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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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Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional

N Sundaraganesan1, C Meganathan, B Dominic Joshua

  • 1Department of Physics (Engg.), Annamalai University, Annamalai Nagar 608002, India. sundaraganesan_n2003@yahoo.co.in

Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|May 2, 2008
PubMed

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