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Updated: Jun 25, 2025

In situ FTIR Spectroscopy as a Tool for Investigation of Gas/Solid Interaction: Water-Enhanced CO2 Adsorption in UiO-66 Metal-Organic Framework
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关于二氧化碳稀气复合体振动结构的理论见解

Larry Rodriguez1, Michael Natalizio1, Olaseni Sode1

  • 1Department of Chemistry and Biochemistry, California State University, Los Angeles, 5151 State University Drive, Los Angeles, California 90032, United States.

The journal of physical chemistry. A
|May 21, 2024
PubMed
概括

对于Ne-CO2和Kr-CO2复合体的新潜在能量表面 (PES) 可以准确预测振动谱. 计算证实了曲模式分裂,这种分裂随着稀有气体原子的极化性增加而增加.

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