过电位
异质结
密度泛函理论
材料科学
电催化剂
吉布斯自由能
吸附
纳米材料
氢
兴奋剂
化学物理
物理化学
纳米技术
计算化学
化学
光电子学
热力学
电极
电化学
有机化学
物理
作者
Bo Gao,Qiuping Cheng,Xiaoye Du,Shujiang Ding,Chunhui Xiao,Jin Wang,Zhongxiao Song,Ho Won Jang
标识
DOI:10.1002/smtd.202301542
摘要
Developing Two-dimensional (2D) Mo-based heterogeneous nanomaterials is of great significance for energy conversion, especially in alkaline hydrogen evolution reaction (HER), however, it remains a challenge to identify the active sites at the interface due to the structure complexity. Herein, the real active sites are systematically explored during the HER process in varied Mo-based 2D materials by theoretical computational and magnetron sputtering approaches first to filtrate the candidates, then successfully combined the MoSi
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