The determination of the most probable mechanism function and kinetic parameters of the thermal decomposition of complexes of rare earth isothiocyanates with glycine by non-isothermal differential scanning calorimetry curve

1991 ◽  
Vol 176 ◽  
pp. 209-220 ◽  
Author(s):  
Shu-Rong Yang ◽  
Jian-Hua Zhang ◽  
Ben-Gao Jiang ◽  
Zhao-He Yang
Keyword(s):  
Differential Scanning Calorimetry ◽  
Thermal Decomposition ◽  
Rare Earth ◽  
Kinetic Parameters ◽  
Differential Scanning Calorimetry Curve ◽  
Probable Mechanism ◽  
Scanning Calorimetry ◽  
Mechanism Function ◽  
Complexes Of Rare Earth

Thermal Decomposition of Hydroxylamine Nitrate Studied by Differential Scanning Calorimetry Analysis and Density Functional Theory Calculations

2017 ◽  
Vol 42 (4) ◽  
pp. 334-343
Author(s):  
Jianguo Liu ◽  
Zhentao An ◽  
Qian Zhang ◽  
Chaoyang Wang
Keyword(s):  
Activation Energy ◽  
Density Functional Theory ◽  
Differential Scanning Calorimetry ◽  
Thermal Decomposition ◽  
Density Functional ◽  
Probable Mechanism ◽  
Thermal Decomposition Mechanism ◽  
Scanning Calorimetry ◽  
Functional Theory ◽  
Mechanism Function

The thermal stability and kinetics of hydroxylamine nitrate (HAN) decomposition were studied by differential scanning calorimetry (DSC) and the thermal decomposition reaction mechanism was determined by density functional theory (DFT). With the help of parameter values from the non-isothermal DSC curves of HAN, the thermal decomposition activation energy and pre-exponential constant were obtained by the Kissinger and Ozawa methods. Then, the most probable mechanism function was calculated by the Šatava–Šesták method. Seven different paths for the thermal decomposition mechanism of HAN were formulated and DFT at the B3LYP/6-311++G(d,p) level was used to carry out the dynamics analysis. The calculated results show that the values of the activation energy calculated by the Kissinger and Ozawa methods are 67.892 and 70.412 kJ mol−1 respectively. The most probable mechanism function calculated by the Šatava–Šesták method is [Formula: see text]. The path being favoured energetically in the dynamics is in the order: Path6 > Path5 > Path4 > Path1 > Path2 > Path7 > Path3.

The Application of Differential Scanning Calorimetry to Thermal Analysis for Energetic Materials

2013 ◽  
Vol 423-426 ◽  
pp. 588-592
Author(s):  
Yong Kang Chen ◽  
Ming Hua Chen ◽  
Tao Zhang ◽  
Xiao Le Wu
Keyword(s):  
Thermal Stability ◽  
Thermal Analysis ◽  
Differential Scanning Calorimetry ◽  
Thermal Decomposition ◽  
Energetic Materials ◽  
Evaluation Research ◽  
Paper Briefly ◽  
Scanning Calorimetry ◽  
Main Components

Differential Scanning Calorimetry (DSC) is a common and useful method for thermal analysis. This paper briefly introduces the thermal decomposition characteristic determination of the main components of propellant by DSC assay and the applications of DSC in thermal stability and compatibility evaluation research of energetic materials.

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