Kinetic simulation of unsteady detonation with thermodynamic nonequilibrium effects

C Lin, KH Luo - Combustion, Explosion, and Shock Waves, 2020 - Springer
… In this section, the DBM is adopted to simulate and investigate unsteady detonation with both
hydrodynamic and thermodynamic nonequilibrium effects. The computational domain, with …

Theory of chemical kinetics and charge transfer based on nonequilibrium thermodynamics

MZ Bazant - Accounts of chemical research, 2013 - ACS Publications
… below, eq 81, but first we need to develop a modeling framework for chemical potentials. …
has been to formulate chemical kinetics for inhomogeneous, nonequilibrium systems. The most …

Discrete Boltzmann modeling of multiphase flows: Hydrodynamic and thermodynamic non-equilibrium effects

Y Gan, A Xu, G Zhang, S Succi - Soft Matter, 2015 - pubs.rsc.org
non-equilibrium and thermodynamic non-equilibrium effects in phase separation processes.
Efficient parallel implementation and the ability to capture the non-equilibrium effects are …

Unsteady detonation with thermodynamic nonequilibrium effect based on the kinetic theory

X Su, C Lin - Communications in Theoretical Physics, 2023 - iopscience.iop.org
… is simulated and investigated from the viewpoint of kinetic … the kinetic moments of the reaction
term have been simulated… to describe the global effects of kinetic moments due to chemical …

Criteria for validity of thermodynamic equations from non-equilibrium molecular dynamics simulations

S Kjelstrup, D Bedeaux, I Inzoli, JM Simon - Energy, 2008 - Elsevier
non-equilibrium molecular dynamics simulations. In all cases, we verified that thermodynamic
variables obeyed normal thermodynamic … Equipartition of kinetic energy applied to all …

Local non-equilibrium effect on the growth kinetics of crystals

PK Galenko, V Ankudinov - Acta Materialia, 2019 - Elsevier
… well the molecular simulation data if the deviation from local thermodynamic equilibrium is
taken … This confirms the necessity of use of local non-equilibrium models in the analysis of fast …

Discrete Boltzmann modeling of unsteady reactive flows with nonequilibrium effects

C Lin, KH Luo - Physical Review E, 2019 - APS
… and thermodynamic nonequilibrium effects beyond the NS equations. The capability of the
DBM is demonstrated through simulations … Moreover, nonequilibrium effects on the predicted …

Nonequilibrium modeling of hydrate dynamics in reservoir

MT Vafaei, B Kvamme, A Chejara, K Jemai - Energy & fuels, 2012 - ACS Publications
… the simulator and the specific method for implementing nonequilibrium thermodynamics in
… to show the importance of a kinetic approach in the simulation of hydrate in reservoir and to …

[图书][B] Non-equilibrium reacting gas flows: kinetic theory of transport and relaxation processes

E Nagnibeda, E Kustova - 2009 - books.google.com
… the local thermodynamic equilibrium were considered. Non-equilibrium effects were taken
… the developed theory to numerical simulations of various non-equilibrium flows. We present …

Kinetic simulation of nonequilibrium Kelvin-Helmholtz instability

CD Lin, KH Luo, YB Gan, ZP Liu - Communications in Theoretical …, 2019 - iopscience.iop.org
simulation, large eddy simulation, and Reynolds-averaged Navier-Stokes (NS) equations,
improve computational efficiency significantly, but lose various thermodynamic nonequilibrium