INVESTIGADORES
JUAN Alfredo
artículos
Título:
The hydrogen interaction in an FCC FePd alloy with a vacancy
Autor/es:
JASEN P, GONZALEZ E, ARDENGHI S. A. JUAN
Revista:
PHYSICA SCRIPTA - (Print)
Editorial:
IOP PUBLISHING LTD
Referencias:
Lugar: Londres; Año: 2009 vol. 79 p. 45702 - 45708
ISSN:
0031-8949
Resumen:
The absorption of hydrogen in the ordered face-centered cubic FePd alloy is investigated using a density functional calculation method. Changes in the electronic structure and bonding after introducing an Fe or Pd vacancy are analysed. H locates close to a tetrahedral site and the Hmetal bond is achieved at the expense of the interfacial FePd bond.
