Reactive molecular dynamics and DFT simulations of FTDO explosive-Reference-Cited by-同舟云学术

Reactive molecular dynamics and DFT simulations of FTDO explosive

Published:2022-06 Issue: Volume:1212 Page:113723
ISSN:2210-271X
Container-title:Computational and Theoretical Chemistry
language:en
Short-container-title:Computational and Theoretical Chemistry

Author:

Gonçalves Rene F.B.,Kuznetsov Aleksey,Rocco Bruno T.,Rocco Leopoldo,Rocco José A.F.F.

Funder

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Instituto Tecnológico de Aeronáutica

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference56 articles.

1. J.J. Sabatini, L.A. Wingard, P.E. Guzman, E.C. Johnson, G.W. Drake, Bis-Isoxazole dinitrate: A potential propellant and explosive ingredient. 42nd International Pyrotechnics Society Seminar, Grand Junction, 2016.

2. The Chemistry of Explosives;Oxley,2003

3. Explosives development and fundamentals of explosives technology;Lee,2003

4. Blast - efeitos da onda de choque no ser humano e nas estruturas;Silva,2007

5. Theoretical and Experimental Studies on Blast Wave Propagation in Air;Dharma Rao;Propellants, Explos., Pyrotech.,2015

Cited by 12 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Synthesis, spectral, DFT, topology, NCI and molecular docking studies of (1E,1′E)-N, N'-(sulfonylbis(4,1-phenylene))bis(1-(4-bromophenyl)methanimine);Journal of Molecular Structure;2024-11

2. Effect of oxygen concentration on ammonia combustion: A combined ReaxFF and DFT study;International Journal of Hydrogen Energy;2024-08

3. Synthesis, topology, molecular docking and dynamics studies of o -phenylenediamine derivative;Journal of Biomolecular Structure and Dynamics;2024-04-05

4. Synthesis, solvent role in TD-DFT (IEFPCM model), fluorescence and reactivity properties, topology and molecular docking studies on sulfathiazole derivative;Journal of Molecular Liquids;2024-04

5. Synthesis, solvent role, absorption and emission studies of cytosine derivative;Heliyon;2024-04