对称性破坏
催化作用
缩放比例
合理设计
化学物理
可扩展性
材料科学
密度泛函理论
纳米技术
对称(几何)
设计要素和原则
反应性(心理学)
产量(工程)
格子(音乐)
电子结构
局部对称性
计算机科学
化学
金属
理论(学习稳定性)
过渡金属
表征(材料科学)
平移对称性
物理
电子组态
调制(音乐)
计算化学
化学稳定性
混合功能
设计策略
电子效应
组合化学
自组装
分类
作者
Bin Wu,Zuohuan Chen,Yifan Ye,Justin Zhu Yeow Seow,Daniel Mandler,Adrian C. Fisher,Dingsheng S. Wang,Shaojun Guo,Zhichuan Jason Xu
摘要
. Our analysis reveals that such symmetry breaking redistributes electron density around the metal center, lifts orbital degeneracy, and optimizes the d-band center, leading to enhanced intermediate adsorption, accelerated reaction kinetics, and broken scaling relationships. Furthermore, these asymmetrically configured SACs exhibit improved stability through strengthened metal-support interactions. While significant progress has been made, we conclude that future efforts must address the challenges of atomic-level precision, stability under operation, and scalable synthesis to fully realize the potential of symmetry-broken SACs across various electrocatalytic applications, thereby establishing a new paradigm for the rational design of advanced electrocatalytic materials.
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