Modeling kinetic non-equilibrium using the first two moments of the residence time distribution

R Andricevic, E Foufoula-Georgiou - Stochastic Hydrology and Hydraulics, 1991 - Springer
… The second moment of the residence time reflects the relative importance of the chemical
kinetics versus local equilibrium conditions for the given transport time step Δt. The simulated

Multi-degree-of-freedom kinetic model and its applications in simulation of three-dimensional nonequilibrium flows

D Pan, C Zhuo, S Liu, C Zhong - Computers & Fluids, 2023 - Elsevier
… high fidelity in the simulation of non-equilibrium flows. Klingenberg et al. investigated
molecular collisions in two-component mixtures and proposed a novel kinetic collision model from …

Nonequilibrium rate-based simulation of reactive systems: simulation model, heat transfer, and influence of film discretization

N Asprion - Industrial & engineering chemistry research, 2006 - ACS Publications
… In this paper, a nonequilibrium model is presented that is based on the two-film model.
The multicomponent diffusion of components in the films is described using the Stefan−Maxwell …

Effect of nonequilibrium surface thermochemistry in simulation of carbon-based ablators

YK Chen, T Gökçen - Journal of Spacecraft and Rockets, 2013 - arc.aiaa.org
… ) [4] simulation to take into account the effect of mass … simulation system and its applications
to carbon-based charring ablators. The boundary condition with general nonequilibrium

Non-equilibrium kinetics, diffusion and heat transfer in shock heated flows of N2/N and O2/O mixtures

O Kunova, E Kustova, M Mekhonoshina, E Nagnibeda - Chemical Physics, 2015 - Elsevier
kinetics on heat transfer and diffusion in non-equilibrium flows … state and one-temperature
kinetic theory approaches. The results … Simulations performed in the frame of the present study …

A new methodology for the reduction of vibrational kinetics in non-equilibrium microwave plasma: application to CO 2 dissociation

JF de la Fuente, SH Moreno, AI Stankiewicz… - Reaction Chemistry & …, 2016 - pubs.rsc.org
… Hence, to enable the applicability of plasma kinetic models in multidimensional simulations,
a simplification approach to reduce complex kinetic models is presented in this work. …

Non-equilibrium Thermodynamics from a Kinetic Standpoint

PC Philippi - … From Fundamentals to Multiphase and Multicomponent …, 2024 - Springer
… Nevertheless, in numerical simulations of molecular dynamics, the round-off errors prevent
the simulations from being performed beyond very limited spatial and time ranges. This …

Kinetic effects of non-equilibrium plasma-assisted methane oxidation on diffusion flame extinction limits

W Sun, M Uddi, SH Won, T Ombrello, C Carter… - Combustion and …, 2012 - Elsevier
… The use of global strain rate was found to be appropriate for mechanism validation [36],
and the global strain rates were used in this study for both experiments and simulations. …

Nonequilibrium velocity distribution function of gases: Kinetic theory and molecular dynamics

W Loose, S Hess - Physical review A, 1988 - APS
… the velocity distribution function is obtained from nonequilibrium … can provide the desired
data from a simulation of a nonequilibrium … of the kinetic theory with results from nonequilibrium

Noise-induced modulation of the relaxation kinetics around a non-equilibrium steady state of non-linear chemical reaction networks

R Ramaswamy, IF Sbalzarini, N González-Segredo - PLoS One, 2011 - journals.plos.org
Effects of higher confinement are then studied using a partial-propensity stochastic simulation
… the mechanisms that deviate stochastic kinetics from its deterministic counterpart. In …