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17:30
From chemical ordering to mass transport: Machine-learning atomistic simulations of cubic TiAlON
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Pavel Ondračka
(MUNI)
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17:31
Effects of Hydrogen Occupation on the Magnetic and Electronic Properties of LaNi5- and LaNiSn-Based Hydrides: A DFT Study
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Kateřina Dočkalová
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17:32
Use of open data for training machine-learning interatomic potentials
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Pavel Ondračka
(MUNI)
Šimon Kratochvíl
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17:33
Roofline Benchmarking and CPU-to-CPU Variability of Barbora NG
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Daniel Velicka
(IT4Innovations, VSB-TUO)
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17:34
Modeling of High-Quality Electron Beam for a Compact EUV Free-Electron Laser
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Mihail Miceski
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17:35
Multi-Level Compression for Direct Volume Rendering
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Markéta Faltýnková
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17:36
Effective solution of differential equations on highly parralel architectures
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Petr Bém
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17:37
Simulation Model of the Mitochondrial Ribosome
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Rudolf Kvasňovský
(University of Chemistry and Technology)
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17:38
Anharmonic Effects in Tin Studied by MLIP
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Petr Sestak
(Academy of Sciences of CZ, Institute of Physics of Materials)
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17:39
Momentum-Resolved Energy-Loss Spectroscopy of Molybdenum Disulfide: First-Principles Interpretation of Experimental Spectra
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Michal Štulpa
(Department of Condensed Matter Physics, Masaryk University)
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17:40
Laser Wakefield Acceleration in Discharge-Generated Plasma Channels
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Alex Whitehead
(ELI-ERIC (ELI-Beamlines Facility))
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17:41
Radiation resistant refractory high entropy alloys
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Oussama Madyouni
(Faculty of Electrical Engineering - CTU in Prague)
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17:42
Blood Cell Membrane Models for Nanoparticle Delivery Systems
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Petra Čechová
(Regional Centre of Advanced Technologies and Materials, Czech Advanced Technology and Research Institute (CATRIN), Palacký University Olomouc: Olomouc, CZ)
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17:43
Hardware drift and the accuracy of molecular properties from quantum computers
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Przemyslaw Grenda
(Charles University)
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17:44
Bringing Regional Traffic Simulation to HPC
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Pavlína Smolková
(IT4Innovations (VSB-TUO))
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17:45
First principles study of chalcogen vacancy effect on the optoelectronic and photocatalytic properties of transition metal dichalcogenides monolayers
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Tahir wahab
(Czech Technical University in Prague)
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17:46
HPC-Enabled Real-Time Monitoring of Aseptic Gene Therapy Manufacturing Using Computer Vision
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Nikola Cudráková
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17:47
A Comprehensive Stability Classification and Dynamical Analysis of a Brain-Inspired Coupled Rössler-Type System
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Haseeba Sajjad
(IT4Innovations)
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17:48
Biased-exchange metadynamics of nascent peptide-accompanied rearrangements of the ribosome catalytic center
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Josef Cikhart
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17:49
Tuning magnitude and direction of lattice thermal conductivity in transition metal dichalcogenide heterobilayers
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Elliot Perviz
(Czech Technical University)
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17:50
Case study: Six months of work from heat flow simulation to the arrow of time experiment.
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Ladislav Ničman
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17:51
Privacy-preserving federated learning with light-weight attention improved CNNs for automated leukemia detection across distributed medical imaging
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Muhammad Zeerak Awan
(VSB - Technical University of Ostrava)
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17:52
Influence of the N/P ratio on Lipid Nanoparticle's structure and behaviour
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Adéla Chadalíková
(CATRIN, VŠB-TUO)
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17:53
Polypyridine Iron Complexes in Elektro- & Photocatalytic CO2 Reduction
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Florian Lemken
(Institute of Organic Chemsitry Biochemistry, Czech Academy of Sciences)
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17:54
Regional climate projections of non-CO2 forcers and their impact on climate and air quality using RegCM5-Chem
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Natália Machado Crespo
(Charles University)
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17:55
Predicting polymorphs of pharmaceutical co-crystals via crystal structure prediction
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Petr Touš
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17:56
Spectroscopy Enhanced by Two-Dimensional Materials for the Detection of Free Heme Associated with Intravascular Hemolysis
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Angarag Munkhbat
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17:57
Thermoelectric properties of defective scandium nitride nanostructures from first principles
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Luigi Cigarini
(IT4Innovations, VŠB – Technical University of Ostrava)
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17:58
Machine Learning for Predicting Lignin Solubility and Guiding Solvent Selection
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Zaheer Abbas
(University of Chemistry and Technology, Prague)
