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Updated: Apr 28, 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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Vibrational spectra (FT-IR and FT-Raman), molecular structure, natural bond orbital, and TD-DFT analysis of

S Sylvestre1, S Sebastian2, S Edwin1

  • 1Department of Chemistry, DMI-St. Eugene University, Chipata 511026, Zambia.

Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|June 20, 2014
PubMed

Keywords:
NBONLOTD-DFTTEDVibrational spectral-Asparagine

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