Science. 262:1993;721.
12. Studier M.H., Hayatsu R., Anders E. Geochim. Cosmochim. Acta. 36:1972;189.
13. Tingle T.N., Becker C.H., Malhotra R. Meteoritics. 26:1991;117.
14. L.J. Kovalenko, C.R. Maechling, S.J. Clemett, J.M. Philippoz, R.N. Zare, C.M.O'D. Alexander, Anal. Chem. 64 (1992) 682.
15. C.W. Bauschlicher, S.R. Langhoff, Mol. Phys., in press.
16. Frisch M.J., Pople J.A., Binkley J.S. J. Chem. Phys. 80:1984;3265. and references therein.
17. Becke A.D. J. Chem. Phys. 98:1993;5648.
18. Stephens P.J., Devlin F.J., Chabalowski C.F., Frisch M.J. J. Phys. Chem. 98:1994;11623.
19. Becke A.D. Phys. Rev. A. 38:1988;3098.
20. J.P. Perdew, Phys. Rev. B 33 (1986) 8822 and 34 (1986) 7406 (E).
21. J.P. Perdew, Phys. Rev. B 33 (1986) 8822 and 34 (1986) 7406 (E).
22. C.W. Bauschlicher, D.M. Hudgins, L.J. Allamandola, unpublished.
23. M. Rosi, C.W. Bauschlicher, G.V. Chertihin, L. Andrews, Theor. Chem. Acc. 99 (1998) 106.
24. GAUSSIAN 94, Revision D.1, 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, Inc., Pittsburgh PA, 1995.
25. D.M. Hudgins, S.A. Sandford, J. Phys. Chem. 102 (1998) 329, 344, 353.
26. M.P. Bernstein, personal communication.