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Updated: Jul 6, 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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可溶性Gd6Cu24集群:用于氧化水的有效分子电催化剂

Jia-Nan Chen1, Zhong-Hua Pan1, Qi-Hao Qiu1

  • 1Collaborative Innovation Center of Chemistry for Energy Materials, State Key Laboratory of Physical Chemistry of Solid Surface, Department of Chemistry, College of Chemistry and Chemical Engineering, Xiamen University Xiamen 361005 China xjkong@xmu.edu.cn.

Chemical science
|January 5, 2024
PubMed
概括

研究人员开发了新的异金属集群,用于高效的氧化水催化,这对于生产至关重要. 这些催化剂表现出高周转频率,推进了水分裂技术.

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相关概念视频

Formation of Complex Ions03:45

Formation of Complex Ions

A type of Lewis acid-base chemistry involves the formation of a complex ion (or a coordination complex) comprising a central atom, typically a transition metal cation, surrounded by ions or molecules called ligands. These ligands can be neutral molecules like H2O or NH3, or ions such as CN− or OH−. Often, the ligands act as Lewis bases, donating a pair of electrons to the central atom. These types of Lewis acid-base reactions are examples of a broad subdiscipline called coordination...
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