Nitrogen adsorption and thin surface nitrides on Cu(1 1 1) from first-principles

Surface Science

Volumn 601, Issue 21, 2007, Pages 4775-4785

  Soon, Aloysius ^a   Wong, Lindee ^a   Lee, Michael ^a   Todorova, Mira ^a   Delley, Bernard ^b   Stampfl, Catherine ^a  

^a UNIVERSITY OF SYDNEY   (Australia)

^b PAUL SCHERRER INSTITUTE   (Switzerland)

Author keywords

Copper; Density functional calculations; Morphology; Nitridation; Nitrogen; Surface nitrides; Surface structure; Surface thermodynamics

Indexed keywords

ADSORPTION; CHEMISORPTION; CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; NITRIDATION; RELAXATION PROCESSES;

RECONSTRUCTED SURFACE; SURFACE NITRIDES; SURFACE THERMODYNAMICS;

NITROGEN;

EID: 35448988539     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2007.07.011     Document Type: Article

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