Selective CO2 reduction on topological Chern magnet TbMn6Sn6†
Abstract
As a new type of topological magnet, TbMn6Sn6 has a planar Mn kagome lattice with out-of-plane magnetic moments. Previous studies have found spin-polarized Chern gapped Dirac fermions in TbMn6Sn6, which are advantageous to topological catalysis. In this study, we theoretically demonstrate that the TbMn6Sn6 (001) surface is favorable for CO2 reduction. The stability of different surface types is investigated, and then the reaction paths of CO2 reduction on the surfaces are revealed to prove that the product is selective. This work reveals the effect of magnetic topological materials on CO2 reduction.