A. Pereverzev

activity

20212026

collaborators

4 papers

cond-mat.mtrl-sci2026

Lattice thermal conductivity decomposition: Peierls vs. non-Peierls contributions

Andrey Pereverzev

The Green-Kubo lattice thermal conductivity computed using the full classical heat current of a crystalline solid is compared with results obtained from the quadratic component of…

cond-mat.mtrl-sci2023

Molecular dynamics study of diffusionless phase transformations in HMX: $β$ -HMX twinning and $β$ - $ε$ phase transition

Andrey Pereverzev

We use molecular dynamics to study mechanism of deformation twinning of $β$ -1,3,5,7-tetranitro-1,3,5,7-tetrazocane ( $β$ -HMX) in the $P 2_{1} / n$ space group setting for the twin system…

cond-mat.mtrl-sci2023

Thermal conductivity tensor of $β$ -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 $β$ -1,3,5,7-tetranitro-1,3,5,7-tetrazocane ( $β$ -HMX) as a function of pressure and temperature f…

cond-mat.mtrl-sci2021

Heat-current filtering for Green-Kubo and Helfand-moment molecular dynamics predictions of thermal conductivity: Application to the organic crystal $β$ -HMX

Andrey Pereverzev, Tommy Sewell

The closely related Green-Kubo and Helfand moment approaches are applied to obtain the thermal conductivity tensor of $β$ -1,3,5,7-tetranitro-1,3,5,7-tetrazoctane ( $β$ -HMX) at $T=30…

Lattice thermal conductivity decomposition: Peierls vs. non-Peierls contributions

Molecular dynamics study of diffusionless phase transformations in HMX: β-HMX twinning and β-ε phase transition

Thermal conductivity tensor of β-HMX as a function of pressure and temperature from equilibrium molecular dynamics simulations

Heat-current filtering for Green-Kubo and Helfand-moment molecular dynamics predictions of thermal conductivity: Application to the organic crystal β-HMX

Molecular dynamics study of diffusionless phase transformations in HMX: $β$ -HMX twinning and $β$ - $ε$ phase transition

Thermal conductivity tensor of $β$ -HMX as a function of pressure and temperature from equilibrium molecular dynamics simulations

Heat-current filtering for Green-Kubo and Helfand-moment molecular dynamics predictions of thermal conductivity: Application to the organic crystal $β$ -HMX