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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

Published on: January 25, 2020

Ab initio potential energy surface, infrared spectra, and dynamics of the ion-molecule complexes between Br- and H2,

T A Grinev1, A A Buchachenko, J Kłos

  • 1Laboratory of Molecular Structure and Quantum Mechanics, Department of Chemistry, Moscow State University, Moscow 119992, Russia.

The Journal of Chemical Physics
|September 27, 2006
PubMed

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