Density functional theory study of the reactions of 2-azido-N,N-dimethylethanamine with nitric acid and nitrogen dioxide

Keyphrases

• Density Functional Theory 100%
• Nitrogen Dioxide 100%
• Nitric Acid 100%
• Azido 100%
• Nitric Nitrogen 100%
• Ignition 20%
• Ignition Delay Time 20%
• Amine Nitrogen 20%
• Low Temperature 10%
• Liquid Phase 10%
• Ignition Mechanism 10%
• Proton 10%
• Heat Release 10%
• Reaction Pathway 10%
• Proton Transfer 10%
• Hypergolic Propellant 10%
• Gas-phase Reactions 10%
• B3LYP Functional 10%
• Nitrogen Atom 10%
• Proton Transfer Reaction 10%
• Amino Nitrogen 10%
• TMEDA 10%
• Azido Group 10%
• Reaction Types 10%
• N2 Formation 10%
• High Energy Barrier 10%
• Nitrogen Dioxide, NO2 10%
• Low-temperature Reaction 10%

Physics

• Density Functional Theory Study 100%
• Nitrogen 100%
• Amine 50%
• Liquid Phase 25%
• Gas Phase Reaction 25%
• Nitrogen Atom 25%
• Density Functional Theory 25%