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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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Analytical Morse/long-range model potential and predicted infrared and microwave spectra for a symmetric top-atom

Yong-Tao Ma1, Tao Zeng2, Hui Li1

  • 1Institute of Theoretical Chemistry, State Key Laboratory of Theoretical and Computational Chemistry, Jilin University, 2519 Jiefang Road, Changchun 130023, People's Republic of China.

The Journal of Chemical Physics
|June 9, 2014
PubMed

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