Calculations of dislocation mobility using Nudged Elastic Band method and first principles DFT calculations

Philosophical Magazine

Volumn 88, Issue 1, 2008, Pages 91-100

  Pizzagalli, L ^a   Beauchamp, P ^a   Jonsson H ^b  

^a UNIVERSITÉ DE POITIERS   (France)

^b UNIVERSITY OF ICELAND   (Iceland)

Author keywords

[No Author keywords available]

Indexed keywords

BOUNDARY CONDITIONS; COMPUTER SIMULATION; PRINCIPAL COMPONENT ANALYSIS; SILICON; STRESS ANALYSIS;

DISLOCATION MOBILITY; PEIERLS ENERGIES;

DENSITY FUNCTIONAL THEORY;

EID: 37049039232     PISSN: 14786435     EISSN: 14786443     Source Type: Journal    
DOI: 10.1080/14786430701767402     Document Type: Article

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