First-principles study on the crystal, electronic structure and stability of LaNi5-xAlx (x = 0, 0.25, 0.5, 0.75 and 1)

Acta Materialia

Volumn 53, Issue 12, 2005, Pages 3445-3452

  Zhang, R J ^a   Wang, Y M ^a   Lu, M Q ^a   Xu, D S ^a   Yang, K ^a  

^a INSTITUTE OF METAL RESEARCH   (China)

Author keywords

Cohesive energy; Electronic structure; Formation energy; Plane wave pseudo potential

Indexed keywords

APPROXIMATION THEORY; CRYSTAL STRUCTURE; ELECTRIC DISCHARGES; ELECTRODES; ELECTRONIC STRUCTURE; NEUTRON SCATTERING;

COHESIVE ENERGY; FORMATION ENERGY; PLANE-WAVE PSEUDO-POTENTIAL; RARE ALLOYS;

LANTHANUM COMPOUNDS;

EID: 19844363801     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2005.04.005     Document Type: Article

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