The role of sub-surface hydrogen on CO<sub>2</sub> reduction and dynamics on Ni(110): An ab initio molecular dynamics study.

The role of sub-surface hydrogen on CO₂ reduction and dynamics on Ni(110): An ab initio molecular dynamics study.

Allec, Sarah I; Nguyen, Manh-Thuong; Rousseau, Roger; Glezakou, Vassiliki-Alexandra.

Afiliação

Allec SI; Physical Sciences Division, Pacific Northwest National Laboratory, Richland, Washington 99352, USA.
Nguyen MT; Physical Sciences Division, Pacific Northwest National Laboratory, Richland, Washington 99352, USA.
Rousseau R; Physical Sciences Division, Pacific Northwest National Laboratory, Richland, Washington 99352, USA.
Glezakou VA; Physical Sciences Division, Pacific Northwest National Laboratory, Richland, Washington 99352, USA.

J Chem Phys ; 155(4): 044702, 2021 Jul 28.

Article em En | MEDLINE | ID: mdl-34340378

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2021 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2021 Tipo de documento: Article