Since the seminal works on the application of density functional theory and the
computational hydrogen electrode to electrochemical CO2 reduction (eCO2R) and …

Combining computational and experimental methods is a powerful approach to understand
the variables that govern catalyst performance and ultimately design improved materials …

Electrochemical hydrogen evolution reaction in neutral media is listed as the most difficult
challenges of energy catalysis due to the sluggish kinetics. Herein, the Ir-HxWO3 catalyst is …

Cobalt-based spinel oxides (ie, Co3O4) are emerging as low-cost and selective
electrocatalysts for the electrochemical nitrate reduction reaction (NO3–RR) to ammonia …

Developing highly efficient and stable noble-metal-free electrocatalysts for water splitting is
critical for producing clean and sustainable energy. Here, we design a hierarchical transition …

Heterogeneous electrocatalysis lies at the center of various technologies that could help
enable a sustainable future. However, its complexity makes it challenging to accurately and …

The dynamic restructuring of Cu surfaces in electroreduction conditions is of fundamental
interest in electrocatalysis. We decode the structural dynamics of a Cu (111) electrode under …

Exploring efficient catalysts for the nitric oxide reduction reaction (NORR) toward NH3
synthesis is becoming increasingly important for tackling both NH3 synthesis and NO …

The synthesis and characterisation of two series of low molar mass mesogens, the (4‐
nitrophenyl) 2‐alkoxy‐4‐(4‐methoxybenzoyl) oxybenzoates (NT3. m) and the (3‐fluoro‐4 …

Electrochemical reduction of biomass-derived feedstocks holds great promise to produce
value-added chemicals or fuels driven by renewable electricity. However, mechanistic …