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About this Symposium

Meeting 2026 TMS Annual Meeting & Exhibition
Symposium Energy Technology 2026: Advancement in Energy Materials - Theory, Simulation, Characterization, Application
Sponsorship TMS Extraction and Processing Division
TMS: Energy Committee
TMS: Process Technology and Modeling Committee
Organizer(s) Wenwen Song, University of Kassel
Chukwunwike Iloeje, Argonne National Laboratory
Donna P. Guillen, Idaho National Laboratory
Neale R. Neelameggham, IND LLC
Lei Zhang, University of Alaska Fairbanks
Shafiq Alam, University of Saskatchewan
Fiseha Tesfaye, Metso Metals Oy; Åbo Akademi University
Srujan Rokkam, Advanced Cooling Technologies, Inc.
Eric Detsi, University of Pennsylvania
Scope With the increasing global focus on transitioning to sustainable and efficient energy systems, energy materials have become a foundation for enabling advanced energy technologies. This symposium focuses on recent breakthroughs in the development, understanding, and application of energy materials across diverse fields, including energy generation, storage, and conversion. Topics of interest include fundamental research on the design and optimization of energy materials through computational and theoretical approaches, multi-scale modelling, and advanced characterization techniques. This symposium aims to bring together a multidisciplinary community of researchers and engineers working on the cutting edge of energy materials. It will provide a collaborative platform for sharing knowledge, exchanging innovative ideas, and discussing methodologies to tackle current challenges in the field. By fostering dialogue across theory, experiment, and application, the symposium seeks to inspire novel approaches to accelerate advancements in energy materials for a sustainable future.

Exemplary topics at the symposium include but are not limited to:
• Theoretical approaches for energy materials design, including density functional theory (DFT), molecular dynamics (MD), and thermodynamic modeling, to predict the properties and behavior of energy materials. Insights into atomic structures, defect energetics, and phase stability enable the design of materials tailored for specific energy applications, such as batteries, fuel cells.
• Multiscale simulations for energy materials design and property prediction, covering quantum, atomistic, mesoscale, and continuum levels.
• Advanced characterization techniques for energy materials, including in-situ/ex-situ synchrotron X-ray diffraction, in-situ/ex-situ neutron scattering, microscopic analysis, atom probe tomography etc., which reveals micro- to nano scale features and dynamic structural and chemical changes during energy generation, storage, and conversion processes.
• Development of functional energy materials. This topic focuses on the development and application of advanced materials for energy storage (e.g. batteries, supercapacitors, and hydrogen storage) and energy conversion (e.g. fuel cells, solar cells, and thermoelectrics). Emphasis is placed on optimizing material properties, including conductivity, stability, and efficiency, for integration into sustainable energy technologies.
• Interface and surface engineering in energy materials, e.g. materials science technology to modify interface characteristics, segregation control, coating technology, to enhance energy efficiency and materials durability.
• Data-driven design and machine learning in energy materials. This topic highlights the use of data-driven approaches to analyze experimental and simulation data, predict material properties, and explore to develop next-generation energy materials.
• Applications of energy materials in sustainable technologies.

Note regarding publication: Authors seeking an oral presentation opportunity must submit a manuscript for the Energy Technology proceedings or be accepted for publication in a TMS journal.

Abstracts Due 07/25/2025
Proceedings Plan Planned:

PRESENTATIONS APPROVED FOR THIS SYMPOSIUM INCLUDE


Application of DFT Simulation to the Investigation of Hydrogen-Material Interaction and Design of High Strength Low Alloy Steel
Atomistic Insight into Planar Condensates of Mg atoms in GaN Films from Empirical Molecular Dynamics Simulations.
Chemical bonding analysis and thermochemistry as tools to understand the structure and properties of magnetocaloric materials for solid-state refrigeration
Defective Metal–Organic Framework for CO₂ Capture
Design and Optimization of Hydrogen-Resistant Steels Based on First-Principles Calculations and Machine Learning
Dynamic strain ageing of L12-strengthened Ni-Co base high-entropy alloy and unraveling its deformation mechanisms in strain ageing process
Effects of TiO2 andMnO2 on the Hydrogen Desorption of Mechanically milled MgH2
Electrochemical Co-Deposition as a Reproducible Platform for Observing and Analyzing Energetic Particle Generation in the Metal Deuterium System
Enhanced strength and ductility of medium Mn steels via multi-microalloying and its hydrogen embrittlement resistance
Explainable Inverse Design of Battery Materials via Multi-Model Learning and Conditional Filtering
Functionalized Magnesium Nanoparticles for Controlled Energy Release
Investigation of High-Purity Li2S Production From Li2SO4 and LiOH Using H2S Gas
Machine learning-enhanced tomographic analysis of L12-type chemical short-range ordering in compositionally-complex alloys
Materials Design for Lithium Argyrodite Solid Electrolytes Enabled by Machine-Learned Interatomic Potentials
Mechanically Reinforced Ion-Regulating Nanofibril Binder Accelerating Ion Transport in Thick LiFePO₄ Electrodes
Phase Equilibria and Thermodynamic Properties of Functional Chalcogenides in the Ag–Pd–Ge–S System
Phonon Dynamics and Thermal Transport in Tl3VSe4
Probing the Nonequilibrium Phonon Dynamics in W and W-Re Alloys with Irradiation-Induced Defects
Structural alloys and their embrittlement in hydrogen transport
Thermally Induced Interfacial Improvements in Solid Polymer Electrolytes
Twin-twin interactions in high Mn steels for LNG tank building
Ultra-conductors: A new paradigm in energy transmission
Unveiling the atomistic mechanism of oxide scale spalling in heat-resistant alloys


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