Electronic structure and lattice dynamics of CaPd3B studied by first-principles methods

Physics Letters, Section A: General, Atomic and Solid State Physics

Volumn 356, Issue 3, 2006, Pages 251-254

  Music, Denis ^a   Ahuja, Rajeev ^b   Schneider, Jochen M ^a  

^a RWTH AACHEN UNIVERSITY   (Germany)

^b UPPSALA UNIVERSITY   (Sweden)

Author keywords

Ab initio calculations; CaPd3B; Phonons

Indexed keywords

CALCIUM COMPOUNDS; CALCULATIONS; ELECTRONIC STRUCTURE; LATTICE VIBRATIONS; MAGNESIUM COMPOUNDS; NICKEL COMPOUNDS; PALLADIUM; PALLADIUM COMPOUNDS; PHONONS;

AB INITIO CALCULATIONS; CAPD3B; FIRST PRINCIPLES METHOD; ISOSTRUCTURAL; LOW FREQUENCY ACOUSTIC; PHONON DENSITY OF STATE; PHONON MODE; SECOND-ORDER PHASE TRANSITION;

BORON COMPOUNDS;

EID: 33745430265     PISSN: 03759601     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physleta.2006.03.054     Document Type: Article

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