"The thermal decomposition physical models of different CL-20 polymorph crystals and their polymer bonded explosives (PBXs) bonded by polymeric matrices using polyisobutylene (PIB), acrylonitrile butadiene rubber (NBR), styrene butadiene rubber (SBR), Viton A, and Fluorel binders are obtained and used to predict the temperature profiles of constant rate decomposition. These models are supported by the detailed decomposition pathways simulated by a reactive molecular dynamics (ReaxFF-lg) code. Compared to fluoropolymers, PIB, SBR and NBR may make epsilon-CL-20 undergo more complete N-NO2 scission before collapse of the cage structure. This is likely the main reason why those polymer bases could greatly mitigate the decomposition process of epsilon-CL-20 from a single step to a multistep, resulting in lower impact sensitivity, whereas fluoropolymers have only a little effect on that." . "Sanchez Jimenez, P. E." . "RIV/00216275:25310/14:39898683!RIV15-MSM-25310___" . . "Journal of Physical Chemistry C" . . . . "Yan, Qi Long" . "The mitigation effect of synthetic polymers on initiation reactivity of CL-20: physical models and chemical pathways of thermolysis"@en . "25310" . "Zhang, Tong-Lai" . "RIV/00216275:25310/14:39898683" . "Zeman, Svatopluk" . "Perez-Maqueda, L. A." . "The thermal decomposition physical models of different CL-20 polymorph crystals and their polymer bonded explosives (PBXs) bonded by polymeric matrices using polyisobutylene (PIB), acrylonitrile butadiene rubber (NBR), styrene butadiene rubber (SBR), Viton A, and Fluorel binders are obtained and used to predict the temperature profiles of constant rate decomposition. These models are supported by the detailed decomposition pathways simulated by a reactive molecular dynamics (ReaxFF-lg) code. Compared to fluoropolymers, PIB, SBR and NBR may make epsilon-CL-20 undergo more complete N-NO2 scission before collapse of the cage structure. This is likely the main reason why those polymer bases could greatly mitigate the decomposition process of epsilon-CL-20 from a single step to a multistep, resulting in lower impact sensitivity, whereas fluoropolymers have only a little effect on that."@en . "The mitigation effect of synthetic polymers on initiation reactivity of CL-20: physical models and chemical pathways of thermolysis" . "15"^^ . . "1932-7447" . "118" . . "10.1021/jp505955n" . "crystal-structure; mass-spectrometry; force-field; energetic materials; thermal-decomposition; combined kinetic-analysis; plastic bonded explosives; attractive cyclic nitramines; molecular-dynamics simulations"@en . . "[CF34501E17E5]" . "The mitigation effect of synthetic polymers on initiation reactivity of CL-20: physical models and chemical pathways of thermolysis"@en . . . . . . "000343016800008" . "Elbeih, Ahmed Ikhlas Mohamed" . . . "Yan, Qi Long" . . . . . "3"^^ . "US - Spojen\u00E9 st\u00E1ty americk\u00E9" . "29555" . "40" . . . "The mitigation effect of synthetic polymers on initiation reactivity of CL-20: physical models and chemical pathways of thermolysis" . . "I, S" . "Elbeih, Ahmed Ikhlas Mohamed" . "6"^^ .