The electrocatalytic oxygen evolution reaction (OER) supplies the protons and electrons
needed to transform renewable electricity into chemicals and fuels. However, the OER is …

Hydrogen peroxide (H2O2) is a highly desired chemical with a wide range of applications.
Recent advancements in H2O2 synthesis center on the electrochemical reduction of oxygen …

To move from fossil-based energy resources to a society based on renewables, electrode
materials free of precious noble metals are required to efficiently catalyze electrochemical …

Co-electrolysis of carbon oxides and nitrogen oxides promise to simultaneously help restore
the balance of the C and N cycles while producing valuable chemicals such as urea …

Currently, computational models based on density functional theory (DFT) are intensively
used for the analysis of electrocatalytic reactions and the design of enhanced catalysts. As …

Macroscopic properties of materials stem from fundamental atomic-scale details, yet for
insulators, resolving surface structures remains a challenge. We imaged the basal (0001) …

As much of the theory related to computational electrocatalysis has been adapted from the
thermodynamics of gas-phase reactions, it demands careful treatment and the …

Enthalpies of formation of adsorbates are crucial parameters in the microkinetic modeling of
heterogeneously catalyzed reactions since they quantify the stability of intermediates on the …

Electrocatalysis holds the key to the decentralized production of hydrogen peroxide via the
two‐electron oxygen reduction reaction (ORR, O2 (g)+ 2H++ 2e−‐> H2O2 (aq)). However …

Metal–nitrogen–carbon (M–N–C) motifs present intriguing structural and electronic
properties for a number of applications, including as oxygen reduction catalysts. However …