Influence of Al substitution on the atomic and electronic structure of Si clusters by density functional theory and molecular dynamics simulations

Physical Review B - Condensed Matter and Materials Physics

Volumn 69, Issue 11, 2004, Pages

  Majumder, Chiranjib ^a   Kulshreshtha, S K ^a  

^a UNIVERSITY OF SYDNEY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM; SILICON;

AB INITIO CALCULATION; ARTICLE; CHEMICAL BOND; DENSITY FUNCTIONAL THEORY; ENERGY TRANSFER; GEOMETRY; IONIZATION; MOLECULAR DYNAMICS; QUANTUM CHEMISTRY;

EID: 2142713132     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.69.115432     Document Type: Article

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