An ab initio study of 3-aminopropyltrimethoxysilane molecule on Si(1 1 1)-(sqrt(3) × sqrt(3)) surface

Surface Science

Volumn 601, Issue 18, 2007, Pages 3740-3744

  Demirel, G ^a   Birlik, G ^a   Cakmak M ^a   Caykara T ^a   Ellialtioǧlu, Ş ^b  

^a GAZI UNIVERSITY   (Turkey)

^b MIDDLE EAST TECHNICAL UNIVERSITY   (Turkey)

Author keywords

Density functional theory; Self assembled monolayer; Si(1 1 1) surface

Indexed keywords

ATOMS; BINDING ENERGY; CHEMISORPTION; DENSITY FUNCTIONAL THEORY; GEOMETRY; GRADIENT METHODS; HYDROGEN; MOLECULES; OXYGEN; RELAXATION PROCESSES;

AMINOPROPYLTRIMETHOXYSILANE (APTS); HYDROXYL GROUPS; MOLECULAR GEOMETRY; SELF-ASSEMBLED MONOLAYER; SILICON ATOM;

SILANES;

EID: 34548603281     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2007.04.045     Document Type: Article

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