MOF,

Kun Xie1, Ye Shen2, Long Lin1,3

  • 1Henan Key Laboratory of Materials on Deep-Earth Engineering, School of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo, Henan 454000, China.

概括

机器学习和DFT相结合,选2D金属有机框架用于氧气电催化. 确定了像Co3 ((HXBHYB) 和Ir3 ((HXBHYB) 这样的有前途的催化剂,用于氧减少 (ORR) 和氧演化 (OER) 反应.