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Updated: Jul 9, 2025

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

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稳定硫位点在四氧化四面体协调结构中,用于高效的电化学氧化水

Jing Jin1, Jie Yin1, Yang Hu1

  • 1State Key Laboratory of Applied Organic Chemistry, College of Chemistry and Chemical Engineering, Frontiers Science Centre for Rare Isotopes, Lanzhou University, Lanzhou, 730000, China.

Angewandte Chemie (International ed. in English)
|December 7, 2023
PubMed
概括

将硫原子封装成氧化 (NiO) 形成了一个独特的S-O4结构,显著提高了氧演化反应 (OER) 电催化剂的性能. 这种四氧四面体结构通过促进晶格氧气交换来增强活动和稳定性.

关键词:
格子-氧气介导机制纳米薄膜的使用方法氧的进化反应反应 氧的进化反应四面体 硫 四面体 硫

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