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Meeting 2026 TMS Annual Meeting & Exhibition
Symposium Bridging Scales: Deformation and Damage Mechanisms in Microstructurally and Compositionally Complex Metallic Alloys
Presentation Title Multiscale insights into plastic deformation in phase-segregated ternary CCAs
Author(s) Xiang Chen
On-Site Speaker (Planned) Xiang Chen
Abstract Scope Motivated by the search for complex concentrated alloys (CCAs) suitable for friction stir welding, this study investigates dislocation-mediated plastic deformation in three ternary face-centered cubic (FCC) CCAs. First, molecular dynamics (MD) simulations, combined with the Monte Carlo algorithm and the nudged elastic band (NEB) method, are used to quantify lattice friction and interface resistance at the single-dislocation level across a range of temperatures. Both random and short-range-ordered CCAs are examined. Second, nano-pillar compression MD simulations are conducted to analyze stress–strain behavior alongside dislocation density evolution, offering additional insights into the role of long-range dislocation interactions in governing flow stress. Finally, thermodynamic principles are applied to develop a framework for bridging atomistic simulations with continuum-scale models.
Proceedings Inclusion? Planned:
Keywords Modeling and Simulation, Mechanical Properties, High-Entropy Alloys

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

A Compositionally Dependent Crystal Plasticity and Strength Model for High-Temperature Refractory Alloys
Bridging Atomistic and Mesoscale Models for Predicting Materials Response Under Radiation
Ductility mechanisms in complex concentrated refractory alloys from atomistic fracture simulations
Effect of heat treatment on the microstructure an irradiation response of MoNbTi based refractory MPEAs
Effect of void clustering and stress triaxiality on the ductile fracture of a high-entropy alloy
Enhanced Strength-Ductility in Ti-6Al-4V via Multi-Step Laser Surface Processing
Improved Low-Cycle Fatigue Resistance and Competing Deformation Mechanisms of Chemically Optimized FCC Multi-Principal Element Alloys
Kink Dynamics and Cross-Kink Effects in Screw Dislocation Migration of Refractory Complex Concentrated Alloys
Leveraging the strain glass microstructure in fcc chemically complex alloys
Mechanisms of Transformation and Recovery in TRIP-metastable High-Entropy Alloys revealed by in-situ heating and straining
Microstructural Stability of Re and Ru Modified A2 + B2 Refractory High Entropy Alloys
MICROSTRUCTURALLY DEFECT INDUCED HIGH STRAIN-RATE FAILURE MODES IN REFRACTORY ALLOYS
Multi-Scale Investigation of Strain Localization in Hot-Rolled Superelastic Nitinol
Multiscale insights into plastic deformation in phase-segregated ternary CCAs
On the Toughening Deformation Mechanisms in a NbTaTiHf Refractory HEA at Cryogenic and Room Temperatures
Physics Informed Machine Learning for Rapid Defect Characterization of Crystalline Materials
Predicting Failure in Metal Matrix Composites Using a Coupled Phase-Field and Crystal Plasticity Model
Simultaneous improvement of strength and ductility in additively manufactured Al-7Si-0.3Mg-0.5Cu-1Fe alloy
Stabilization of ordered phases in a Al0.3CoFeNi High Entropy Alloy Leading to Excellent Tensile Properties: Entropy versus Enthalpy
STEM Analysis of Dislocation-Precipitate Interactions in BCC+B2 Fe75Al15Ni10 at Room and Elevated Temperatures
Tailoring the Mechanical Behavior of FeCoNiCuB High-Entropy Alloys Through Microalloying
Temperature-dependent Deformation Mechanisms in Single-crystalline RMPEAs
Tensile Ductility and Plastic Deformation Behavior of Polycrystalline Refractory Multi-Principal Element Alloys

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