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Initiation mechanisms and kinetic analysis of the isothermal decomposition of poly(α-methylstyrene): a ReaxFF molecular dynamics study

This study investigates the thermal decomposition initiation mechanisms and kinetics of poly(α-methylstyrene) (PαMS) under isothermal conditions, using molecular dynamics simulations with the ReaxFF reactive force field. The unimolecular pyrolysis simulations show that the thermal decomposition of t...

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Detalles Bibliográficos
Autores principales:	Hu, Shide, Sun, Weiguo, Fu, Jia, Zhang, Zhanwen, Wu, Weidong, Tang, Yongjian
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2018
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9077710/ https://www.ncbi.nlm.nih.gov/pubmed/35542940 http://dx.doi.org/10.1039/c7ra12467h

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