First-principles study of inter-nitrogen interaction energy of Cu(100)-c(2 × 2)N surface

International Journal of Quantum Chemistry

Volumn 91, Issue 2 SPEC, 2003, Pages 211-215

  Yoshimoto, Yoshihide ^a   Tsuneyuki, Shinji ^a  

^a UNIVERSITY OF TOKYO   (Japan)

Author keywords

Copper; Cu(100) c(2 2)N; Interaction energy among nitrogen atoms; Preconditioning of local potential; Self consistent field iteration

Indexed keywords

COPPER; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; REACTION KINETICS; SCANNING TUNNELING MICROSCOPY;

METALLIC SYSTEMS;

NITROGEN;

EID: 0037438876     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10419     Document Type: Conference Paper

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