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Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
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Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid

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Potential scans and potential energy distributions of normal vibrational modes of trichloroacetyl isocyanate

Hassan M Badawi1, Wolfgang Förner, Basel F Abu-Sharkh

  • 1Department of Chemistry, King Fahd University of Petroleum and Minerals, Dhahran 31261, Saudi-Arabia. hbadawi@kfupm.edu.sa

Journal of Molecular Modeling
|May 29, 2002
PubMed

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