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Density functional theory study on the structure and energy properties of high-energy–density materials based on trinitrophenyl azacyclic compounds.

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Bibliographic Details
Title: Density functional theory study on the structure and energy properties of high-energy–density materials based on trinitrophenyl azacyclic compounds.
Authors: Zhang, Xinyue1 (AUTHOR), Guo, Jiaming1 (AUTHOR), Peng, Xinhua1 (AUTHOR) xhpeng@njust.edu.cn
Source: Journal of Molecular Modeling. Mar2026, Vol. 32 Issue 3, p1-14. 14p.
Database: Academic Search Ultimate
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