MD simulation of the interaction of magnesium with graphene

Thin Solid Films

Volumn 518, Issue 2, 2009, Pages 877-879

  Tachikawa, Hiroto ^a   Iyama, Tetsuji ^a   Kawabata, Hiroshi ^a  

^a HOKKAIDO UNIVERSITY   (Japan)

Author keywords

DFT; Diffusion; Direct MD calculation; Graphene; Magnesium

Indexed keywords

DENSITY FUNCTIONAL THEORY METHODS; DFT; DIRECT MD CALCULATION; GRAPHENE; GRAPHENE SHEETS; GRAPHENES; HEXAGONAL SITES; MD SIMULATION; THEORETICAL RESULT;

ATOMS; DENSITY FUNCTIONAL THEORY; DIFFUSION; MAGNESIUM; MOLECULAR DYNAMICS; MOLECULAR ORBITALS; PROBABILITY DENSITY FUNCTION;

GRAPHITE;

EID: 70349873201     PISSN: 00406090     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.tsf.2009.07.108     Document Type: Article

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