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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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A five-dimensional potential energy surface and predicted infrared spectra for the N2O-hydrogen complexes

Yanzi Zhou1, Hong Ran, Daiqian Xie

  • 1Institute of Theoretical and Computational Chemistry, Laboratory of Mesoscopic Chemistry, School of Chemistry and Chemical Engineering, Nanjing University, Nanjing 210093, China.

The Journal of Chemical Physics
|November 15, 2006
PubMed

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