Computational design of (100) alloy surfaces for the hydrogen evolution reaction
Hao Li, Shaopeng Xu, Min Wang, Ziheng Chen, Fengfeng Ji, Kewei Cheng, Zhengyang Gao, Zhao Ding, Weijie Yang
Abstract
Based on the understandings of alloying effects in bimetallic (100) surfaces, we explored their four-fold active sites for electrocatalytic hydrogen evolution reaction.
Topics & Concepts
Bimetallic stripAlloyHydrogenMaterials scienceChemical engineeringChemistryMetallurgyNanotechnologyEngineeringOrganic chemistryMetalElectrocatalysts for Energy ConversionMachine Learning in Materials ScienceMolecular Junctions and Nanostructures