Lack of energy conservation in lattice Boltzmann models leads to unrealistically high values of the bulk viscosity. For this reason, the lattice Boltzmann method remains a computational tool rather than a model of a fluid. A novel lattice Boltzmann model with energy conservation is derived from Boltzmann's kinetic theory. Simulations demonstrate that the new lattice Boltzmann model is the valid approximation of the Boltzmann equation for weakly compressible flows and microflows.
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http://dx.doi.org/10.1103/PhysRevLett.95.260605 | DOI Listing |
ACS Appl Mater Interfaces
January 2025
College of Material, Chemistry and Chemical Engineering, Hangzhou Normal University, Hangzhou 311121, P. R. China.
Thermoelectric technology enables the direct and reversible conversion of heat into electrical energy without air pollution. Herein, the stability, electronic structure, and thermoelectric properties of methoxy-functionalized MC(OMe) (M = Sc, Ti, V, Cr, Y, Zr, Nb, Mo, Hf, Ta, and W) were systematically investigated using first-principles calculations and semiclassical Boltzmann transport theory. All MXenes, except those with M = Cr, Mo, and W, can be synthesized by substituting Cl- and Br-functionalized MXenes with deprotonated methanol, with stability governed by the M-O bond strength.
View Article and Find Full Text PDFPNAS Nexus
January 2025
Université Paris Cité, CNRS, Laboratoire de Biochimie Théorique, 13 rue Pierre et Marie Curie, Paris 75005, France.
The driving mechanisms at the base of the clearance of biological wastes in the brain interstitial space (ISS) are still poorly understood and an actively debated subject. A complete comprehension of the processes that lead to the aggregation of amyloid proteins in such environment, hallmark of the onset and progression of Alzheimer's disease, is of crucial relevance. Here we employ combined computational fluid dynamics and molecular dynamics techniques to uncover the role of fluid flow and proteins transport in the brain ISS.
View Article and Find Full Text PDFNanomaterials (Basel)
December 2024
Marine Engineering College, Dalian Maritime University, Dalian 116026, China.
Proton exchange membrane fuel cells (PEMFCs) are being pursued for applications in the maritime industry to meet stringent ship emissions regulations. Further basic research is needed to improve the performance of PEMFCs in marine environments. Assembly stress compresses the gas diffusion layer (GDL) beneath the ribs, significantly altering its pore structure and internal transport properties.
View Article and Find Full Text PDFJ R Soc Interface
December 2024
Université Grenoble Alpes, CNRS, LIPhy, Grenoble 38000, France.
Nitric oxide (NO) is an important vasodilator responsible for maintaining vascular tone in the human body. Its production in endothelial cells (ECs) is regulated by the rise of cytoplasmic Ca concentration and shear stress perceived by blood flow. The increase in cytoplasmic Ca concentration is mainly activated by adenosine triphosphate (ATP) released from red blood cells (RBCs) and ECs.
View Article and Find Full Text PDFPhys Rev E
November 2024
Graduate Aerospace Laboratories and Department of Applied Physics, California Institute of Technology, Pasadena, California 91125, USA.
Moment methods are often used to solve transport problems involving the Boltzmann-BGK equation. Because the moment equations are underdetermined, these methods require an additional "closure equation" that relates higher to lower-order moments. Here, we examine the closure equation and higher-order moment relations implicit in the lattice Boltzmann method (LBM) that use Gauss-Hermite quadrature for their discrete velocity sets.
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