Lattice stability prediction of elemental tetrahedrally close-packed structures

Acta Materialia

Volumn 55, Issue 11, 2007, Pages 3707-3718

  Sluiter, M H F ^a  

^a DELFT UNIVERSITY OF TECHNOLOGY   (Netherlands)

Author keywords

Ab initio electron theory; Crystal structure; Properties and Phenomena; Theory and Modeling; Thermodynamics

Indexed keywords

CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ENTHALPY; GROUND STATE; STABILITY; THERMODYNAMICS;

AB INITIO ELECTRON THEORY; CLOSE-PACKED STRUCTURES;

LATTICE CONSTANTS;

EID: 34248524092     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2007.02.016     Document Type: Article

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