Theoretical prediction of the reaction of s-triazine with nitrate radical: A new possible route to generate oxy-s-triazine
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4769285
Reference23 articles.
1. The Mechanism for Unimolecular Decomposition of RDX (1,3,5-Trinitro-1,3,5-triazine), an ab Initio Study
2. Potential of mean force calculations using ab initio tight-binding molecular dynamics: Application to N–NO2 bond dissociation in DMNA and HMX
3. Density functional study of 1,3,5-trinitro-1,3,5-triazine molecular crystal with van der Waals interactions
4. Density Functional Theory Calculations of Pressure Effects on the Vibrational Structure of α-RDX
5. A study of the chemical and physical processes governing CO2 laser-induced pyrolysis and combustion of RDX
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2. Theoretical Study of Mechanism and Kinetics of the Reaction of NO2with s-Triazine;Propellants, Explosives, Pyrotechnics;2016-07-22
3. Theoretical study of the reaction mechanism of CH3NO2 with NO2, NO and CO: the bimolecular reactions that cannot be ignored;Journal of Molecular Modeling;2015-01
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