Insights into Mechanism and Kinetics of Toluene Reactions with CH<sub>3</sub> Radicals: A Theoretical Study. [PDF]
Pham TV, Le TPT, Nguyen NT, Nam PC.
europepmc +1 more source
Building machine‐readable vocabularies for materials science is slow, expert‐driven work. This study benchmarks 13 large language models on two of its first steps: finding candidate terms in engineering articles and deciding where they belong in a class hierarchy.
Thomas Bjarsch +3 more
wiley +1 more source
Lithium isotope effects and magnetic interactions in flavin-ascorbyl radical pairs. [PDF]
Mouhamed A, Al-Khalili J, Sacchi M.
europepmc +1 more source
We develop a data‐driven method to derive the mathematical expressions of the Flory–Huggins interaction parameter χ for the swelling behavior of temperature–responsive hydrogels. Starting from initial assumptions of χ, our workflow combines Bayesian optimization, Flory–Rehner theory, and symbolic regression to generate candidate χ expressions.
Yawen Wang +2 more
wiley +1 more source
Simplified theory to predict contact ion pair formation in electrolyte mixtures containing hydroxylammonium nitrate. [PDF]
Shaw B.
europepmc +1 more source
Current Status and Challenges in Data Collection for Aerospace Coatings Deposited by Plasma Spraying
An innovative approach has been integrated into the GRENAT project to optimize plasma spraying and coating performance. Raw materials are accelerated and melted in the plasma generated by torches, creating coatings. Monitoring sensors collect process data which are combined with ex situ characterization data.
Lila Randriamananjara +8 more
wiley +1 more source
Modular Critical Element Recycling Platform Using a Nanoporous Additively Manufactured Gyroid
A modular recycling platform integrates 3D‐printed nanoporous gyroid structures to enable efficient critical element recovery. This system utilizes a hierarchical architecture, combining macroscopic channels with polymerization‐induced nanoscale porosity. By systematically tuning structural wall thickness and resin formulation, the platform achieves an
Xiangyu Gao +6 more
wiley +1 more source
Thermodynamic Basis of Paton's Rate Theory of Drug Action: Occupation Theory as Its Steady-State Limit. [PDF]
Raffa RB.
europepmc +1 more source
A novel workflow for investigating hydride vapor phase epitaxy for GaN bulk crystal growth is proposed. It combines Design of experiments (DoE) with physical simulations of mass transport and crystal growth kinetics, serving as an intermediate step between DoE and experiments.
J. Tomkovič +7 more
wiley +1 more source
Paper- vs. computer-based assessment in high-stakes testing: a common-person investigation of mode comparability. [PDF]
Kabasakal KA, Gündüz T.
europepmc +1 more source

