scholarly journals Thermal Decomposition of Energetic Materials by ReaxFF Reactive Molecular Dynamics

2006 ◽  
Author(s):  
Luzheng Zhang
Keyword(s):  
Molecular Dynamics ◽  
Thermal Decomposition ◽  
Energetic Materials ◽  
Reactive Molecular Dynamics

Reactive molecular dynamics simulation of thermal decomposition for nano-FOX-7

2021 ◽  
Vol 127 (11) ◽  
Author(s):  
Chongchong She ◽  
Shaohua Jin ◽  
Shusen Chen ◽  
Lijie Li ◽  
Qinghai Shu ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Thermal Decomposition ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation ◽  
Reactive Molecular Dynamics

Molecular Dynamics Insight into the Evolution of Al Nanoparticles in the Thermal Decomposition of Energetic Materials

2020 ◽  
Vol 124 (19) ◽  
pp. 10783-10792
Author(s):  
Weizhe Hao ◽  
Gang Li ◽  
Liangliang Niu ◽  
Ruijun Gou ◽  
Chaoyang Zhang
Keyword(s):  
Molecular Dynamics ◽  
Thermal Decomposition ◽  
Energetic Materials ◽  
Al Nanoparticles ◽  
Insight Into

Reactive molecular dynamics simulation of thermal decomposition for nano-aluminized explosives

2018 ◽  
Vol 20 (46) ◽  
pp. 29341-29350 ◽  
Author(s):  
Zheng Mei ◽  
Qi An ◽  
Feng-Qi Zhao ◽  
Si-Yu Xu ◽  
Xue-Hai Ju
Keyword(s):  
Molecular Dynamics ◽  
Thermal Decomposition ◽  
Molecular Dynamics Simulation ◽  
Catalytic Effect ◽  
Onset Temperature ◽  
Dynamics Simulation ◽  
Reactive Molecular Dynamics

The catalytic effect of nano-Al particles on thermal decomposition of RDX, reducing the onset temperature of generating H2O and CO2 (ΔTo < 0).

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