Structural and vibrational properties of fullerenes and nanotubes in a nonorthogonal tight-binding scheme

Journal of Chemical Physics

Volumn 104, Issue 15, 1996, Pages 5875-5882

  Menon, Madhu ^a   Richter, Ernst ^a   Subbaswamy, K R ^a  

^a UNIVERSITY OF KENTUCKY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CHEMICAL BONDS; DIFFERENTIATION (CALCULUS); EIGENVALUES AND EIGENFUNCTIONS; ELECTRONIC STRUCTURE; FREQUENCIES; GRAPHITE; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS; OPTIMIZATION; RELAXATION PROCESSES;

BOND LENGTHS; FORCE CONSTANTS; GENERALIZED TIGHT BINDING MOLECULAR DYNAMICS; HAMILTONIAN MATRIX; HELLMANN FEYNMAN THEOREM; NANOTUBES;

FULLERENES;

EID: 0030128996     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471319     Document Type: Article

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