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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
08:54

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

Published on: January 25, 2020

Spectroscopic properties of MgH2, MgD2, and MgHD calculated from a new ab initio potential energy surface

Hui Li1, Robert J Le Roy

  • 1Guelph-Waterloo Centre for Graduate Work in Chemistry and Biochemistry, University of Waterloo, Waterloo, Ontario N2L 3G1, Canada. huili@uwaterloo.ca

The Journal of Physical Chemistry. A
|June 22, 2007
PubMed

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