A molecular dynamics study of 1,1-diamino-2,2-dinitroethylene (FOX-7) crystal using a symmetry adapted perturbation theory-based intermolecular force field

Physical Chemistry Chemical Physics

Volumn 13, Issue 37, 2011, Pages 16629-16636

  Taylor, Decarlos E ^a   Rob, Fazle ^b   Rice, Betsy M ^a   Podeszwa, Rafal ^c   Szalewicz, Krzysztof ^b  

^a U S ARMY RESEARCH LABORATORY   (United States)

^b UNIVERSITY OF DELAWARE   (United States)

^c UNIVERSITY OF SILESIA   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

1,1 DIAMINO 2,2 DINITROETHYLENE; 1,1-DIAMINO-2,2-DINITROETHYLENE; ETHYLENE DERIVATIVE; NITRO DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; QUANTUM THEORY; X RAY CRYSTALLOGRAPHY;

CRYSTALLOGRAPHY, X-RAY; ETHYLENES; MODELS, MOLECULAR; NITRO COMPOUNDS; QUANTUM THEORY;

EID: 80052531417     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/c1cp21342c     Document Type: Article

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