Ab initio investigations of the electronic and magnetic structures of CoH and CoH2
Langue
en
Article de revue
Ce document a été publié dans
Solid State Sciences. 2013, vol. 22, p. 77-81
Elsevier
Résumé en anglais
First principles investigation of the structural, electronic and magnetic properties study of cobalt and the hydrides CoHx (x = 1, 2) show significant volume expansion effect versus Co-H bonding. As hydrogen is incorporated ...Lire la suite >
Mots clés en espagnol
Cobalt hydrides
DFT
GGA
FP-LAPW
EOS
Magnetic properties