Mechanical and electronic properties of C60 under structure distortion studied with density functional theory

Computational Materials Science

Volumn 40, Issue 4, 2007, Pages 537-547

  Wang, Z Y ^a   Su, K H ^b   Fan, H Q ^a   Hu, L D ^b   Wang, X ^b   Li, Y L ^b   Wen, Z Y ^c  

^a NORTHWESTERN POLYTECHNICAL UNIVERSITY   (China)

^b NORTHWESTERN POLYTECHNICAL UNIVERSITY   (China)

^c NORTHWEST UNIVERSITY   (China)

Author keywords

C60 fullerene; Density functional theory; Elastic property; Electronic property; Electronic spectrum; Stability; Time dependent

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRON SPECTROSCOPY; ELECTRONIC STATES; POTENTIAL ENERGY SURFACES; STRENGTH OF MATERIALS;

ELASTIC PROPERTY; ELECTRONIC PROPERTY; ELECTRONIC SPECTRUM; POTENTIAL ENERGY CURVES (;

ISOTOPES;

EID: 34548515742     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2007.02.003     Document Type: Article

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