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Theoretical design of bis-azole derivatives for energetic compounds
Bis-azole derivatives are a new class of energetic materials with features that include high nitrogen content, high heat of formation (HOF), high detonation performance and insensitivity to external stimuli. In this paper, 599 new bis-azole compounds were designed in a high-throughput fashion using...
Autores principales: | Pu, Keyu, Wang, Linyuan, Liu, Jian, Zhong, Kai |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9051427/ https://www.ncbi.nlm.nih.gov/pubmed/35492122 http://dx.doi.org/10.1039/d0ra00385a |
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