Nitroborazines as potential high energy materials: Density functional theoretical calculations

Journal of Molecular Modeling

Volumn 16, Issue 5, 2010, Pages 857-862

  Janning, Jay D ^a   Ball, David W ^a  

^a CLEVELAND STATE UNIVERSITY   (United States)

Author keywords

Density functional theory calculations; High energy density materials; Nitroborazines

Indexed keywords

BENZENE DERIVATIVE; BORAZINE; BORON; DINITROBORAZINE; FUNCTIONAL GROUP; METHYLTRINITROBORAZINE; NITROBORAZINE; NITROGEN; TRINITROBORAZINE; UNCLASSIFIED DRUG; BORON DERIVATIVE; ISOTOPE;

ARTICLE; CHEMICAL STRUCTURE; COMBUSTION; DENSITY FUNCTIONAL THEORY; ENTHALPY; GEOMETRY; PHYSICAL CHEMISTRY; PRIORITY JOURNAL; THERMODYNAMICS; VIBRATION; CHEMISTRY; MATERIALS; PHYSICAL PHENOMENA;

BORON COMPOUNDS; ISOTOPES; MANUFACTURED MATERIALS; NITROGEN; PHYSICAL PROCESSES; THERMODYNAMICS; VIBRATION;

EID: 77953585433     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-009-0586-y     Document Type: Article

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