2 papers
cond-mat.mes-hall2024
On resolving meso-scale calculations of pore-collapse-generated hotspots in energetic crystals for consistency with atomistic models
Chukwudubem Okafor, Jacob Herrin, Catalin R. Picu +4
Meso-scale calculations of pore collapse and hotspot formation in energetic crystals provide closure models to macro-scale hydrocodes for predicting the shock sensitivity of energe…
cond-mat.mtrl-sci2023
Thermal conductivity tensor of -HMX as a function of pressure and temperature from equilibrium molecular dynamics simulations
Andrey Pereverzev, Tommy Sewell
We apply the Green-Kubo (G-K) approach to obtain the thermal conductivity tensor of -1,3,5,7-tetranitro-1,3,5,7-tetrazocane (-HMX) as a function of pressure and temperature f…