Computer simulations of the effect of atomic structure and coordination on the stabilities and melting behaviour of copper surfaces and nano-particles

Surface Science

Volumn 603, Issue 3, 2009, Pages 445-454

  Daff, Thomas D ^a,b   Saadoune, Iman ^b   Lisiecki, Isabelle ^c   de Leeuw, Nora H ^b  

^a UNIVERSITY OF LONDON   (United Kingdom)

^b UNIVERSITY COLLEGE LONDON   (United Kingdom)

^c UMR 8233 CNRS Université Pierre et Marie Curie   (France)

Author keywords

Computer simulations; Copper; Molecular dynamics; Nano particles; Surface defects; Surface melting; Surface structure, morphology, roughness, and topography

Indexed keywords

ATOMIC PHYSICS; COMPUTATIONAL METHODS; COMPUTER SIMULATION; COPPER; DEFECTS; DYNAMICS; ENGINEERING GEOLOGY; MELTING; MELTING POINT; METAL MELTING; MOLECULAR DYNAMICS; NANOPARTICLES; SURFACE CHEMISTRY; SURFACE DEFECTS; SURFACE MORPHOLOGY; SURFACE STRUCTURE; SURFACE TENSION; SURFACE TOPOGRAPHY;

BULK MELTING; COMPUTER SIMULATIONS; COPPER NANO-PARTICLES; COPPER SURFACES; INTER ATOMIC POTENTIAL; LOW ENERGIES; MODERATE TEMPERATURES; MOLECULAR-DYNAMICS (MD) SIMULATIONS; STEP EDGES; SURFACE ENERGIES; SURFACE MELTING; SURFACE STRUCTURE, MORPHOLOGY, ROUGHNESS, AND TOPOGRAPHY;

SURFACE PROPERTIES;

EID: 58749096325     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2008.11.031     Document Type: Article

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