Structural and electronic properties of C60X6 (X = F, Cl, Br and I). A theoretical study

Journal of Computational and Theoretical Nanoscience

Volumn 5, Issue 11, 2008, Pages 2247-2251

  Ibrahim, Medhat ^a   Hameed, Ali Jameel ^c   El Haes, Hanan ^b   Jalbout, Abraham F ^d  

^a NATIONAL RESEARCH CENTRE   (Egypt)

^b Ain Shams University   (Egypt)

^c UNIVERSITY OF BASRAH   (Iraq)

^d UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO   (Mexico)

Author keywords

Charges; Fullerenes; Quantum mechanical calculation; Stability; Substitution

Indexed keywords

ATOMIC PHYSICS; ATOMIC SPECTROSCOPY; ELECTRONIC PROPERTIES; FULLERENES; METHOD OF MOMENTS; MOLECULAR SPECTROSCOPY; SURFACE STRUCTURE; THERMOCHEMISTRY;

ATOMIC CHARGE DISTRIBUTIONS; CHARGES; ELECTROSTATIC POTENTIAL SURFACES; EMPIRICAL METHODS; FINAL HEATS; HALOGEN ATOMS; QUANTUM MECHANICAL CALCULATION; SUBSTITUTION; SUBSTITUTION EFFECTS;

MECHANICAL PROPERTIES;

EID: 57649231751     PISSN: 15461955     EISSN: None     Source Type: Journal    
DOI: 10.1166/jctn.2008.1127     Document Type: Article

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