Structure and electronic properties of iron oxide clusters : A first-principles study
ABSTRACT: In this study we present results of electronic structure calculations for some iron oxide clusters of the form FenOm on the basis of the GGA+U approximation. The cluster size ranged between 33 and 113 atoms corresponding to length scales between around 7 Å and 12 Å in diameter, respectivel...
- Autores:
-
López, Sinhué
Romero, Aldo Humberto
Mejía López, José
Mazo Zuluaga, Johan
Restrepo Cárdenas, Johans
- Tipo de recurso:
- Article of investigation
- Fecha de publicación:
- 2009
- Institución:
- Universidad de Antioquia
- Repositorio:
- Repositorio UdeA
- Idioma:
- eng
- OAI Identifier:
- oai:bibliotecadigital.udea.edu.co:10495/8146
- Acceso en línea:
- http://hdl.handle.net/10495/8146
- Palabra clave:
- Propiedades electrónicas
Estructura
Clusters de óxido de hierro
- Rights
- openAccess
- License
- Atribución-NoComercial-SinDerivadas 2.5 Colombia