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Looking for high energy density compounds among polynitraminecubanes

โœ Scribed by Wei-Jie Chi, Lu-Lin Li, Bu-Tong Li, Hai-Shun Wu

Book ID
118790090
Publisher
Springer-Verlag
Year
2012
Tongue
English
Weight
219 KB
Volume
19
Category
Article
ISSN
1610-2940

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Looking for high energy density compound
Looking for high energy density compounds applicable for propellant among the derivatives of dpo with n3, ono2, and nno2 groups
โœ Gui-Xiang Wang; Xue-Dong Gong; Yan Liu; Hong-Chen Du; Xiao-Juan Xu; He-Ming Xiao ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 197 KB

The derivatives of DPO (2,5-dipicryl-1,3,4-oxadiazole) are optimized to obtain their molecular geometries and electronic structures at the DFT-B3LYP/6-31G\* level. The bond length is focused to primarily predict thermal stability and the pyrolysis mechanism of the title compounds. Detonation propert