All Articles

Farthest point sampling in property designated chemical feature space as an effective strategy for enhancing the machine learning model performance for small scale chemical dataset

Effects of nonlinearity and inter-feature coupling in machine learning studies of Nb alloys with center-environment features

Exploring generic fractions of multi-origin asphalts and revisiting the linkage to their bulk properties via machine learning

Machine learning-enabled optoelectronic material discovery: a comprehensive review

Active learning-based generative design of halogen-free flame-retardant polymeric composites

Neuroevolution potential for thermal transport in silicon carbide

Hot deformation behavior investigation of heat-resistant aluminum matrix composite based on Arrhenius model and machine learning

Phase-field-informed machine learning on creep behavior of Ni-based single-crystal superalloys

Effect of material properties on the thermal responses of the carbonization and pyrolysis layers of polymer matrix composites for charring-ablators

Accelerated discovery of high-performance small-molecule hole transport materials via molecular splicing, high-throughput screening, and machine learning

Symbolic regression accelerates the discovery of quantitative relationships in rubber material aging

Uncertainty aware design space modeling for sample efficiency in material design of bainitic steels

FT²DP: large atomic model fine-tuned machine learning potential for accelerating atomistic simulation of iron-based Fischer-Tropsch synthesis

Multi-objective optimization in machine learning assisted materials design and discovery

How AI guided the development of green hydrogen production: in the case of solid oxide electrolysis cell?

Design of high energy storage ferroelectric materials by phase-field simulations

Deep learning for enhanced porosity detection in AZ91 magnesium alloys using windowed perception and aggregated sensing

Prediction of thermal conductivity in multi-component magnesium alloys based on machine learning and multiscale computation