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Updated: May 1, 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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Molecular conformational analysis, vibrational spectra, NBO analysis and first hyperpolarizability of

Y Sheena Mary1, K Raju2, C Yohannan Panicker3

  • 1Department of Physics, Fatima Mata National College, Kollam, Kerala, India; Department of Physics, University College, Trivandrum, Kerala, India.

Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|April 8, 2014
PubMed

Keywords:
CinnamicFT-IRFT-RamanHyperpolarizability

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