First-principles spin-polarized calculations on the adsorption of ethanethiol molecule upon the nonpolar (10 10) ZnO surface

Article

Abstract: The study of the molecular adsorption of ethanethiol upon the nonpolar (010 ¯ ) ZnO surface has been

Palabras claves:

DFT + U, Dissociative chemisorption, Ethanethiol, Oxygen vacancy, ZnO surface

Autores:

Carini M., Carlos Tapia, Frank Maldonado, Jessica Cuesta, Luis Villamagua, Richard Rivera

Fuentes:

google

scopus