[en] The orientation of thiophenol adsorbed on silver is determined by comparing ab initio calculated and
experimental sum-frequency generation (SFG) spectra measured between 9 and 20 µm using a tandem KTP/CdSe optical parametric oscillator. The molecule S-C bond is tilted ~37° from the surface normal with the aromatic ring plane perpendicular to the surface.
Disciplines :
Physics
Author, co-author :
Mani, A. A.
Schultz, Z. D.
Caudano, Y.
Champagne, B.
Humbert, C.
Dreesen, Laurent ; Université de Liège - ULiège > Département de physique > Biophotonique
Gewirth, A. A.
White, J. O.
Thiry, P. A.
Peremans, A.
Language :
English
Title :
Orientation of Thiophenol Adsorbed on Silver Determined by Nonlinear Vibrational Spectroscopy of the Carbon Skeleton
Publication date :
2004
Journal title :
Journal of Physical Chemistry B
ISSN :
1520-6106
eISSN :
1520-5207
Publisher :
American Chemical Society, Washington, United States - District of Columbia
Sabatani, E.; Cohen-Boulakia, J.; Bruening, M.; Rubinstein, I. Langmuir 1593, 9, 2974-2981.
Dhirani, A.-A.; Zehner, R. W.; Hsung, R. P.; Guyot-Sionnest, P.; Sita, L. R. J. Am. Chem. Soc. 1996, 118, 3319-3320.
Frey, S.; Stadleer, V.; Heister, K.; Eck, W.; Zharnikov, M.; Grunze, M.; Zeysing, B.; Terfort, A. Langmuir 2001, 17, 2408-2415.
Shen, W.; Nyberg, G. L.; Liesegang, J. Surf. Sci. 1993, 298, 143-160.
Yeganeh, M. S.; Dougal, S. M.; Polizzotti, R. S.; Rabinowitz, P. Phys. Rev. Lett. 1995, 74, 1811-1814.
Wei, X.; Zhuang, X.; Hong, S.-C.; Goto, T.; Shen, Y. R. Phys. Rev. Lett. 1999, 82, 4256-4259.
Tadjeddine, A.; Guyot-Sionnest, P. Electrochim. Acta 1991, 36, 1849-1854.
Peremans, A.; Caudano, Y.; Thiry, P.; Dumas, P.; Zheng, W.; Le Rille, A. ; Tadjeddine, A. Phys. Rev. Lett. 1997, 78, 2999-3002.
Mani, A. A.; Hollander, P.; Thiry, P. A.; Peremans, A. Appl. Phys. Lett. 1999, 75, 3066-3068.
Mani, A. A.; Dreesen, L.; Hollander, P.; Humbert, C.; Caudano, Y.; Thiry, P. A.; Peremans, A. Appl. Phys. Lett. 2001, 79, 1945-1947.
Mani, A. A.; Schultz, Z. D.; Gewirth, A. A.; White, J. O.; Caudano, Y.; Humbert, C.; Dreesen, L.; Thiry, P. A.; Peremans, A. Opt. Lett. 2004, 29, 274-276.
Braun, R.; Casson, B. D.; Bain, C. D.; van der Ham, E. W. M.; Vrehen, Q. H. F.; Eliel, E. R.; Briggs, A. M.; Davies, P. B. J. Chem. Phys. 1999, 110, 4634-4640.
Guyot-Sionnest, P. Nonlinear optical probes of surface dynamics: application to the vibrational dynamics of Si-H for Si(111)/H. In Laser techniques for state-selected and state-to-state chemistry; Cheuk-Yu, N., Ed.; Proc. SPIE: Bellingham, WA, 1993; Vol. 1858.
Becke, A. D. J. Chem. Phys. 1993, 98, 5648-5652.
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.1; Gaussian, Inc.: Pittsburgh, PA, 1998.
Komornicki, A.; Fitzgerald, G. J. J. Chem. Phys. 1993, 98, 1398-1421 and references therein.
Scott, A. P.; Radom, L. J. Chem. Phys. 1996, 100, 16502-16513.
Champagne, B. Chem. Phys. Lett. 1996, 57, 261-265.
Humbert, C.; Buck, M.; Calderone, A.; Vigneron, J.-P.; Meunier, V.; Champagne, B.; Zheng, W.-Q.; Tadjeddine, A.; Thiry, P. A.; Peremans, A. Phys. Status Solidi A 1999, 175, 129-136.
