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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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The water-oxygen dimer: first-principles calculation of an extrapolated potential energy surface and second virial

Richard J Wheatley1, Allan H Harvey

  • 1School of Chemistry, The University of Nottingham, Nottingham NG7 2RD, United Kingdom. richard.wheatley@nottingham.ac.uk

The Journal of Chemical Physics
|August 28, 2007
PubMed

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