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Prediction of explosive properties of newly synthesized amino nitroguanidine-based energetic complexes via density

Rouhallah Roohzadeh1, Mohammad Mahdavi2

  • 1Department of Chemistry, Malek-Ashtar University of Technology, P.O. Box 83145/115, Shahin Shahr, IR, Iran.

Journal of Molecular Modeling
|April 20, 2020
PubMed

Keywords:
AIMAmino nitroguanidineDFTExplosiveHUMO–LUMO gapHirshfeld surface analysisNBO

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