Structural stability of AB y phases in the (La,Mg)-Ni system obtained by density functional theory calculations

Journal of Physical Chemistry C

Volumn 115, Issue 51, 2011, Pages 25470-25478

  Crivello, J C ^a   Zhang, J ^a   Latroche, M ^a  

^a CNRS Université Paris Est Créteil Val de Marne   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CRYSTALLOGRAPHIC PROPERTIES; DENSITY FUNCTIONAL THEORY CALCULATIONS; ELEMENTAL COMPOSITIONS; EQUILIBRIUM STATE; HEATS OF FORMATION; HEXAGONAL SYMMETRY; ORDERED CONFIGURATION; PHASE FORMATIONS; SITE OCCUPATION; STRUCTURAL STABILITIES; SYSTEMATIC STUDY;

DENSITY FUNCTIONAL THEORY; INTERMETALLICS; PHASE DIAGRAMS; PHASE STABILITY; SYSTEM STABILITY; TERNARY SYSTEMS;

LANTHANUM;

EID: 84255214215     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp204835z     Document Type: Article

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