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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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Localized molecular orbital description of nitrogen lone pairs

D A Kleier1, J H Hall, T A Halgren

  • 1Department of Chemistry, Harvard University, Cambridge Massachusetts 02138.

Proceedings of the National Academy of Sciences of the United States of America
|June 1, 1974
PubMed

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