Theoretical Study on V Atom Supported on N and P-Doped Defective Graphene for Electrocatalytic Nitrogen Reduction

Ammonia (NH 3 ) is one of the most extensively produced chemicals worldwide, and it plays an important and indispensable role in the global economy. At present NH 3 is mainly produced by the traditional Haber-Bosch process operated at high pressure and temperature, which results in massive energy consumption and carbon dioxide emissions. The electrochemical nitrogen reduction reaction (NRR) can allow the production of NH 3 from nitrogen and...