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Updated: Apr 19, 2026

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

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Largely reduced grid densities in a vibrational self-consistent field treatment do not significantly impact the

Oliver M D Lutz1, Bernd M Rode2, Günther K Bonn3

  • 1Institute of Analytical Chemistry and Radiochemistry, Center for Chemistry and Biomedicine, University of Innsbruck, Innrain 80-82, Innsbruck 6020, Austria. oliver.lutz@uibk.ac.at.

Molecules (Basel, Switzerland)
|December 20, 2014
PubMed

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