ScienceDirect Publication: Acta Materialia rss.sciencedirect.com

Uncertainty-aware machine learning framework for predicting dislocation plasticity and stress–strain response in metallic alloys, Part II: BCC systems

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Data-driven quantification of grain boundary structures and their correlation with migration kinetics

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Unveiling the Role of Co Single atoms on the Local Coordination States and Photo-Induced Electronic Shifts in Nb 2 O 5

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Atomistic modeling of polymorphism in iron using an explicitly magnetic machine-learned interatomic potential

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Compatibilities and supercompatibility conditions in shape memory alloys determined from correspondence, metrics and symmetries

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Current density dependence of cation diffusion in Er 2 O 3 /Y 2 O 3 diffusion couple under AC-flash events

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Hierarchical Polysulfide Management via a Core-Shell Host: Simultaneous Trapping, Catalyzing, and Buffering for High-Energy Lithium Sulfur Batteries

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Bayesian Conditional Generation of Porous Media Using Dynamic Surrogate and Generative Models

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Shear-Coupled Migration Governed by Misorientation Angles and Atomistic Structures in [1 1 0] Symmetric Tilt Grain Boundaries of Face-Centered-Cubic Pt

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Self-healing by amorphous shear-band recovery in crystalline Al-Sm materials

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Electric-Field-Modulated Luminescence in Highly Stable and Transparent Er-Doped PMN-PT Crystals

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Segregation-Controlled Diffusion-Induced Grain Boundary Migration in Alloy 690

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Advanced single-atom Fe catalysts via sulfur-mediated spin engineering for high-performance Zn-air batteries

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Inclination-dependent shear-coupling and energy anisotropy in FCC tilt grain boundaries

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Coupled influence of structural relaxation and compositional complexity on deformation behavior and intermittent plasticity in Cu-Zr-based metallic glasses

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Phase-Dependent First-Principles Prediction of Pressure-Composition Isotherms in Yttrium- and Zirconium-Based Metal Hydrides

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Spatial Distributions of Grain Boundary Segregation – A Combined Atom Probe and Atomistic Simulation Study

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A new cracking criterion for additive manufacturing and repair of Ni-based superalloys via laser directed energy deposition

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Internal Architecture and Multiple Structural Transformations of Large-Height Stacking Faults in 4H-SiC Trapezoidal Defects

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F-mediated dynamic electronic regulation via CoF 2 reservoir enables high-valence Ni for enhanced oxygen evolution

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