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Orientation of Thiophenol Adsorbed on Silver Determined by Nonlinear Vibrational Spectroscopy of the Carbon Skeleton
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Section:Abstract
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.
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This article has been cited by 6 ACS Journal articles (5 most recent appear below).
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Self-Assembled Film Organization in Fast Microcontact Printing Investigated by Sum Frequency Generation Spectroscopy
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Resonance Raman Scattering of Rhodamine 6G as Calculated by Time-Dependent Density Functional Theory: Vibronic and Solvent Effects
Julien Guthmuller and Benoît ChampagneThe Journal of Physical Chemistry A2008 112 (14), 3215-3223Resonance Raman Scattering of Rhodamine 6G as Calculated by Time-Dependent Density Functional Theory: Vibronic and Solvent Effects
Julien Guthmuller and Benoît ChampagneThe Journal of Physical Chemistry A2008 112 (14), 3215-3223The geometries, UVvis absorption spectra, and resonance Raman (RR) intensities have been determined for the S1 and S3 excited states of rhodamine 6G (R6G) in vacuum and ethanol by means of DFT/TDDFT methodologies with the aim of better understanding the ...
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History
- Published In Issue October 14, 2004
- Received December 1, 2003
Revised July 28, 2004
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