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Updated: Feb 23, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
10:52

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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メタンのC-H結合活性化のための二重単原子の場所での電荷極化領域の形成

Datong Chen1, Jingyi Zhou1, Wenyuan Lyu1

  • 1School of Chemistry and Chemical Engineering, South China University of Technology, Guangzhou, China.

Nature communications
|February 21, 2026
PubMed
まとめ

研究者らは,室温でメタンを直接変換するための新しい二重原子Fe-Pd触媒を開発しました. この触媒はメタンを効率的に活性化する.

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Synthesis and Performance Characterizations of Transition Metal Single Atom Catalyst for Electrochemical CO2 Reduction

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