Results 181 to 190 of about 13,060,318 (232)

Nonlinear Carrier Dynamics and Optical Response of Lanthanum-Doped Barium Stannate. [PDF]

Nanomaterials (Basel)
Babicheva VE, Kim H, Lock EH.
europepmc   +1 more source

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

ENERGY &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, Pir Muhammad Ismail, Muhammad Humayun, Mohamed Bououdina   +3 more
wiley   +1 more source

Physics-informed convolutional neural networks for fluid flow through porous media. [PDF]

Sci Rep
Topolnicki R, Dłotko P, Matyka M.
europepmc   +1 more source

Machine Learning Unveils Isolated‐Surrounded Pt Motifs in High‐Entropy Alloys for Superior Low‐Temperature Ammonia Oxidation

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
A physics‐informed machine learning approach successfully decodes the complex catalytic activity of high‐entropy alloys for ammonia oxidation. By revealing a synergistic mechanism involving lattice and electronic couplings, the study identifies a superior “isolated‐surrounded” platinum motif.
Shangfeng Jiang, Ting Tao, Kexiang Guo, Xinyu Fan, Xu Zhang, Zhen Zhou   +5 more
wiley   +1 more source

Nickel Coarsening and Mass Transfer Performance Prediction in Direct Internal Reforming Solid Oxide Fuel Cells. [PDF]

Nanomaterials (Basel)
Yang X, Yang G, Wang H, Sun H, Xu Z, Ji S.   +5 more
europepmc   +1 more source

Highly Conductive Networks Encapsulated Borohydride Electrolytes Enabling Superior High Rate Performance for All‐Solid‐State Li‐Ion Batteries

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
A nanoscale ZrB2/LiCl network encapsulated LiBH4 solid electrolyte was prepared by mechanically reacting LiBH4 with ZrCl4. Such a composite solid electrolyte exhibits fast ionic conduction and high critical current density. More importantly, the resultant solid electrolyte enables unprecedented cyclability of Li|LiNbO3@LiCoO2 and Li|TiS2 full cells at ...
Shuyang Sun, Ruizi Wang, Yongfeng Liu, Xin Zhang, Lanxun Li, Wanyue Cai, Zhenguo Huang, Wenping Sun, Mingxia Gao, Hongge Pan   +9 more
wiley   +1 more source

MXene‐Induced Selective Ion Separation in Capacitive Deionization: Bridging Fundamentals With Frontier Innovations

Electron, EarlyView.
This review presents an in‐depth analysis of employing the MXenes electrodes in advancing ion‐selective capacitive deionization technologies, by exploring various strategies to achieve the desired selectivity. It highlights the critical challenges that hinder scalability and practical implementation. The review showcases the future opportunities toward
Rahat Alam, Linda Zou, Louis C. P. M. de Smet, Constantinos V. Chrysikopoulos   +3 more
wiley   +1 more source

Three-Dimensional Digital Model Reconstruction and Seepage Characteristic Analysis of Porous Polyimide. [PDF]

Polymers (Basel)
Dou Z, Li S, Chen W, Yang Y, Yan H, Si L, Chen Q, An K, Li H, Liu F.   +9 more
europepmc   +1 more source

On the Variability of Results for Cylinder Flow: A Systematic Analysis of Parameter Sensitivity Within the Lattice Boltzmann Method

International Journal for Numerical Methods in Fluids, EarlyView.
This study systematically investigates the variability of cylinder flow results. We provide a comprehensive overview of literature values and, using the lattice Boltzmann method (LBM), show that insufficient convergence studies and variations in simulation parameters are a plausible cause for the significant spread in data.
Maximilian Bille, Mario C. Bedrunka, Philipp Spelten, Holger Foysi, Dirk Reith   +4 more
wiley   +1 more source

Atomistic characterization of the maturation mechanisms in the HIV-1 capsid domain. [PDF]

Nat Commun
Cannistra C, Wang E, Lee EMY, Yu A.
europepmc   +1 more source