Boron nitride cages from B12N12 to B36 N36: Square-hexagon alternants vs boron nitride tubes

Journal of Molecular Modeling

Volumn 12, Issue 5, 2006, Pages 537-542

  Wu, Hai Shun ^a   Jiao, Haijun ^c   Cui, Xiao Ying ^a   Qin, Xiao Fang ^a   Strout, Douglas L ^b  

^a SHANXI NORMAL UNIVERSITY   (China)

^b ALABAMA STATE UNIVERSITY   (United States)

^c UNIVERSITY OF ROSTOCK   (Germany)

Author keywords

Boron nitrides; DFT; Fullerene; Stability; Structure

Indexed keywords

BORON DERIVATIVE; BORON NITRIDE DERIVATIVE; FULLERENE DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; CALCULATION; CHEMICAL STRUCTURE; CONTROLLED STUDY; CORRELATION COEFFICIENT; DENSITY FUNCTIONAL THEORY; ISOMERISM; MATHEMATICAL MODEL; MOLECULAR STABILITY; PRIORITY JOURNAL; STRUCTURE ANALYSIS;

BORON COMPOUNDS; IMAGING, THREE-DIMENSIONAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION;

EID: 33746397538     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-005-0042-6     Document Type: Article

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