Matter under Extreme Conditions III
ORAL · S59 · ID: 1067992
Presentations
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Phase-Field Modeling and Peridynamics for Defect Dynamics, and an Augmented Phase-Field Model with Viscous Stresses
ORAL
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Publication: Chua, J., Agrawal, V., Breitzman, T., Gazonas, G., Dayal, K., "Phase-field modeling and peridynamics for defect dynamics, and an augmented phase-field model with viscous stresses.", Journal of the Mechanics and Physics of Solids, 2021, DOI:10.1016/j.jmps.2021.104716
Presenters
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Janel Chua
- Carnegie Mellon University
Authors
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Janel Chua
- Carnegie Mellon University
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“Research output software for energetic materials based on observational modelling/ machine learning” (RoseBoom<sup>©</sup>)
ORAL
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Publication: Published:
Wahler, S., Klapötke, T. M., Mater. Adv. 2022, DOI 10.1039/D2MA00502F.
Klapötke, T. M., Wahler, S., Cent. Eur. J. Energ. Mater. 2022, 19, 295–310. DOI 10.22211/cejem/155004
Submitted:
Wahler, S., Klapötke, T. M., Comparison of the implemented detonation velocity predictions in the Research output software for energetic materials based on observational modelling (RoseBoom©) to 30 experimental values, 2022, submitted Manuscript
Wahler, S., Klapötke, T. M., RoseBoom's RoseHybrid©-values for the heat of formation adjusted for Ionic Molecules, 2022, submitted Manuscript
Wahler, S., Klapötke, T. M., The predictions of RoseBoom2.2© without the input of any data received from experiments or composite methods, 2022, submitted Manuscript
Wahler, S., Klapötke, T. M., Comparison of the 478 specific impulses calculated with the ISPBKW code and 2 different empirical relationships encoded into RoseBoom©, submitted Manuscript
Planned:
Wahler, S., Klapötke, T. M., Chung, P. Implementing Machine Learning models for prediction of the enthalpy of formation, sublimation and vaporization of new compounds.
Wahler, S., Klapötke, T. M., Chung, P. Empirical Models vs. Machine Learning Models for the prediction of the density of energetic compounds.Presenters
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Sabrina Wahler
- LMU Munich, RoseExplosive UG
Authors
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Sabrina Wahler
- LMU Munich, RoseExplosive UG
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Uncertainty propagation in the equation-of-state model for gold
ORAL
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Publication: Uncertainty propagation in Errors-in-Variables equation-of-state models
Presenters
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Lin H Yang
- Lawrence Livermore Natl Lab
Authors
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Lin H Yang
- Lawrence Livermore Natl Lab
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First-Principles Modeling of Structural and Mechanical Properties of High-Entropy Borides
ORAL
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Publication: Bria Storr and Luke Moore et al., APL Materials 10, 061109 (2022); https://doi.org/10.1063/5.0098276
Presenters
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Luke C Moore
- University of Alabama at Birmingham
Authors
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Luke C Moore
- University of Alabama at Birmingham
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Bria C Storr
- University of Alabama at Birmingham
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Shane A Catledge
- University of Alabama at Birmingham
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Yogesh K Vohra
- University of Alabama at Birmingham
- Department of Physics, University of Alabama at Birmingham, Birmingham, AL, 35294, USA
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Cheng-Chien Chen
- University of Alabama at Birmingham
- University of Alabama at Birmingham, Birmingham, Alabama, USA
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Synthesis of Nitrogen Doped Graphene via Gas Phase Explosive Synthesis
ORAL
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Presenters
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Everett V Baker
- Missouri University of Science and Technology
Authors
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Everett V Baker
- Missouri University of Science and Technology
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William G Fahrenholtz
- Missouri University of Science and Technology
- Materials Science and Engineering, Missouri University of Science and Technology
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Jeremy L Watts
- Missouri University of Science and Technology
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Catherine E Johnson
- Missouri University of Science & Technology
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Sean Bailey
- Missouri University of Science and Technology
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Suppression of superconducting transition temperature in MoB<sub>2</sub> via niobium substitution
ORAL
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Presenters
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Shubham Sinha
- University of Florida
Authors
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Shubham Sinha
- University of Florida
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Jinhyuk Lim
- University of Florida
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Ajinkya C Hire
- University of Florida
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Jung S Kim
- University of Florida
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Philip M Dee
- University of Florida
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Ravhi Kumar
- University of Illinois at Chicago
- University of Illinois Chicago
- Department of Physics, University of Illinois Chicago, 845, W. Taylor Street, Chicago, IL 60607
