Kavli Affiliate: Darrell G. Schlom | First 5 Authors: Lei Zhang, Jan Kloppenburg, Chia-Yi Lin, Luka Mitrovic, Simon Gelin | Summary: Understanding the dehydrogenation of transition metal oxide surfaces under electrochemical potential is critical to the control of important chemical processes such as the oxygen evolution reaction (OER). Using first principles computations, we model the […]
Continue.. Atomistic understanding of hydrogen coverage on RuO2(110) surface under electrochemical conditions from ab initio statistical thermodynamics