[HTML][HTML] Classical and reactive molecular dynamics: Principles and applications in combustion and energy systems

Q Mao, M Feng, XZ Jiang, Y Ren, KH Luo… - Progress in Energy and …, 2023 - Elsevier
Molecular dynamics (MD) has evolved into a ubiquitous, versatile and powerful
computational method for fundamental research in science branches such as biology …

Applications of porous materials in combustion systems: A comprehensive and state-of-the-art review

A Gharehghani, K Ghasemi, M Siavashi, S Mehranfar - Fuel, 2021 - Elsevier
Porous materials have been extensively used in various engineering applications, due to
their promising thermal characteristics. Extensions of lean-burn limits as well as the low …

[HTML][HTML] Lattice Boltzmann methods for combustion applications

SA Hosseini, P Boivin, D Thévenin, I Karlin - Progress in Energy and …, 2024 - Elsevier
Progress in recent years has opened the door for yet another area of application for the
lattice Boltzmann method: Combustion simulations. Combustion is known to be a challenge …

[HTML][HTML] Pore-scale simulation of miscible viscous fingering with dissolution reaction in porous media

T Lei, KH Luo - Physics of Fluids, 2021 - pubs.aip.org
Global climate change is happening but may be mitigated by the technology of geological
carbon dioxide (⁠ CO 2⁠) sequestration. To gain comprehensive insights into this approach …

Analysis of power-law natural conjugate heat transfer under the effect of magnetic field and heat absorption/production based on the first and second laws of …

C Sun, Y Zhang, SD Farahani, C Hu, M Nemati… - … Analysis with Boundary …, 2022 - Elsevier
The amount of entropy generated during the conjugate heat transfer of a non-Newtonian
fluid regarding to natural convection within a two-dimensional cavity under the influence of a …

MHD natural convection in a cavity with different geometries filled with a nanofluid in the presence of heat generation/absorption using lattice Boltzmann method

M Nemati, HM Sani, R Jahangiri… - Journal of Thermal …, 2022 - Springer
A nanofluid flow under the influence of magnetic field with heat generation/absorption is
considered in the cooling of electronic systems, nuclear reactors and physical phenomena …

[HTML][HTML] Pore-scale study of coke formation and combustion in porous media using lattice Boltzmann method

T Lei, KH Luo - Proceedings of the Combustion Institute, 2023 - Elsevier
In-situ combustion (ISC) has long been recognized as a promising technique for heavy oil
recovery. However, ISC includes multiple physicochemical processes, which are still poorly …

Study of CO2 desublimation during cryogenic carbon capture using the lattice Boltzmann method

T Lei, KH Luo, FEH Pérez, G Wang, Z Wang… - Journal of Fluid …, 2023 - cambridge.org
Study of CO2 desublimation during cryogenic carbon capture using the lattice Boltzmann
method Page 1 J. Fluid Mech. (2023), vol. 964, A1, doi:10.1017/jfm.2023.227 Study of CO2 …

Investigation of non-Newtonian power-law free convection affected by a magnetic field in an inclined quarter-circle chamber containing the lozenge-shaped obstacle …

J Bai, X Hu, YH Tao, WH Ji - Engineering Analysis with Boundary …, 2022 - Elsevier
Investigating the effect of the strength, type and angle of the magnetic field applied on the
amount of entropy generation caused by the heat transfer of non-Newtonian fluid under the …

[HTML][HTML] A pore-level 3D lattice Boltzmann simulation of mass transport and reaction in catalytic particles used for methane synthesis

M Khatoonabadi, NI Prasianakis, J Mantzaras - International Journal of …, 2024 - Elsevier
Three-dimensional lattice Boltzmann (LB) simulations were carried out to investigate the
mass transport and reaction inside and around catalytic porous particles used in fluidized …