INVESTIGADORES
JASEN Paula Veronica
artículos
Título:
THE HYDROGEN INTERACTION IN A FCC FePd ALLOY WITH A VACANCY
Autor/es:
S. ARDENGHI; E. GONZÁLEZ; P. JASEN; A. JUAN
Revista:
PHYSICA SCRIPTA
Editorial:
IOP PUBLISHING
Referencias:
Año: 2009 vol. 79 p. 1 - 5
ISSN:
0281-1847
Resumen:
The absorption of hydrogen in the ordered FCC FePd alloy is investigated using a density functional calculation method.  The changes in the electronic structure and bonding after introducing a Fe or Pd vacancy are analyzed.  H locates close to a tetrahedral site and the H-metal bond is achieved at the expense of the interfacial Fe-Pd bond.