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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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Enhanced Aerogen-π Interaction by a Cation-π Force

Junjian Miao1, Bo Song1, Yi Gao2

  • 1Division of Interfacial Water and Key Laboratory of Interfacial Physics and Technology, Shanghai Institute of Applied Physics, Chinese Academy of Sciences, Shanghai, 201800, P.R. China.

Chemistry (Weinheim an Der Bergstrasse, Germany)
|December 25, 2015
PubMed

Keywords:
density functional calculationsenergy decomposition analysisnoble gasesnoncovalent interactionspi interactionssupramolecular chemistry

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