Machine Learning, Molecular Dynamics and Excitons II
FOCUS · VIR-K03 · ID: 3105184
Presentations
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Data-Driven and Algorithmic Acceleration of Excited-State Dynamics: from Attosecond Electronic Excitations to Picosecond Phonon Thermalization
ORAL · Invited
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Publication: [1] I. Maliyov, J. Yin, J. Yao, C. Yang, M. Bernardi, "Dynamic mode decomposition of nonequilibrium electron-phonon dynamics:<br>accelerating the first-principles real-time Boltzmann equation.", npj Computational Materials 2024, 10, 123<br>[2] J. Yao, I. Maliyov, D. Gardner, C. Woodward, M. Bernardi, "Advancing Simulations of Coupled Electron and Phonon Nonequilibrium Dynamics Using Adaptive and Multirate Time Integration", in preparation<br>[3] I. Maliyov, F. Bruneval, "High-order dynamic mode decomposition of excited electron dynamics within RT-TDDFT", in preparation
Presenters
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Ivan Maliyov
EPFL, CNRS, Aix-Marseille Universite, Caltech
Authors
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Ivan Maliyov
EPFL, CNRS, Aix-Marseille Universite, Caltech
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Harnessing Active Learning with Machine Learning Potentials to Investigate Deactivation Mechanisms in Transition Metal-Doped Alumina Catalysts
ORAL
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Presenters
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Anshuman Kumar
University of California, Davis, Indian Inst of Tech-Bombay
Authors
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Anshuman Kumar
University of California, Davis, Indian Inst of Tech-Bombay
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Ambarish Kulkarni
University of California, Davis
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Investigating Radiation Damage at a Solid-Liquid interface due to Neutron Irradiation using Molecular Dynamics
ORAL
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Presenters
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Jeet Shannigrahi
University of British Columbia
Authors
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Jeet Shannigrahi
University of British Columbia
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Akseli Aro
Department of Applied Physics, Aalto University
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Antoine Clement
Department of Applied Physics, Aalto University
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Andrea E Sand
Department of Applied Physics, Aalto University
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Large-scale atomistic simulation of high entropy alloys with graph neural networks
ORAL
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Publication: 1. Advancing atomistic simulation of high entropy alloy with graph neural networks; Dengdong Fang, Xianglin Liu*, Zongrui Pei, Fanli Zhou, Yongxiang Liu, Kai Yang, Pengxiang Xu*, and Yonghong Tian; Submitted, 2024<br>2. Machine learning for high-entropy alloys: Progress, challenges and opportunities; Xianglin Liu, Jiaxin Zhang, Zongrui Pei; Progress in Materials Science, 131, 2023
Presenters
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Xianglin Liu
Pengcheng Laboratory
Authors
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Xianglin Liu
Pengcheng Laboratory
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Dengdong Fang
Pengcheng Laboratory
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Zongrui Pei
New York University
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Fanli Zhou
Xiangnan University
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Yongxiang Liu
Pengcheng Laboratory
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Yonghong Tian
Peking University
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Pengxiang Xu
Pengcheng Laboratory
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Kai Yang
Pengcheng Laboratory
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Abstract Withdrawn
ORAL Withdrawn
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Abstract Withdrawn
ORAL Withdrawn
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On the Topological Aspects of the Universal Intelligence: The necessary and sufficient conditions for detectability processes of the possibility of extraterrestrial intelligence topology from the Earth's physical boundary conditions' frame mechanisms
ORAL
