Computational Methods for Statistical Mechanics: Advances and Applications III
FOCUS · W48 · ID: 47176
Presentations
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Accelerated Monte Carlo sampling through non-reversibility and factorisation
ORAL · Invited
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Presenters
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Manon Michel
- Université Clemont – Auvergne
Authors
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Manon Michel
- Université Clemont – Auvergne
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Distribution of conductance in disordered mesoscopic systems
ORAL
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Presenters
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Kazi Alam
- University of Florida
Authors
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Kazi Alam
- University of Florida
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Khandker A Muttalib
- University of Florida
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Choosing the right event (in non-reversible event-chain Monte Carlo)
ORAL
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Publication: [1] P. Höllmer, N. Noirault, B. Li, A. C. Maggs, and W. Krauth, "Sparse hard-disk packings and local Markov chains", arXiv: 2109.13343 [cond-mat.stat-mech] (2020)
[2] P. Höllmer, A.C. Maggs, and W. Krauth, "Hard-sphere dipoles and non-reversible Markov chains" (2021), manuscript in preparation.Presenters
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Philipp Hoellmer
- University of Bonn
Authors
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Philipp Hoellmer
- University of Bonn
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Nicolas Noirault
- École normale supérieure de Paris
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Botao Li
- École normale supérieure de Paris
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A. C. Maggs
- ESPCI Paris
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Werner Krauth
- École normale supérieure de Paris
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<u>Axial Nucleus Density</u> for DFT, Symmetry Axis Rotating Toward Electron Clusters with ½, Zeta Related to Two Locked-at-180<sup>o</sup> Dirac Monopoles, Inter-dimensional Hemispherical (r<sub>#</sub>,θ<sub>#</sub>,φ<sub>#</sub>,z) Relativity Stress
ORAL
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Presenters
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Arno Vigen
- Independent researcher
Authors
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Arno Vigen
- Independent researcher
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Improved Estimators for Quantum Typicality
ORAL
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Presenters
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Phillip E Weinberg
- Northeastern University
Authors
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Phillip E Weinberg
- Northeastern University
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Rejection-Free Population Annealing and Frustrated Ising Models
ORAL
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Presenters
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Martin Weigel
- Tech Univ Chemnitz Zwickau
Authors
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Martin Weigel
- Tech Univ Chemnitz Zwickau
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Denis Gessert
- Coventry University
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Construction of CRSS model for sapphire with rate theory and molecular dynamic simulations
ORAL
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Presenters
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Yiyang Du
- University of Cincinnati
Authors
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Woo Kyun Kim
- University Of Cincinnati
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Yiyang Du
- University of Cincinnati
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Dalei Xi
- 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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Sangkee Min
- University of Wisconsin-Madison
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Computational studies of the glass-forming ability of binary alloys
ORAL
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Publication: 1. Yuan-Chao Hu, Jan Schroers, Mark D. Shattuck, and Corey S. O'Hern, Tuning the glass-forming ability of metallic glasses through energetic frustration, PHYSICAL REVIEW MATERIALS 3, 085602 (2019)
2. Yuan-Chao Hu, Kai Zhang, Sebastian A. Kube, Jan Schroers, Mark D. Shattuck, and Corey S. O'Hern, Glass formation in binary alloys with different atomic symmetries, PHYSICAL REVIEW MATERIALS 4, 105602 (2020)Presenters
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Yuan-Chao Hu
- Yale University
Authors
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Yuan-Chao Hu
- Yale University
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Jan Schroers
- Yale University
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Mark D Shattuck
- The City College of New York
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Corey S O'Hern
- Yale University
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Reversible and irreversible plastic events in a sheared amorphous solid - a mesoscopic approach
ORAL
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Publication: [1] M. Mungan, S. Sastry, K. Dahmen, and I. Regev, Phys. Rev. Lett. 123, 178002 (2019
[2] I. Regev, I. Attia, K. Dahmen, S. Sastry, and M. Mungan,Phys. Rev. E 103, 062614 (2021)
[3] K. Khirallah, B. Tyukodi, D. Vandembroucq, and C.E. Maloney, Phys. Rev. Lett. 126, 218005 (2021)
[4] D. Fernandez Castellanos, S. Roux and S. Patinet, Comptes-Rendus Physique, 22, 1 (2021)
Presenters
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Dheeraj Kumar
- Laboratoire PMMH, CNRS, ESPCI Paris PSL
Authors
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Dheeraj Kumar
- Laboratoire PMMH, CNRS, ESPCI Paris PSL
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Sylvain Patinet
- Laboratoire PMMH,
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Muhittin Mungan
- Univ Bonn
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Ido Regev
- Ben Gurion Univ Sede Boqer
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Pico-Scale Ideas for People-Scale Problems: Leveraging Molecular Simulation Tools for the Modeling of Urban Systems
ORAL
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Publication: Kelby B. Kramer and Gerald J. Wang, "Social distancing slows down steady dynamics in pedestrian flows," Physics of Fluids 33, 103318 (2021) https://doi.org/10.1063/5.0062331
Ryan Rusali and Gerald J. Wang, "High-Throughput Analysis of Urban Textures using Methods from Molecular Simulation," BuildSys '20: Proceedings of the 7th ACM International Conference on Systems for Energy-Efficient Buildings, Cities, and Transportation (2020) https://doi.org/10.1145/3408308.3427984Presenters
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Gerald J Wang
- Carnegie Mellon University
Authors
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Vincent M Cheng
- Carnegie Mellon University
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Kelby B Kramer
- Carnegie Mellon University
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Divya Rana
- IIT Delhi
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Ryan Rusali
- Carnegie Mellon University
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Diana L Warren
- Carnegie Mellon University
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Gerald J Wang
- Carnegie Mellon University
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Stereo-chemistry controlled mechanical properties of cross-linked Poly (N-isopropyl acrylamide) in aqueous medium using molecular simulations
ORAL
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Publication: under preparation research paper entitled: "Stereo-chemistry controlled mechanical properties of cross-linked Poly (N-isopropyl acrylamide) in aqueous medium using molecular simulations"
Presenters
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ehsan hosseinian
- University of Tehran
Authors
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sajjad arzemanzadeh
- University of Tehran
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Erfan Norouzi
- University of Tehran
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ehsan hosseinian
- University of Tehran
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Maryam Mahnama
- University of Tehran
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Not Saved by the Bell: Non-Gaussianity and Fluid Transport Measurements in Molecular-Dynamics Simulations
ORAL
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Presenters
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Yuanhao Li
- Carnegie Mellon University
Authors
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Yuanhao Li
- Carnegie Mellon University
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Gerald J Wang
- Carnegie Mellon University
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