Properties of molecular charge distributions affecting the sensitivity of energetic materials-Reference-Cited by-同舟云学术

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Properties of molecular charge distributions affecting the sensitivity of energetic materials

Published:2022 Issue: Volume: Page:81-105
ISSN:1380-7323
Container-title:Theoretical and Computational Chemistry
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Author:

Borges Itamar,Oliveira Roberta Siqueira Soldaini,Oliveira Marco Aurélio Souza

Funder

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Fundação Carlos Chagas Filho de Amparo à Pesquisa do Estado do Rio de Janeiro

Publisher

Elsevier

Reference118 articles.

1. Design and synthesis of energetic materials;Fried;Ann. Rev. Mater. Res.,2001

2. An excitonic mechanism of detonation initiation in explosives;Kuklja;J. Chem. Phys.,2000

3. A study of dinitro-Bis-1,2,4-triazole-1,1 '-diol and derivatives: design of high-performance insensitive energetic materials by the introduction of N-oxides;Dippold;J. Am. Chem. Soc.,2013

4. Synthesis and properties of tetranitro-substituted adamantane derivatives;Klapotke;ChemPlusChem,2018

5. Energetic Materials. Part 1. Decomposition, Crystal and Molecular Properties;Politzer,2003

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1. 3,5‐difluoro‐2,4,6‐trinitrophenol: A high‐energy compound born under the “NO₂FNO₂” construction strategy;Propellants, Explosives, Pyrotechnics;2023-12-07

2. The effect of the electronic structure method and basis set on the accuracy of the electric multipoles computed with the distributed multipole analysis (DMA);Journal of Molecular Modeling;2023-11

3. Nitrocellulose-based propellants: elucidation of the mechanisms of the diphenylamine stabilizer employing density functional theory;Journal of Energetic Materials;2023-02-01

4. Impact sensitivities of energetic materials derived from easy-to-compute ab initio rate constants;Physical Chemistry Chemical Physics;2023

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