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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

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Modeling nuclear resonance vibrational spectroscopic data of binuclear non-heme iron enzymes using density functional

Kiyoung Park1, Edward I Solomon1

  • 1Department of Chemistry, Stanford University, 333 Campus Drive, Stanford, CA 94305, USA.

Canadian Journal of Chemistry
|September 26, 2017
PubMed

Keywords:
and density functional theorybinuclear non-heme iron enzymesnuclear resonance vibrational spectroscopy

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