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Publication: 1-T. Şengör, "The Spontaneously Fields and Wave Propagation Providing the Possible Self-Sourced Variations and the Most Elementary Structures: The Inflective Photon, the Vortex Photon, and the Sourced Photon with the Torsionally Inflective Spaces and Coordinates," (invited), 2024 4th URSI Atlantic Radio Science Meeting (AT-RASC), Meloneras, Spain, 2024, pp. 1-4, doi: 10.46620/URSIATRASC24/ORNU5679.<br>keywords: {Boundary value problems;Propagation;Mathematical models;Trajectory;Photonics} (presented).<br>2-T. Sengor, The Inflective Coordinates, Spaces, and Waves, International Short Course34th URSI GASS, 28 August- 4 September 2021, Rome, Italy (presented).<br>3-T. Sengor, "Self-generation processes as stochastically embedded building mechanisms generating complex molecular chains and simple biological structures from single point spaces: Upgrading origin to both simple particle communities from simplest particles and livable simplest cells from complex molecular chains," APS March Meeting 2023 (presented).<br>4-T. Sengor, "Inflective Spaces: Contribution into the Physical Truth," (invited), 2019 URSI International Symposium on Electromagnetic Theory (EMTS), 2019, pp. 1-4, doi: 10.23919/URSI-EMTS.2019.8931478. https://ieeexplore.ieee.org/document/8931478 (presented).<br>5-T. Sengor, "The Quantum Electromagnetism and Gravity Waves in Inflective Spaces with Topological Transformations of De-formations and Re-formations: Designing an Elementary Particle," 2021 XXXIVth General Assembly and Scientific Symposium of the International Union of Radio Science (URSI GASS), 2021, pp. 1-4, doi:10.23919/URSIGASS51995.2021.9560637. https://ieeexplore.ieee.org/abstract/document/9560637 (presented).<br>6-T. Sengor, "Topological processes building ingredients of the most simple available particles, gravity, and electromagnetism from null space: Time energy concept as creater of waves and particles by single point space," APS April Meeting 2022, https://meetings.aps.org/Meeting/APR22/Session/K17.33 (presented).<br>7-T. Sengor, "The self-controlling mechanisms in natural processes, events, ingredients, and behaviors," APS April Meeting 2022, https://meetings.aps.org/Meeting/APR22/Session/K17.32 (presented).<br>8-T. Sengor, "Spontaneous generation and propagation capabilities as pseudoembedded but stochastically communication and intelligence like mechanisms in complex exotic molecular chains: CI-in-CEMCs," APS March Meeting 2022, https://meetings.aps.org/Meeting/MAR22/Session/G66.15 (presented).<br>9-T. Sengor, "The Universally Compact Multi-Networks Bundle of the Nature: the clustering machinery approachable self-controlling and self-building mechanisms in natural processes, physical universes, and their ingredients," APS April Meeting 2023, https://meetings.aps.org/Meeting/APR23/ (presented).<br>10-T. Sengor, "The Inflective Coordinates, Spaces, and Quantum Fields and Waves," APS April Meeting 2023, https://meetings.aps.org/Meeting/APR23/ (presented).<br>11-T. Sengor, "On the Availability of Absorbing Single Photon from Perfectly Absolute Vacuum: A way stabilizing quantum fluctuations," APS March Meeting 2023, https://meetings.aps.org/Meeting/MAR23/Session/TT10.7 (presented).<br>12-T. Sengor, "The Globally Compact Multi-Network of the Earth: the self-controlling mechanisms in natural hazards above significant level," Geophysical Research Abstracts, Vol. 21, EGU2019-17127,2019, General Assembly 2019, Vienna, Austria, 7-12 April 2019, https://meetingorganizer.copernicus.org/EGU2019/EGU2019-17127.html (presented).<br>13-T. Sengor, "Introduction to TTs Guided by Null-to-Wave-to-Particle Deformations: inflective wave functions of a single point space," in Abstracts of PIERS Rome, Italy, 17– 20 June 2019 (presented).<br>14-T. Sengor, "Topological Ingredients of Single Point Spaces: the phases of nonexistence to existence passages for null space to thing space," in Abstracts of PIERS Rome, Italy, 17– 20 June 2019 (presented).<br>15-T. Sengor, "Topological Decompositions of Single Point Spaces and Null Spaces: creation phase of light at early universes," in Abstracts of PIERS Rome, Italy, 17– 20 June 2019 (presented).<br>16-T. Sengor, " The self-controlling mechanisms in natural processes, events, ingredients, and behaviors," APS April Meeting 2022 (presented).<br>17-T. Sengor, "The State Space Model for Atomic Interactions," Invited Paper, PIERS 2013 in Stockholm, Progress in Electromagnetics Research Symposium, Stockholm, Sweden, 12 -15 August 2013 (presented). <br>18-T. Sengor, " Quantum Electrodynamical Interaction Mechanisms in Simple Atoms," INVITED PAPER, Proceedings of Progress In Electromagnetics Research Symposium, PIERS 2012 in Moscow (Rusya), Aug. 19-23, 2012 (presented). <br>19- T. Sengor, "Analytical classification of time and frequency dependence basics in dielectric materials," Helsinki University of Technology, Electromagnetics Lab. Report 344, Nov. 2000, ISBN 951-22-5258-9, ISSN 1456-632X.<br>20-T. Sengor, "Wave equation and solution in time varying and frequency dependent medium: plane case," Helsinki University of Technology, Electromagnetics Lab. Report 347, Dec. 2000, ISBN 951-22-5274-0, ISSN 1456-632X.