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Updated: Jan 18, 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

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视角:基于轨迹的激发状态动态的振动式合潜力

Sandra Gómez1, Patricia Vindel-Zandbergen2,3, Dilara Farkhutdinova4,5

  • 1Departamento de Química, Módulo 13, Universidad Autónoma de Madrid, Cantoblanco, Madrid 28049, Spain.

Journal of chemical theory and computation
|September 11, 2025
PubMed
概括

振动合 (VC) 潜能简化了兴奋状态动态模拟,使光物理过程的有效研究成为可能. 这些模型为复杂系统中的能量转移和放松通路提供了宝贵的见解.

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