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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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TCNE-aniline charge transfer complex: ab initio and TDDFT investigations in gas phase

Tapas Manna1, Sumanta Bhattacharya

  • 1Department of Chemistry, The University of Burdwan, Golapbag, Burdwan, 713 104, India.

Journal of Molecular Modeling
|January 28, 2009
PubMed

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