Finite Element Simulation of Hot Rolling for Large-Scale AISI 430 Ferritic Stainless-Steel Slabs Using Industrial Rolling Schedules-Part 1: Set-Up, Optimization, and Validation of Numerical Model. [PDF]
Ojeda-López A +4 more
europepmc +1 more source
Role of Wadsley Defects and Cation Disorder to Enhance MoNb12O33 Diffusion
Wadsley‐Roth niobates are high‐rate capable and durable anode materials for lithium‐ion batteries. Defect‐tailoring of MoNb12O33 is shown to substantially enhance lithium diffusion. Computational models were used to separate the effects of cation disorder and Wadsley defects to identify that both led to the occupation of fast diffusion sites at lower ...
CJ Sturgill +10 more
wiley +1 more source
Lower Extremity Splint Application. [PDF]
Shihab W, Denning J.
europepmc +1 more source
Spontaneous Perovskite Passivator Featuring Dual Functional Groups
A novel strategy to suppress multiple defect sites in perovskite crystals using a spontaneous passivator with dual functional groups is proposed, addressing an intrinsic drawback of conventional spontaneous perovskite passivators. 2‐thiophene‐ethyl‐ammonium‐bis(trifluoromethylsulfonyl)imide (TEA‐TFSI) is newly synthesized and successfully demonstrate ...
Naoyuki Nishimura +9 more
wiley +1 more source
Inhomogeneity in electronic phase and flat band in magnetic kagome metal Co<sub>3</sub>Sn<sub>2</sub>S<sub>2</sub>. [PDF]
Ekahana SA +8 more
europepmc +1 more source
All‐solid‐state batteries (ASSB) are promising for high‐energy applications. Using a newly designed electrochemical cell, this study demonstrates reversible Li+ insertion/extraction in a thick ASSB and enables operando neutron diffraction. The results reveal structural evolution and H1‐H2 phase coexistence in LiNi0.6Mn0.2Co0.2O2 (NMC622), while ...
Sreelakshmi Anil Kumar +7 more
wiley +1 more source
Triboelectric nanogenerators are vital for sustainable energy in future technologies such as wearables, implants, AI, ML, sensors and medical systems. This review highlights improved TENG neuromorphic devices with higher energy output, better stability, reduced power demands, scalable designs and lower costs.
Ruthran Rameshkumar +2 more
wiley +1 more source
Accelerating Catalyst Materials Discovery With Large Artificial Intelligence Models
AI‐empowered catalysis research via integrated database platform, universal machine learning interatomic potentials (MLIPs), and large language models (LLMs). ABSTRACT The integration of artificial intelligence (AI) into catalysis is fundamentally reshaping the research paradigm of catalyst discovery.
Di Zhang +7 more
wiley +2 more sources
Finite Element Simulation of Hot Rolling for Large-Scale AISI 430 Ferritic Stainless-Steel Slabs Using Industrial Rolling Schedules-Part 2: Simulation of the Roughing Stage and Comparison with Experimental Results. [PDF]
Ojeda-López A +4 more
europepmc +1 more source
This study introduces FIRE‐GNN, a force‐informed, relaxed equivariant graph neural network for predicting surface work functions and cleavage energies from slab structures. By incorporating surface‐normal symmetry breaking and machine learning interatomic potential‐derived force information, the approach achieves state‐of‐the‐art accuracy and enables ...
Circe Hsu +5 more
wiley +1 more source

