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Meeting 2025 TMS Annual Meeting & Exhibition
Symposium Structure-Property Relationships in Molecular Crystal Deformation
Presentation Title Molecular Crystals - A New Class in the Global Materials Space
Author(s) Panche Naumov
On-Site Speaker (Planned) Panche Naumov
Abstract Scope The adaptive molecular single crystals are gaining attention as a new class of materials for light, flexible, and environmentally friendly devices, particularly for memories, capacitors, sensors, and actuators. To be effective in high-efficiency energy storage devices, these dynamic materials need to exhibit strongly induced polarization, high switching field, and narrow hysteresis in reversible dynamic processes. However, molecular crystals, which have been predominantly studied by crystallographers, still lack thorough investigations to reliably evaluate their reproducibility, scalability, and actuating performance. This, along with certain drawbacks, has diverted the interest of engineers from these materials. Recently, under the term “crystal adaptronics”, research efforts aim to assess the suitability of dynamic crystals for applications that require fast, reversible, and continuous operation over prolonged periods of time. This lecture will discuss the most recent developments in the research of adaptive molecular crystals, highlighting their strengths and weaknesses based on our decade-long experience with these materials.
Proceedings Inclusion? Planned:
Keywords Electronic Materials, Mechanical Properties, Phase Transformations

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

A shocking look into the large single crystal energetics and their analogues
Advances in mesoscale modelling of highly filled composite explosives
Crystal structure prediction of energetic materials using Genarris and GAtor
Dislocation mediated plasticity in PETN: indentation and high-rate deformation
Elucidating Tabletability of Pharmaceutical Solids based on Plasticity Quantified by Nanoindentation
From Atoms to Constituent Models for Energetic Molecular Crystals
high-fidelity simulations of shock to detonation transition
Impact of Nanoindentation Tip Geometry on Orientation-Dependent Nanomechanical Behavior of PETN
In-situ Mechanical Characterization of Molecular Crystal Materials
Interconnections between High Explosive Mechanical Strength and Reactivity in the Buildup to Detonation
Mechanical Properties in Pharmaceutical Solid Oral Dosage Form Development: Bridging Molecular Interactions and Performance
Mechanical response of single crystal acetaminophen over an extended strain rate
Molecular Crystals - A New Class in the Global Materials Space
Multi-Scale Model For Describing The Thermo-Mechanical Behavior Of Polycrystalline Energetic System Subjected To Dynamic Loadings
Multiscale Modeling of Material Strength for the Shock-to-Detonation Behavior in Heterogeneous PETN
Organic Molecular Crystals as Explosive Simulants in Polymer Composites
Physical Aspects of Plasticity and Constitutive Modeling of Molecular Crystal HMX
Plasticity and heat conversion of energetic materials under different dynamic loading conditions
Quantitative Analysis of Granular Explosives through Examination of the Compaction Manufacturing Process
The onset of plasticity in molecular crystals during contact loading
The ultimate strength of plastic bonded explosives under uniaxial stress compression at strain-rates beyond 1000 /s
Understanding milling behavior of pharmaceutical crystals through quasistatic and dynamic mechanical testing
Understanding the correlation between mechanical properties, crystal structure and tabletability of pharmaceutical cocrystals
Using Terahertz Spectroscopy to Probe the Reactive Coordinates and the Mechanical Response of Crystalline Solids

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