封面图:使用QuantEXAFS定量非均匀催化剂的位点异质性(化学)。方法1/2025)

IF 3.7 Q1 CHEMISTRY, MULTIDISCIPLINARY Chemistry methods : new approaches to solving problems in chemistry Pub Date : 2025-01-10 DOI:10.1002/cmtd.202580101
Rachita Rana, Jiyun Hong, Adam S. Hoffman, Baraa Werghi, Simon R. Bare, Ambarish R. Kulkarni
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引用次数: 0

摘要

封面说明了使用x射线吸收光谱(XAS)对含有单原子和纳米颗粒的负载金属催化剂的研究。MS-QuantEXAFS方法将密度泛函理论与XAS分析相结合,可以对这两个物种进行定量分析。有关详细信息,请参阅Rachita Rana, Simon R. Bare, Ambarish R. Kulkarni及其同事的研究文章(DOI: 10.1002/cmtd.202400020)。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

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Cover Picture: Quantifying the Site Heterogeneities of Non-Uniform Catalysts Using QuantEXAFS (Chem. Methods 1/2025)

The Front Cover illustrates the investigation of a supported metal catalyst containing both single atoms and nanoparticles using X-ray absorption spectroscopy (XAS). The MS-QuantEXAFS method, integrating density functional theory with XAS analysis, enables quantification of the two species. For more details, see the Research Article by Rachita Rana, Simon R. Bare, Ambarish R. Kulkarni, and co-workers (DOI: 10.1002/cmtd.202400020).

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