Chemical Insight on Decreased Sensitivity of CL-20/TNT Cocrystal Revealed by ReaxFF MD Simulations
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DOI: 10.1021/acs.jcim.8b00952
Abstract: Understanding the underlying mechanisms on sensitivity-decrease of the CL-20/TNT cocrystal is essential for wide applications of the promising high-energetic CL-20. This work presents the chemical scenario of CL-20/TNT thermolysis obtained from ReaxFF molecular dynamics simulations.… read more here.
Keywords: sensitivity tnt; tnt; sensitivity; tnt cocrystal ... See more keywords