Molecular dynamic insight into octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) and the nano-HMX decomposition mechanism

Herein, we demonstrate the use of large-scale reactive molecular dynamics simulations to identify the influence of nanostructures, size effects, and temperature for the decomposition processes of octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX). The bulk-phase and six types of HMX nanoparticle...

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Detalles Bibliográficos
Autores principales: Zhou, Mingming, Wei, Genwang, Zhang, Yao, Xiang, Dong, Ye, Caichao
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2022
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9661487/
https://www.ncbi.nlm.nih.gov/pubmed/36425722
http://dx.doi.org/10.1039/d2ra05394b

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9661487/
https://www.ncbi.nlm.nih.gov/pubmed/36425722
http://dx.doi.org/10.1039/d2ra05394b

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