- University of Illinois, Chicago
- Department of Physics, University of Illinois at Chicago
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Dmitry Popov
- Argonne National Laboratory
- HPCAT, X-ray Science Division, Argonne National Laboratory
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Russell J Hemley
- University of Illinois at Chicago
- University of Illinois Chicago
- Departments of Physics, Chemistry, and Earth and Environmental Sciences, University of Illinois Chicago
- Department of Physics and Chemistry, University of Illinois Chicago, 845, W. Taylor Street, Chicago, IL 60607
- Departments of Physics, Chemistry, and Earth and Environmental Sciences, University of Illinois at Chicago
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Richard G Hennig
- University of Florida
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Peter Hirschfeld
- University of Florida
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Gregory R Stewart
- University of Florida
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James J Hamlin
- University of Florida
- Dept. of Physics, University of Florida
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Tuning high-strain rate deformation of self-assembled block copolymers
ORAL
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Presenters
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Hongkyu Eoh
- Texas A&M University
Authors
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Hongkyu Eoh
- Texas A&M University
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Jinho Hyon
- Agency for Defense Development, South Korea
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Edwin L Thomas
- Texas A&M University
- Texas A & M University
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Ab initio calculations of the melting line of MgSiO<sub>3</sub> and Fe
ORAL
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Presenters
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Felipe J Gonzalez
- University of California, Berkeley
Authors
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Felipe J Gonzalez
- University of California, Berkeley
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Burkhard Militzer
- University of California, Berkeley
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Computing equilibrium properties by a dissipative non-equilibrium process
ORAL
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Presenters
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Kangxin Liu
- New York University
Authors
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Kangxin Liu
- New York University
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Grant M Rotskoff
- Stanford Univ
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Eric Vanden-Eijnden
- New York University
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Glen M Hocky
- New York University (NYU)
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Effects of Thin Film Coating on Ultra-Precision Machining of Single-Crystalline Sapphire
ORAL
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Presenters
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Dalei Xi
- University of Cincinnati
Authors
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Dalei Xi
- University of Cincinnati
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Yiyang Du
- University of Cincinnati
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Aditya Nagaraj
- University of Wisconsin, Madison
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Suk Bum Kwon
- University of Wisconsin, Madison
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Dae Nyoung Kim
- University of Wisconsin, Madison
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Sangkee Min
- University of Wisconsin, Madison
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Woo Kyun Kim
- University Of Cincinnati
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Discovering Quantum Phase Transitions with Fermionic Neural Networks
ORAL
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Publication: Discovering Quantum Phase Transitions with Fermionic Neural Networks (submitted to PRL)
Presenters
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Gino W Cassella
- Imperial College London
Authors
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Gino W Cassella
- Imperial College London
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Halvard Sutterud
- Imperial College London
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Sam Azadi
- University of Oxford
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Neil Drummond
- University of Lancaster
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David Pfau
- Deepmind
- DeepMind
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James Spencer
- Deepmind
- DeepMind
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W Matthew C Foulkes
- Imperial College London
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Cross-sectional Scanning Tunneling Microscopy on clean m-plane GaN and Ga vacancy identification
ORAL
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Publication: Atomically resolved study of the unpinned GaN (10 ¯10) surface by Cross-sectional Scanning Tunneling Microscopy
Presenters
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Edoardo G Banfi
- Eindhoven Technical University
Authors
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Edoardo G Banfi
- Eindhoven Technical University
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Tomas J.F. Verstijnen
- Eindhoven Technical University
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Michael E Flatté
- University of Iowa
- Department of Physics and Astronomy, University of Iowa, IA 52242, USA
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Eva Monroy
- Univ. Grenoble-Alpes
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Paul M Koenraad
- Eindhoven University of Technology
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