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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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Unraveling Structure and Spectroscopic Signatures of Pt/γ-Al2O3 via an Artificial Intelligence-Enabled Simulation

Piaoping Yang1, Alfred Worrad2, Dionisios G Vlachos1,2

  • 1Delaware Energy Institute, University of Delaware, 221 Academy St, Newark, Delaware19716, United States.

ACS Applied Materials & Interfaces
|October 28, 2026
PubMed

Keywords:
CO coverageIRPt/γ-Al2O3machine learning force fieldreconstructionxanes

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