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High-Pressure Studies of Hydrogen-Bonded Energetic Material 3,6-Dihydrazino-s-tetrazine Using DFT
[Image: see text] Hydrogen bonding is an important noncovalent interaction that plays a key role in most of the CHNO-based energetic materials, which has a great impact on the structural, stability, and vibrational properties. By analyzing the structural changes, IR spectra, and the Hirshfeld surfac...
Autores principales: | Moses Abraham, B., Prathap Kumar, J., Vaitheeswaran, G. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2018
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6645062/ https://www.ncbi.nlm.nih.gov/pubmed/31459072 http://dx.doi.org/10.1021/acsomega.8b00806 |
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