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ORCIDVladimir V. Stegailov
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Journal Articles
- 2024
[j9]Daniil Pavlov
, Vladislav Galigerov, Daniil Kolotinskii, Vsevolod P. Nikolskiy, Vladimir V. Stegailov:
GPU-based molecular dynamics of fluid flows: Reaching for turbulence. Int. J. High Perform. Comput. Appl. 38(1): 34-49 (2024)- 2021
- [j8]Nikolay Kondratyuk, Vsevolod P. Nikolskiy, Daniil Pavlov, Vladimir V. Stegailov:
GPU-accelerated molecular dynamics: State-of-art software performance and porting from Nvidia CUDA to AMD HIP. Int. J. High Perform. Comput. Appl. 35(4) (2021) - 2019
- [j7]Vladimir V. Stegailov, Grigory S. Smirnov, Vyacheslav S. Vecher:
VASP hits the memory wall: Processors efficiency comparison. Concurr. Comput. Pract. Exp. 31(19) (2019) - [j6]Vladimir V. Stegailov, Ekaterina Dlinnova, Timur Z. Ismagilov, Mikhail Khalilov, Nikolay Kondratyuk, Dmitry Makagon, Alexander Semenov, Alexei Simonov, Grigory S. Smirnov, Alexey Timofeev:
Angara interconnect makes GPU-based Desmos supercomputer an efficient tool for molecular dynamics calculations. Int. J. High Perform. Comput. Appl. 33(3) (2019) - 2011
- [j5]Igor V. Morozov, Andrey M. Kazennov, R. G. Bystryi, Genri E. Norman, Vasily V. Pisarev, Vladimir V. Stegailov:
Molecular dynamics simulations of the relaxation processes in the condensed matter on GPUs. Comput. Phys. Commun. 182(9): 1974-1978 (2011) - 2007
- [j4]Alexey Y. Kuksin, Genri E. Norman, Vladimir V. Stegailov, Alexey Yanilkin:
Surface melting of superheated crystals. Atomistic simulation study. Comput. Phys. Commun. 177(1-2): 34-37 (2007) - [j3]Timur T. Bazhirov, Genri E. Norman, Vladimir V. Stegailov:
Cavitation in liquid Pb and Li under negative pressures. Comput. Phys. Commun. 177(1-2): 41 (2007) - [j2]Alexey Y. Kuksin, Genri E. Norman, Vladimir V. Stegailov, Alexey Yanilkin:
Atomistic simulations of structure transitions and fracture in Fe and Al single crystals. Comput. Phys. Commun. 177(1-2): 48 (2007) - 2005
- [j1]Vladimir V. Stegailov:
Homogeneous and heterogeneous mechanisms of superheated solid melting and decay. Comput. Phys. Commun. 169(1-3): 247-250 (2005)
Conference and Workshop Papers
- 2022
- [c17]Daniil Pavlov, Daniil Kolotinskii, Vladimir V. Stegailov:
GPU-Based Molecular Dynamics of Turbulent Liquid Flows with OpenMM. PPAM (1) 2022: 346-358 - 2019
- [c16]Vsevolod P. Nikolskiy, Vladimir V. Stegailov:
GPU Acceleration of Four-Site Water Models in LAMMPS. PARCO 2019: 565-573 - [c15]Ekaterina Dlinnova, Sergey Biryukov, Vladimir V. Stegailov:
Energy Consumption of MD Calculations on Hybrid and CPU-Only Supercomputers with Air and Immersion Cooling. PARCO 2019: 574-582 - [c14]Evgeny Kuznetsov, Nikolay Kondratyuk, Mikhail Logunov, Vsevolod P. Nikolskiy, Vladimir V. Stegailov:
Performance and Portability of State-of-Art Molecular Dynamics Software on Modern GPUs. PPAM (1) 2019: 324-334 - [c13]Evgeny Kuznetsov, Vladimir V. Stegailov:
Porting CUDA-Based Molecular Dynamics Algorithms to AMD ROCm Platform Using HIP Framework: Performance Analysis. RuSCDays 2019: 121-130 - [c12]Nikolay Kondratyuk, Grigory S. Smirnov, Alexander Agarkov, Anton Osokin, Vsevolod P. Nikolskiy, Alexander Semenov, Vladimir V. Stegailov:
Performance and Scalability of Materials Science and Machine Learning Codes on the State-of-Art Hybrid Supercomputer Architecture. RuSCDays 2019: 597-609 - 2018
- [c11]Nikolay Kondratyuk, Grigory S. Smirnov, Vladimir V. Stegailov:
Hybrid Codes for Atomistic Simulations on the Desmos Supercomputer: GPU-acceleration, Scalability and Parallel I/O. RuSCDays 2018: 218-229 - [c10]Vladimir V. Stegailov, Alexey Timofeev:
Deploying Elbrus VLIW CPU Ecosystem for Materials Science Calculations: Performance and Problems. RuSCDays 2018: 543-553 - 2017
- [c9]Vladimir V. Stegailov, Vyacheslav S. Vecher:
Efficiency Analysis of Intel, AMD and Nvidia 64-Bit Hardware for Memory-Bound Problems: A Case Study of Ab Initio Calculations with VASP. PPAM (2) 2017: 81-90 - [c8]Vladimir V. Stegailov, Alexander Agarkov, Sergey Biryukov, Timur Z. Ismagilov, Mikhail Khalilov, Nikolay Kondratyuk, Evgeny Kushtanov, Dmitry Makagon, Anatoly Mukosey, Alexander Semenov, Alexey Simonov, Alexey Timofeev, Vyacheslav S. Vecher:
Early Performance Evaluation of the Hybrid Cluster with Torus Interconnect Aimed at Molecular-Dynamics Simulations. PPAM (1) 2017: 327-336 - [c7]Vladimir V. Stegailov, Vyacheslav S. Vecher:
Efficiency Analysis of Intel and AMD x86_64 Architectures for Ab Initio Calculations: A Case Study of VASP. RuSCDays 2017: 430-441 - 2016
- [c6]Vsevolod P. Nikolskiy, Vladimir V. Stegailov, Vyacheslav S. Vecher:
Efficiency of the Tegra K1 and X1 systems-on-chip for classical molecular dynamics. HPCS 2016: 682-689 - 2015
- [c5]Genri E. Norman, Vasily V. Pisarev, Grigory S. Smirnov, Vladimir V. Stegailov:
Atomistic Modeling and Simulation for Solving Gas Extraction Problems. FOMMS 2015: 137-151 - [c4]Vladimir V. Stegailov, Nikita D. Orekhov, Grigory S. Smirnov:
HPC Hardware Efficiency for Quantum and Classical Molecular Dynamics. PaCT 2015: 469-473 - 2004
- [c3]Alexey Y. Kuksin, Igor V. Morozov, Genri E. Norman, Vladimir V. Stegailov:
Standard of Molecular Dynamics Modeling and Simulation of Relaxation in Dense Media. International Conference on Computational Science 2004: 596-603 - 2002
- [c2]Igor V. Morozov, Genri E. Norman, Vladimir V. Stegailov:
Dynamic and Stochastic Properties of Molecular Systems: From Simple Liquids to Enzymes. International Conference on Computational Science (3) 2002: 1137-1146 - [c1]Vladimir V. Stegailov:
Determinism and Chaos in Decay of Metastable States. International Conference on Computational Science (3) 2002: 1147-1153
Coauthor Index
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