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Updated: Jul 2, 2025

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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RT-EOM-CCSD Calculations of Inner and Outer Valence Ionization Energies and Spectral Functions

Fernando D Vila1, John J Rehr1, Karol Kowalski2

  • 1Department of Physics, University of Washington, Seattle, Washington 98195, United States.

Journal of Chemical Theory and Computation
|February 29, 2024
PubMed

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