Predicting Hugoniot equation of state in erythritol with ab initio and reactive molecular dynamics

Physics & Astronomy

• Hugoniot equation of state 100%
• molecular dynamics 41%
• shock 33%
• density functional theory 33%
• elastic properties 33%
• parameterization 33%
• predictions 31%
• crystal structure 22%
• mechanical shock 21%
• mechanical properties 19%
• field theory (physics) 14%
• crystals 14%
• melting points 13%
• hydrocarbons 13%
• thermal expansion 12%
• specific heat 11%
• oxidation 10%
• harmonics 10%
• phonons 9%
• curves 7%
• coefficients 7%
• approximation 7%
• simulation 5%
• temperature 4%