Designing High‐Entropy Alloys With Low Stacking Fault Energy Through Interpretable Machine Learning
In this study, we developed an interpretable machine learning (ML) ensemble framework and, by integrating the VEC criterion with the proposed machine learning scoring parameter in the alloy composition screening process, successfully designed multiple CoCrFeNiMn‐based HEAs with TWIP/TRIP effects and without the BCC phase.
Shuai Nie +6 more
wiley +1 more source
Hyper-Range Amorphization Unlocks Superior Damage Tolerance in Alloys. [PDF]
Du J +6 more
europepmc +1 more source
Molecular Dynamics Study of Melt Structure and Transport Properties of Mg‒Al Alloy
The structural evolution and transport coefficients of the Mg‐Al alloy melt at different temperatures were investigated using molecular dynamics simulation methods. By establishing relationships among structure, diffusion, and viscosity, the microscopic mechanisms behind the temperature‐induced changes in transport properties are revealed. ABSTRACT The
Lijun Zhang +7 more
wiley +1 more source
Dislocation analysis and structural characteristics of feal alloys under different heating rates using molecular dynamics simulation. [PDF]
Ridwan R, Sudarno S, Nuriana W.
europepmc +1 more source
Palladium nanocubes and nanoparticles supported on nanosheet‐assembled alumina (NA‐Al2O3) were investigated as highly efficient catalysts for the reduction of 4‐nitrophenol. Systematic comparisons highlight the roles of nanoparticle morphology and support structure, with PdNC@NA and PdNP@NA showing superior activity and stability over commercial Al2O3 ...
Nihal Chelampetty Para +2 more
wiley +1 more source
Development of a Machine Learning Interatomic Potential for Zirconium and Its Verification in Molecular Dynamics. [PDF]
Wan Y, Zhang X, Zhang L.
europepmc +1 more source
Electrolyte temperature significantly affects electrocatalyst performance in water splitting reactions. Catalysts synthesized by solution combustion synthesis were evaluated for oxygen evolution activity at different temperatures. Elevated temperatures reduced overpotential and increased current density, reflecting enhanced reaction kinetics and ...
Easwari Padma Kumari +3 more
wiley +1 more source
Exploring Patient, Parent and Clinician Views of Outcomes for Family-Centered Care in Neonatal Settings: A Qualitative Study. [PDF]
Kocakabak C +3 more
europepmc +1 more source
This paper presents a comprehensive overview of recent advancements in Joule‐heating synthesis of photo and electrocatalysts, emphasizing its benefits and applications. The objective is to offer an effective strategy for enhancing the diversity and performance of catalytic materials.
Jiaqi Li +4 more
wiley +1 more source
Unconventional phase metal heteronanostructures with tunable exposed interface for efficient tandem nitrate electroreduction to ammonia. [PDF]
Ma Y +23 more
europepmc +1 more source

