Publication detail
Reactivity of N-NO2 Bonds in Nitramines: Bond Dissociation and Bond Disproportionation Approach. I
FRIEDL, Z. ZEMAN, S.
Original Title
Reactivity of N-NO2 Bonds in Nitramines: Bond Dissociation and Bond Disproportionation Approach. I
Type
book chapter
Language
English
Original Abstract
Comparison of B3LYP/6-311+G(d,p) bond dissociation energies and bond disproportionation energies in 17 nitramines was performed. The energy data were correlated with explosive properties of nitramines.
Keywords
DFT B3LYP/6-311+G(d,p), bond energy, disproportionation energy, nitramines
Authors
FRIEDL, Z.; ZEMAN, S.
RIV year
2007
Released
23. 10. 2007
Publisher
Science Press
Location
Beijing, China
ISBN
978-7-03-020254-3
Book
Theory and Practice of Energetic Materials. Vol. VII.
Edition
Science Press USA
Edition number
1
Pages from
410
Pages to
417
Pages count
8
BibTex
@inbook{BUT55435,
author="Zdeněk {Friedl} and Svatopluk {Zeman}",
title="Reactivity of N-NO2 Bonds in Nitramines: Bond Dissociation and Bond Disproportionation Approach. I",
booktitle="Theory and Practice of Energetic Materials. Vol. VII.",
year="2007",
publisher="Science Press",
address="Beijing, China",
series="Science Press USA",
edition="1",
pages="410--417",
isbn="978-7-03-020254-3"
}