Band gap engineering in armchair-edged graphene nanoribbons by edge dihydrogenation

Computational Materials Science

Volumn 62, Issue , 2012, Pages 93-98

  Zheng, X H ^a   Huang, L F ^a   Wang, X L ^a   Lan, J ^a   Zeng, Z ^a  

^a INSTITUTE OF SOLID STATE PHYSICS   (China)

Author keywords

Band gap; Density functional theory; Dihydrogenation; Formation energy; Graphene nanoribbons

Indexed keywords

BAND GAP ENGINEERING; DIFFERENT EFFECTS; DIHYDROGENATION; FIRST-PRINCIPLES STUDY; FORMATION ENERGIES; GRAPHENE NANORIBBONS; RELATIVE STABILITIES;

DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; GRAPHENE; HYDROGENATION; NANOSTRUCTURES;

ENERGY GAP;

EID: 84861807303     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2012.05.022     Document Type: Article

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