Structure and energetics of shuttlecock-shaped tin-phthalocyanine on Ag(111): A density functional study employing dispersion correction

Journal of Physical Chemistry C

Volumn 116, Issue 17, 2012, Pages 9487-9497

  Baran, Jakub D ^a,b   Larsson, J Andreas ^a  

^a UNIVERSITY COLLEGE CORK   (Ireland)

^b CHALMERS UNIVERSITY OF TECHNOLOGY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

2-FOLD SYMMETRY; ADSORBED MOLECULES; ADSORPTION ENERGIES; ADSORPTION GEOMETRIES; AG(111) SURFACE; BINDING MECHANISMS; CENTRAL METALS; CHEMICAL BONDINGS; DENSITY FUNCTIONAL THEORIES (DFT); DENSITY-FUNCTIONAL STUDY; DISPERSION CORRECTION; DISPERSION FORCE; ELECTRONIC EFFECTS; EXPERIMENTAL DATA; METALPHTHALOCYANINES; MOLECULAR MEMORIES; REVERSIBLE SWITCHES; SEMI-EMPIRICAL; SINGLE MOLECULE; SINGLE-MOLECULE DEVICES; STRUCTURE AND ENERGETICS; THEORETICAL RESULT; TIN-PHTHALOCYANINE;

CHEMICAL BONDS; CHEMISORPTION; DENSITY FUNCTIONAL THEORY; DISPERSIONS; ELECTRONIC STRUCTURE; GEOMETRY; METALS; MOLECULES; NITROGEN COMPOUNDS; SELF ASSEMBLY; TIN; VAN DER WAALS FORCES;

PHYSISORPTION;

EID: 84860523063     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp210771d     Document Type: Article

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