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Theoretical prediction on the hydrolysis rate of the new types of nerve agents: A density functional study

Although the hydrolysis mechanism of the nerve agents, which is the main decontamination pathway, has been studied experimentally and theoretically, the reliable theoretical prediction method for the hydrolysis rate is not studied yet. Furthermore, after the CWC (Chemical Warfare Agent) list is upda...

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Detalles Bibliográficos
Autores principales: Rashid, Md Al Mamunur, Lee, Byounghwak, Kim, Kwang Ho, Jeong, Keunhong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9768234/
https://www.ncbi.nlm.nih.gov/pubmed/36569478
http://dx.doi.org/10.1016/j.toxrep.2022.12.001