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Updated: May 7, 2026

Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
08:54

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

第一原理 超冷却水滴における大気関連アニオン溶解の分子動力学シミュレーション

Yu Zhao1, Hui Li, Xiao Cheng Zeng

  • 1Department of Chemistry, University of Nebraska-Lincoln , Lincoln, Nebraska 68588, United States.

Journal of the American Chemical Society
|September 25, 2013
PubMed
まとめ

ブロミドやヨウ素のようなハリドアニオンは水滴の表面を好み,フッ素は水滴の表面を好む. クロライドイオンは好意を示さない,これは超冷却水シミュレーションにおける新しい発見である.

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