Investigation of changes in crystal and electronic structures by hydrogen within LaNi5 from first-principles

Solid State Sciences

Volumn 11, Issue 6, 2009, Pages 1098-1106

  Al Alam, A F ^a   Matar, S F ^a   Nakhl, M ^b   Ouaini N ^c  

^a UNIVERSITÉ DE BORDEAUX   (France)

^b LEBANESE UNIVERSITY   (Lebanon)

^c HOLY SPIRIT UNIVERSITY OF KASLIK USEK   (Lebanon)

Author keywords

ASW; Bulk modulus; Chemical bonding; DFT; Electronic specific heat coefficient; Haucke phase; Hydride; Magnetic order; VASP

Indexed keywords

BINARY ALLOYS; CHEMICAL BONDS; CRYSTAL STRUCTURE; ELASTIC MODULI; ELECTRONIC STRUCTURE; HYDRIDES; HYDROGEN; SPECIFIC HEAT;

CHEMICAL BONDINGS; ELECTRONIC SPECIFIC HEAT COEFFICIENT; HAUCKE PHASE; MAGNETIC ORDERS; VASP;

LANTHANUM ALLOYS;

EID: 67349101305     PISSN: 12932558     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.solidstatesciences.2009.02.026     Document Type: Article

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