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About this Symposium
Meeting 2025 TMS Annual Meeting & Exhibition
Symposium Hume-Rothery Symposium on Thermodynamics of Microstructure Stability and Evolution
Sponsorship TMS Structural Materials Division
TMS: Alloy Phases Committee
TMS: Computational Materials Science and Engineering Committee
TMS: Integrated Computational Materials Engineering Committee
TMS: Phase Transformations Committee
Organizer(s) Yunzhi Wang, Ohio State University
Wei Xiong, University of Pittsburgh
Jiamian Hu, University of Wisconsin Madison
Chuan Zhang, CompuTherm LLC
Scope This annual symposium is to honor the memory of a great pioneer in alloy thermodynamics and microstructures, William Hume-Rothery. According to Hume-Rothery, the stability of alloy phases and microstructures is critically dependent on the atomic sizes, the valency electron density, and electrochemical differences among the constituent atoms, described in a set of Hume-Rothery rules. These textbook Hume-Rothery rules have been very useful in providing guidelines for designing phase stability and microstructures not only of metallic alloys but also of ceramic and semiconductor alloys. The effects of atomic sizes, valence electron density, and electronegativity of atoms can be translated into the mechanical and chemical contributions to the thermodynamics of phases and microstructures. This invitation-only symposium will feature the 2025 TMS William Hume-Rothery awardee as an honored presenter and bring together experts in theory, computation, and experiments to discuss recent advances in understanding, predicting, and designing thermodynamic stability evolution of phases and microstructures in materials. Topics of interest include, but are not limited to:

(a) General theory and computational methodology developments for understanding and predicting the stability and evolution of phases and their microstructures
(b) Effect of atomic size mismatch on the thermodynamic stability of single and multiphase systems
(c) Strain/stress effect on phase and domain structure stability of bulk crystals and thin films
(d) Temperature-strain and temperature-strain-composition phase equilibria and phase diagrams
(e) Coherent versus incoherent phase equilibria, phase diagrams, and microstructures
(f) Phase and microstructure stability under external fields such as stress, electric, or magnetic fields

Abstracts Due 07/15/2024
Proceedings Plan Planned:
PRESENTATIONS APPROVED FOR THIS SYMPOSIUM INCLUDE

A mesoscale integrated model of microstructure evolution and property degradation in nuclear fuels
Accounting for the alloying effect in electrochemical equilibrium
Advanced Phase-Field Models of Solution Phases in CALPHAD Databases
An integrated simulation and experimental framework for investigating deformation mechanisms in alloys
Coherent Phase Stability and Short-Range Order in Multicomponent Systems
Connecting the atomic scale to phase field models
Critical Role of Internal Stresses in the Nucleation of Nanoscale Undercooled Melts at Solid-Solid Phase Interfaces
Direct Observation of the Atomic Scale Mechanism of Grain Rotation
Dynamical phase-field simulation of the THz light-matter interaction in ferroelectrics
Evolving Information Complexity of Coarsening Materials Microstructures
First-principles calculations of the Mg-Al phase diagram under hydrostratic pressure
Grain Selection Growth of Alkali metals in Electrochemical Processes: Thermodynamics and Phase-field Model
Guiding the design of microstructure and mechanical properties of alloys using integrated phase-field simulation
Harnessing Nano/Microstructures: Unlocking the Shape Memory and Ferroelastic Potential of Zirconia-based Ceramics
High-Temperature Dealloying in Molten Environments: Insights on Grain Boundary Effects from Phase-Field Modeling
High-Throughput and Systematic Study of Phase Transformations and Microstructure Evolution using Dual-Anneal Diffusion Multiples
Hydride Formation in Superconducting Q-Bits
Machine Learning Enhanced ICME Design for Alloy Development in Additive Manufacturing
Macroscopic energy barrier and thermodynamic hysteresis in magnetic shape memory alloys
Microscopic Modeling of Pre-Martensitic Phenomena: Complementary Perspectives from Bottom-Up and Top-Down Approaches
Microstructural Mechanisms of Performance and Degradation of Materials for Hydrogen Storage and Production – Mesoscale Modeling
Microstructure-Aware Bayesian Alloy Design
Microstructure evolutions in Ni-based superalloys under complex creep loadings
Multiphysics Microstructural Modeling with Mixed Inhomogeneous Boundary Conditions with Fourier Spectral Methods
Phase-field modeling of damage evolution in environmental barrier coating – ceramic matrix composite systems
Phase-field modeling of far-from-equilibrium solidification microstructures
Phase-field modeling of hydride behavior in the vicinity of grain boundary of Zr matrix.
Phase-field models, multiscale models and machine learning
Phase-Field Simulations of Microstructure Evolution: Application of PRISMS-PF for Complex Processing Conditions
Predicting Domain Structure and Switching in Ferroelectrics: Physics-Informed Machine Learning and Phase-field Modeling
Strain-induced phase separation and mesocrystal formation in refractory HEAs
Stress-induced reaction heterogeneity in battery electrodes
The development of phenomenological thermodynamic energies
Thermodynamics of strain phase equilibria and phase diagrams
Understanding Mechanical Tunability in Ba1-xSrxTiO3 Membrane by Phase-Field Simulation
Understanding the Impact of Applied Magnetic Fields on the Thermodynamic and Kinetic Behavior of Heat-Treated Steels
When grains go wild! Tracking the emergence and persistence of abnormal grain growth in the commercial aluminum alloy 5252
William Hume-Rothery Award Lecture: Thermodynamic Basis for the Phase-Field Method of Microstructure Stability and Evolution
Zentropy


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