Results 151 to 160 of about 13,060,318 (232)

Physical Properties of Transition Metal Hydride Superconductors Mg2TmH6 (Tm = Rh, Pd, Ir, Pt) by First‐Principles Calculations

open access: yesAdvanced Physics Research, EarlyView.
The electronic band structure determines all the charge transport properties of crystalline solids. It also controls the optical response of the material. Bonding characters are strongly influenced by the band structure. The band structures of Mg2TmH6 (Tm = Rh, Pd, Ir, Pt) compounds shown above confirm their metallic nature.
Md Ashraful Alam   +3 more
wiley   +1 more source

Diffusion Coefficient and Viscosity of Methyl Viologen Electrolyte Estimation Based on a Kinetic Monte Carlo Computational Approach Coupled with the Mean Square Displacement Method

open access: yesBatteries &Supercaps, Volume 8, Issue 3, March 2025.
A novel and comprehensive 3D‐resolved kinetic Monte Carlo model coupled with mean square displacement analysis is introduced. This computational approach allows to explore, for the first time, the concentration and the state of charge effects on ionic diffusion coefficient and viscosity in methyl viologen‐based electrolytes used in organic redox flow ...
Jia Yu   +2 more
wiley   +1 more source

Electrospun Porous Materials for the Next‐Generation Proton Exchange Membrane Fuel Cells: Progress, Challenges, and AI‐Optimized Perspectives

open access: yesCarbon Energy, EarlyView.
Incorporating AI to optimize solution, process, and environment enables efficient prediction of structural properties and performance, allowing tailoring of GDL, CL, and PEM fabrication to guide PEMFC toward 9.0 kW L‒1 by 2040. ABSTRACT The performance and commercial viability of proton exchange membrane fuel cells (PEMFCs) are constrained by key ...
Shangfeng Jiang   +11 more
wiley   +1 more source

A Lattice Boltzmann Thermal Model for Predicting Melt Pool Geometry in Selective Laser Melting of AlSi10Mg and 316L Stainless Steel. [PDF]

open access: yesMaterials (Basel)
Guzmán-Nogales R   +6 more
europepmc   +1 more source

Strongly‐Anchored Ionomer‐Free Anode Catalyst Layer Fabricated via Joule Heating Achieves Efficient Electron/Mass Transfer for Acidic Water Electrolysis

open access: yesCarbon Energy, EarlyView.
An ionomer‐free anode catalyst layer is fabricated via rapid Joule heating, partially embedding IrO2 nanoparticles into the membrane to form a robust, anchored interface. This architecture eliminates ionomer‐induced poisoning and mass‐transport barriers, enabling efficient water‐mediated proton transport and electronic connectivity.
Yuyang Wang   +9 more
wiley   +1 more source

Investigating the Electrochemical Double Layer with Quantum‐Chemical Simulations and Implicit Solvation Models

open access: yesChemistry – A European Journal, EarlyView.
ESM‐RISM is applied to model electrochemical interfaces and benchmarked against Poisson–Boltzmann and molecular dynamics results. Density profiles, differential capacitance, and adsorption energetics at the gold–electrolyte interface are analyzed, highlighting the capabilities of this implicit electrolyte framework.
Alessandro Mangiameli   +1 more
wiley   +1 more source

Design of Solar Energy Harvesting Reactor From 2D to 3D Structures for Solar Thermal Conversion

open access: yesCarbon Innovation, EarlyView.
ABSTRACT Solar energy utilisation is pivotal for advancing sustainable and renewable energy solutions, yet the rational design of high‐efficiency photothermal conversion devices remains a critical challenge. This paper systematically examines the evolution of photothermal reactor architectures from two‐dimensional (2D) to 3D structures, emphasising ...
Haozhe Zhuang   +8 more
wiley   +1 more source

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