Multiscale simulations in simple metals: A density-functional-based methodology

Physical Review B - Condensed Matter and Materials Physics

Volumn 71, Issue 9, 2005, Pages

  Choly, Nicholas ^a   Lu, Gang ^a,c   Weinan, E ^b   Kaxiras, Efthimios ^a  

^a HARVARD UNIVERSITY   (United States)

^b PRINCETON UNIVERSITY   (United States)

^c CALIFORNIA STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM;

AB INITIO CALCULATION; ARTICLE; DENSITY FUNCTIONAL THEORY; QUANTUM THEORY; SIMULATION;

EID: 20344388522     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.71.094101     Document Type: Article

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