| Literature DB >> 34350689 |
Hao Wan1, Alexander Bagger2, Jan Rossmeisl3.
Abstract
Electrocatalytic denitrification is a promising technology for removing NOx species (NO3 - , NO2 - and NO). For NOx electroreduction (NOxRR), there is a desire for understanding the catalytic parameters that control the product distribution. Here, we elucidate selectivity and activity of catalyst for NOxRR. At low potential we classify metals by the binding of NO versus H. Analogous to classifying CO2 reduction by CO vs H, Cu is able to bind NO while not binding H giving rise to a selective NH3 formation. Besides being selective, Cu is active for the reaction found by an activity-volcano. For metals that does not bind NO the reaction stops at NO, similar to CO2-to-CO. At potential above 0.3 V vs RHE, we speculate a low barrier for N coupling with NO causing N2O formation. The work provide a clear strategy for selectivity and aims to inspire future research on NOxRR.Entities:
Keywords: NOx Removal, Ammonia Synthesis, Metal Surfaces, DFT, Electrocatalysis
Year: 2021 PMID: 34350689 DOI: 10.1002/anie.202108575
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336