Kinetics of thermal decomposition of ε-hexanitrohexaazaisowurtzitane by TG-DSC-MS-FTIR

Yan Li Zhu; Ming Xin Shan; Zhi Xia Xiao; Jing Si Wang; Qing Jie Jiao

doi:10.1007/s11814-014-0305-y

Kinetics of thermal decomposition of ε-hexanitrohexaazaisowurtzitane by TG-DSC-MS-FTIR

Yan Li Zhu^*, Ming Xin Shan, Zhi Xia Xiao, Jing Si Wang, Qing Jie Jiao

^*Corresponding author for this work

School of Mechatronical Engineering

Beijing Institute of Technology

Research output: Contribution to journal › Article › peer-review

33 Citations (Scopus)

Abstract

Thermal decomposition of ε-hexanitrohexaazaisowurtzitane (HNIW) was studied by thermogravimetry-differential scanning calorimetry-mass spectrometry-Fourier transform infrared spectroscopy (TG-DSC-MS-FTIR) simultaneous analysis. It has been shown that there is a crystal transition point for ε-HNIW, and only a single decomposition process has been observed for HNIW. The kinetic parameters of thermal decomposition of HNIW were obtained by Kissinger and Flynn-Wall-Ozawa methods, indicating that HNIW has the higher reactivity compared to the other nitramines. The HNIW decomposition mechanism demonstrated by the non-isothermal kinetics conformed to Avrami-Erofeev equation with the factor of nucleus growth of n=1/3 and the conversion degree of α from 0.1 to 0.7. The MS and FTIR analyses indicated that the thermal decomposition of HNIW favors N-N bond cleavage over C-N bond cleavage as the rate determining step.

Original language	English
Pages (from-to)	1164-1169
Number of pages	6
Journal	Korean Journal of Chemical Engineering
Volume	32
Issue number	6
DOIs	https://doi.org/10.1007/s11814-014-0305-y
Publication status	Published - 5 Jun 2015

Keywords

Chemical Kinetics
Explosive
Hexanitrohexaazaisowurtzitane
Thermal Decomposition

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10.1007/s11814-014-0305-y

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@article{3ea533f2e4ef4b4c93b0c6e0c023d53d,

title = "Kinetics of thermal decomposition of ε-hexanitrohexaazaisowurtzitane by TG-DSC-MS-FTIR",

abstract = "Thermal decomposition of ε-hexanitrohexaazaisowurtzitane (HNIW) was studied by thermogravimetry-differential scanning calorimetry-mass spectrometry-Fourier transform infrared spectroscopy (TG-DSC-MS-FTIR) simultaneous analysis. It has been shown that there is a crystal transition point for ε-HNIW, and only a single decomposition process has been observed for HNIW. The kinetic parameters of thermal decomposition of HNIW were obtained by Kissinger and Flynn-Wall-Ozawa methods, indicating that HNIW has the higher reactivity compared to the other nitramines. The HNIW decomposition mechanism demonstrated by the non-isothermal kinetics conformed to Avrami-Erofeev equation with the factor of nucleus growth of n=1/3 and the conversion degree of α from 0.1 to 0.7. The MS and FTIR analyses indicated that the thermal decomposition of HNIW favors N-N bond cleavage over C-N bond cleavage as the rate determining step.",

keywords = "Chemical Kinetics, Explosive, Hexanitrohexaazaisowurtzitane, Thermal Decomposition",

author = "Zhu, \{Yan Li\} and Shan, \{Ming Xin\} and Xiao, \{Zhi Xia\} and Wang, \{Jing Si\} and Jiao, \{Qing Jie\}",

note = "Publisher Copyright: {\textcopyright} 2014, Korean Institute of Chemical Engineers, Seoul, Korea.",

year = "2015",

month = jun,

day = "5",

doi = "10.1007/s11814-014-0305-y",

language = "English",

volume = "32",

pages = "1164--1169",

journal = "Korean Journal of Chemical Engineering",

issn = "0256-1115",

publisher = "Springer",

number = "6",

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TY - JOUR

T1 - Kinetics of thermal decomposition of ε-hexanitrohexaazaisowurtzitane by TG-DSC-MS-FTIR

AU - Zhu, Yan Li

AU - Shan, Ming Xin

AU - Xiao, Zhi Xia

AU - Wang, Jing Si

AU - Jiao, Qing Jie

PY - 2015/6/5

Y1 - 2015/6/5

N2 - Thermal decomposition of ε-hexanitrohexaazaisowurtzitane (HNIW) was studied by thermogravimetry-differential scanning calorimetry-mass spectrometry-Fourier transform infrared spectroscopy (TG-DSC-MS-FTIR) simultaneous analysis. It has been shown that there is a crystal transition point for ε-HNIW, and only a single decomposition process has been observed for HNIW. The kinetic parameters of thermal decomposition of HNIW were obtained by Kissinger and Flynn-Wall-Ozawa methods, indicating that HNIW has the higher reactivity compared to the other nitramines. The HNIW decomposition mechanism demonstrated by the non-isothermal kinetics conformed to Avrami-Erofeev equation with the factor of nucleus growth of n=1/3 and the conversion degree of α from 0.1 to 0.7. The MS and FTIR analyses indicated that the thermal decomposition of HNIW favors N-N bond cleavage over C-N bond cleavage as the rate determining step.

AB - Thermal decomposition of ε-hexanitrohexaazaisowurtzitane (HNIW) was studied by thermogravimetry-differential scanning calorimetry-mass spectrometry-Fourier transform infrared spectroscopy (TG-DSC-MS-FTIR) simultaneous analysis. It has been shown that there is a crystal transition point for ε-HNIW, and only a single decomposition process has been observed for HNIW. The kinetic parameters of thermal decomposition of HNIW were obtained by Kissinger and Flynn-Wall-Ozawa methods, indicating that HNIW has the higher reactivity compared to the other nitramines. The HNIW decomposition mechanism demonstrated by the non-isothermal kinetics conformed to Avrami-Erofeev equation with the factor of nucleus growth of n=1/3 and the conversion degree of α from 0.1 to 0.7. The MS and FTIR analyses indicated that the thermal decomposition of HNIW favors N-N bond cleavage over C-N bond cleavage as the rate determining step.

KW - Chemical Kinetics

KW - Explosive

KW - Hexanitrohexaazaisowurtzitane

KW - Thermal Decomposition

UR - https://www.scopus.com/pages/publications/84930377752

U2 - 10.1007/s11814-014-0305-y

DO - 10.1007/s11814-014-0305-y

M3 - Article

AN - SCOPUS:84930377752

SN - 0256-1115

VL - 32

SP - 1164

EP - 1169

JO - Korean Journal of Chemical Engineering

JF - Korean Journal of Chemical Engineering

IS - 6

ER -

Kinetics of thermal decomposition of ε-hexanitrohexaazaisowurtzitane by TG-DSC-MS-FTIR

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Keywords

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