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17:59
Effects of sequence on the conformational ensembles of ribosomal protein fragments
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Jan Heblt
(VŠCHT)
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18:00
Atom-scale contributions to nanofriction response in transition metal dichalcogenides
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Suresh Ravisankar
(Czech Technical University in Prague)
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18:01
A Quantum Perspective on Interval Power Flow
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Michal Belina
(IT4Innovations, VSB – Technical University of Ostrava, 17. listopadu 2172/15, 708 00 Ostrava-Poruba, Czech Republic)
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18:02
Density functional theory simulations of hydrogenated graphene supported by machine learning
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Jiří Richter
(Brno University of Technology, Faculty of Mechanical Engineering, Institute of Physical Engineering)
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18:03
Many-body errors of quantum chemistry methods
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Jiri Klimes
(Faculty of Mathematics and Physics, Charles University)
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18:04
Energy-optimized scaling laws for laser-driven electron accelerators
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Petr Valenta
(Beamlines Facility, Extreme Light Infrastructure ERIC)
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18:05
From Batch Jobs to AI Services: Training and Inference Workflows on HPC
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Tomáš Martinovič
(IT4Innovations, VŠB - Technical University of Ostrava)
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18:06
Quantum-Circuit Tensor Networks for Correlated Superconducting Nanostructures
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Jan Hojač
(Institute of Physics of Materials, Czech Academy of Sciences, Brno, Czech Republic)
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18:07
SELECTING VAN DER WAALS FUNCTIONALS FOR 2D MAGNETS: A DFT BENCHMARK FOR STRUCTURAL, ELECTRONIC AND MAGNETIC PROPERTIES OF CHROMIUM TRIHALIDES (CrX₃)
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SUBHASMITA RAY
(POSTDOCTORAL RESEARCHER, CHARLES UNIVERSITY)
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18:08
Kinetic study of shock formation in protostellar jets
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Jakub Gazdoš
(FZU AVČR)
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18:09
Influence of Antisite Defects on the Stability of Martensitic NiTi
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Petr Jaroš
(Ústav termomechaniky AVČR v.v.i.)
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18:10
Evaluating Generative Structural Models Against Multi-Microsecond Molecular Dynamics for Intrinsically Disordered Ensembles: Lessons from p53 TAD1
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Michael Bakker
(Charles University)
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18:11
Laser-driven acceleration of sub-GeV and GeV high-quality electron beams
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Martin Matys
(ELI Beamlines Facility, The Extreme Light infrastructure ERIC)
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18:12
Atomistic Insights Into Interaction of Doxorubicin With DNA: From Duplex to Nucleosome
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Andrea Nedělníková
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18:13
Controlled Electron Injection and keV Betatron X-rays from Nanoparticle-Assisted Laser Wakefield Acceleration
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Alfred Mishi
(Czech Technical University in Prague)
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18:14
Magnetic field effect on acoustic wave propagation in cubic ferromagnets
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Ievgeniia Korniienko
(IT4Innovations)
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18:15
Machine-learned interatomic potentials for fracture simulations in hydroxylated silica minerals
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Valentína Berecová
(Institute of Physics of Materials CAS, v. v. i.)
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18:16
Simulation-Driven Optimization of Betatron X-ray Sources
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Dominik Čáp
(Beamlines Facility, Extreme Light Infrastructure ERIC)
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18:17
The stability and material properties of Zn5Sb4In2 computed by quantum mechanical calculations
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Martin Friák
(Institute of Physics of Materials, Czech Academy of Sciences, Brno, Czech Republic)
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18:18
Implicit solvation models for modern neural network potentials
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Erik Andris
(IOCB Prague)
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18:19
The Quantum Access Trail: Reach QPUs at EU/National scale with QHEAppE
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Jan Swiatkowski
(IT4Innovations, VSB - TUO)
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18:20
Developing Machine Learning Interatomic Potential for 2D TMDC High Entropy Alloys
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Shubham Agarwal
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18:21
Magnetoelastic behavior in tetragonal Pt-base compounds
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Jakub Šebesta
(IT4Innovations, VSB - Technical University of Ostrava, 70800 Ostrava-Poruba, Czech Republic)
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18:22
Interlayer exchange coupling in antiferromagnetic multilayers with magnetically alloyed spacer
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Sergiu Arapan
(IT4Innovations VŠB - TU Ostrava)
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18:23
Bridging Phonon Dynamics and Nanotribology in TMD Heterostructures via Machine Learning Force Fields
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Ravikant Kumar
(Department of Control Engineering - KN:G-204, Faculty of Electrical Engineering, Czech Technical University in Prague, Czech Republic)
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18:24
Feature-Complete Multi-GPU Solver for the k-Wave Ultrasound Simulation Toolbox
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Oliver Kuník
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18:25
Modular multiscale approach to modelling HHG in gases & spectrally selective HHG scheme
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Jan Vábek
(ELI Beamlines Facility, The Extreme Light Infrastructure ERIC, Czech Republic; Czech Technical University in Prague, Faculty of Nuclear Sciences and Physical Engineering, Czech Republic)