<br>21-T. Sengor, "Wave equation and solution in time varying and frequency dependent medium: circularly cylindrical case," Helsinki University of Technology, Electromagnetics Lab. Report 349, Jan. 2001, ISBN 951-22-5333-X, ISSN 1456-632X. <br>22-T. Sengor, "Static field near inflection points," Helsinki University of Technology, Electromagnetics Lab. Report 350, Jan. 2001, ISBN 951-22-5349-6, ISSN 1456-632X.<br>23-T. Sengor, "Waves near inflection points," Helsinki University of Technology, Electromagnetics Lab. Report 351, Jan. 2001, ISBN 951-22-5350-X, ISSN 1456-632X.<br>24-T. Sengor, "Time and frequency dependableness in anisotropic medium: application to cold plasma model," Helsinki University of Technology, Electromagnetics Lab. Report 357, Mar. 2001, ISBN 951-22-5411-5, ISSN 1456-632X.<br>25-T. Sengor, "Boundary conditions on time and frequency dependable intersection surfaces," Helsinki University of Technology, Electromagnetics Lab. Report 361, Mar. 2001, ISBN 951-22-5423-9, ISSN 1456-632X.<br>26-T. Sengor, "On the Availability of Processes for Creation a Thing Space from a Null Space," (invited)., 2019 URSI International Symposium on Electromagnetic Theory (EMTS), 2019, pp. 1-4, doi: 10.23919/URSIEMTS.2019.8931455. https://ieeexplore.ieee.org/document/8931455 (presented).<br>27-T. Sengor, "The Compact System Electromagnetically Equivalent to the Earth's Natural Events and Disasters with Application to Seismic Processes: The Completely Compact Electromagnetically Equivalent Earth Network (CCEEEN)," 2021 XXXIVth General Assembly and Scientific Symposium of the International Union of Radio Science (URSI GASS), 2021, pp. 1-4, doi:10.23919/URSIGASS51995.2021.9560618. https://ieeexplore.ieee.org/document/9560618 (presented).<br>28- T. Sengor, "The Electromagnetically Equivalent Complex Network Modeling of Compact Seismo-Climatic Processes for the Complete Earth," Solicited paper, European Geosciences Union, Geophysical Research Abstracts, Vol. 11, EGU2009-01264,2009, European Geosciences Union General Assembly 2009, Vienna, Austria, 19-24 April 2009 (KRTA) (presented).<br>29- T. Sengor, "State Approach in Artificial Materials Development in Electromagnetics", INVITED PAPER, Proceedings of Progress in Electromagnetics Research Symposium, pp. 568, The Electromagnetics Academy (USA), University of Pisa, Pisa, Italy, March 28-31, 2004 (presented).<br>30- T. Sengor, "The Optimizer Topology Characteristics in Seismic Hazards," AGU (American Geophysical Union) Fall Meeting, San Francisco, California, U.S.A., 13-18 December 2015.<br>31- T. Sengor, "Seismic - Climatic - Hazardous Events Estimation Processes via the Coupling Structures in Conserving Energy Topologies of the Earth," AGU (American Geophysical Union) Fall Meeting, San Francisco, California, U.S.A., 15-19 December 2014 (presented).<br>32- T. Sengor, "Inflective Structures on the Orbits of Electron Sharing Molecules with the Stochastic Discontinuity Effects: the Definition of Orbitron Mechanism," 7th Nanoscience and Nanotechnology Conference, NanoTR VII, Istanbul, Turkey, 27 June- 1 July 2011 (presented). <br>33- T. Sengor, "The state space approach and modified state equations solution in dispersive chiral media," XXVIIIth General Assembly of the International Union of Radio Science, URSI GA 2005, Abstracts Book, COM2-01430-2005; Conference CD, URSI New Delhi 2005, paper no. COM2-01430-2005, New Delhi, India, 23-29 October 2005 (presented).<br>34- T. Sengor, "The Mechanisms of Interactions of Irregularly Oscillating Bodies by Electromagnetic Waves, Paper in Monograph Book Title: Electromagnetic Phenomena Related to Earthquake Prediction. Eds.: M. Hayakawa and Y. Fujinawa, TERRA Pub. Comp., Tokyo, pp.: 647-666, 1994.<br>35-T. Sengor, "Extensions of Maxwell's electromagnetic theory to oscillating bodies," IEEE Antennas and Propagation Society International Symposium. 1996 Digest, 1996, pp. 872-875 vol.2, doi: 10.1109/APS.1996.549734.<br>36- T. Sengor, "Possibilities to extend electromagnetism for non-smooth and non-uniformly vibrating media cases," Helsinki University of Technology, Electromagnetics Lab. Report 367, May. 2001, ISBN 951-22-5474-3, ISSN 1456-632X.<br>37- T. Sengor, "Interaction of Electromagnetic Waves with Condensed Atomic Structures,'' (in Turkish) 16th Condense Matter Physics Meeting, Gazi University, Ankara, Turkey, 06 November 2009 (presented).<br>38- T. Sengor, "Designing of Condensed Matter Using Inflective Femto Wires: Introducing the Inflector,'' (in Turkish) 18th Condense Matter Physics Meeting, METU, Ankara, Turkey, 25 November 2012 (presented).<br>39- T. Sengor, "Topological theory and analytical configuration for a universal community model," Procedia- Soc. and Beh. Sci., 81, 2013, pp. 188-194, doi:10.1016/j.sbspro.2013.06.411.<br>
Presenters
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Taner Sengor
Yildiz Technical University (Retired)
Authors
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Taner Sengor
Yildiz Technical University (Retired)
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