Improved transition metal surface energies from a generalized gradient approximation developed for quasi two-dimensional systems.

Patra, Abhilash; Jana, Subrata; Constantin, Lucian A; Chiodo, Letizia; Samal, Prasanjit.

Afiliação

Patra A; School of Physical Sciences, National Institute of Science Education and Research, HBNI, Bhubaneswar 752050, India.
Jana S; School of Physical Sciences, National Institute of Science Education and Research, HBNI, Bhubaneswar 752050, India.
Constantin LA; Center for Biomolecular Nanotechnologies@UNILE, Istituto Italiano di Tecnologia, Via Barsanti, I-73010 Arnesano, Italy.
Chiodo L; Department of Engineering, Campus Bio-Medico University of Rome, Via Á del Portillo 21, 00128 Rome, Italy.
Samal P; School of Physical Sciences, National Institute of Science Education and Research, HBNI, Bhubaneswar 752050, India.

J Chem Phys ; 152(15): 151101, 2020 Apr 21.

Article em En | MEDLINE | ID: mdl-32321265

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2020 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2020 Tipo de documento: Article