Optimal pre-sulfidation of the β-Mo<inf>2</inf>C surface (001) in the chlorobencene hydrodechlorination: An electrostatic potential study

Article

Abstract: A DFT study of the presulfidation conditions of the (001) Mo2C surface was performed in this work. F

Palabras claves:

chlorobencene, DFT, Electrostatic potential, HDC, Molybdenum carbide, presulfidation

Autores:

Añez R., Bastardo A., David Santiago Coll, Rodríguez J.A., Velásquez M.

Fuentes:

scopus