A theoretical study on 1,5-diazido-3-nitrazapentane (DANP) and 1,7-diazido-2,4,6-trinitrazaheptane (DATNH): molecular and crystal structures, thermodynamic and detonation properties, and pyrolysis mechanism

Title
A theoretical study on 1,5-diazido-3-nitrazapentane (DANP) and 1,7-diazido-2,4,6-trinitrazaheptane (DATNH): molecular and crystal structures, thermodynamic and detonation properties, and pyrolysis mechanism
Authors
Keywords
Azido nitramine, Plasticizer, Density functional theory, Detonation performance, Pyrolysis mechanism
Journal
JOURNAL OF MOLECULAR MODELING
Volume 19, Issue 12, Pages 5367-5376
Publisher
Springer Nature
Online
2013-10-26
DOI
10.1007/s00894-013-2014-6

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