Reactive Force Field for Liquid Hydrazoic Acid with Applications to Detonation Chemistry

Physics & Astronomy

• hydrazoic acid 100%
• detonation 55%
• field theory (physics) 53%
• chemistry 45%
• density functional theory 40%
• molecular dynamics 38%
• liquids 28%
• simulation 20%
• thermal decomposition 19%
• routes 14%
• activation energy 12%
• formalism 12%
• thermodynamics 11%
• predictions 9%
• performance 7%
• temperature 5%

Engineering & Materials Science

• Density functional theory 79%
• Detonation 62%
• Molecular dynamics 59%
• Acids 48%
• Liquids 35%
• Computer simulation 19%
• Activation energy 18%
• Pyrolysis 16%
• Thermodynamics 15%
• Compaction 14%
• Temperature 7%

Chemical Compounds

• Detonation 64%
• Force 35%
• Simulation 33%
• Density Functional Theory 32%
• Chemistry 30%
• Liquid 28%
• Activation Volume 24%
• Acid 18%
• Application 16%
• Molecular Dynamics 13%
• Pyrolysis 12%
• Reaction Activation Energy 12%
• Thermodynamics 10%