拉曼光谱
溶剂化壳
谱线
水溶液
分子
化学
热力学
物理化学
溶剂化
物理
光学
有机化学
天文
作者
Zhiqiang Wang,Siwen Ju,Yuxi Wang,Ruiting Zhang,Lin Ma,Jiangluqi Song,Ke Lin
标识
DOI:10.1016/j.saa.2024.124413
摘要
Isosbestic point is often observed in a series of spectra, but their interpretation is still controversial, such as whether the continuum model can produce an isosbestic point. In order to answer this question, the Raman spectra of hydration shell with continuous distribution structure in different ionic aqueous solutions were separated by Raman ratio spectra, and an isosbestic point was successfully observed. Our experimental results show that the continuum model can indeed produce the isosbestic point. In order to deepen the understanding of the isosbestic point, we calculate the first moment of the Raman spectra and conduct molecular dynamics (MD) simulations. Both experimental and theoretical findings indicate that elevated temperatures lead to increased disorder among water molecules within the hydration shell.
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