Results 231 to 240 of about 508,080 (278)

Tuning Stability and Optoelectronic Properties of CsSnI3 Via Rare‐Earth Doping

open access: yesENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
Sn‐based halide perovskites are promising optoelectronic materials but are limited by poor stability. Thus, rare‐earth elements (RE) doping in CsSnI3 addresses this limitation, significantly enhancing thermodynamic, mechanical, and chemical stability, while simultaneously tuning electronic characteristics and modulating optical responses in the ...
Haowei Wang   +6 more
wiley   +1 more source

Electronic Structure Modulation in Dopant‐Controlled Single‐Atom Graphene Catalysts for Efficient Hydrogen Evolution: A Machine Learning and First‐Principles Study

open access: yesENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
First‐principles DFT calculations and machine learning analysis show that heteroatom doping of graphene (G) significantly enhances the stabilization of transition‐metal single atoms by strengthening metal–support interactions and increasing charge transfer. N‐doped G exhibits higher adsorption energies, lower d‐band centers, and shorter TM–G bonds than
Sajjad Ali   +3 more
wiley   +1 more source

Lattice Boltzmann simulation of deformable fluid-filled bodies: progress and perspectives.

open access: yesSoft Matter
Silva DPF   +5 more
europepmc   +1 more source

Lattices for the lattice Boltzmann method

Physical Review E, 2009
A recently introduced theory of higher-order lattice Boltzmann models [Chikatamarla and Karlin, Phys. Rev. Lett. 97, 190601 (2006)] is elaborated in detail. A general theory of the construction of lattice Boltzmann models as an approximation to the Boltzmann equation is presented.
Chikatamarla, S.S., Karlin, I.V.
openaire   +4 more sources

Exact Lattice Boltzmann Equation

Physical Review Letters, 2013
The lattice Boltzmann equation is derived from the Bhatnagar-Gross-Krook kinetic equation using the Euler-Maclaurin integration formula. Unlike previous attempts to connect the lattice Boltzmann method with the kinetic theory, the result is free of any relaxation-type approximation.
Bösch F, Karlin IV
openaire   +3 more sources

A Lattice Boltzmann Equation for Waves

Journal of Computational Physics, 2000
zbMATH Open Web Interface contents unavailable due to conflicting licenses.
Guangwu Yan
exaly   +3 more sources

Palabos: Parallel Lattice Boltzmann Solver

open access: yesComputers and Mathematics With Applications, 2021
zbMATH Open Web Interface contents unavailable due to conflicting licenses.
Federico Brogi   +2 more
exaly   +3 more sources

Theory of the lattice Boltzmann method: From the Boltzmann equation to the lattice Boltzmann equation

Physical Review E, 1997
In this paper, the lattice Boltzmann equation is directly derived from the Boltzmann equation. It is shown that the lattice Boltzmann equation is a special discretized form of the Boltzmann equation. Various approximations for the discretization of the Boltzmann equation in both time and phase space are discussed in detail.
Xiaoyi He, Li-Shi Luo
openaire   +1 more source

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