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Updated: Jun 9, 2026

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

Published on: January 25, 2020

水分子聚合物的电荷转移能量由分子束散射实验,电荷位移分析和ab initio计算揭示出来

Leonardo Belpassi1, Michael L Reca, Francesco Tarantelli

  • 1Dipartimento di Chimica, Università di Perugia, 06123 Perugia, Italy. belp@thch.unipg.it

Journal of the American Chemical Society
|September 1, 2010
PubMed
概括

由于显著的电荷转移 (CT),水相互作用比预期的要强. 这种电荷转移,水作为电子捐赠者或接受者,解释了分子相互作用中观察到的稳定能.

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