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ORCIDAidan P. Thompson
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2020 – today
- 2024
[j7]James Goff, C. Sievers, Mitchell A. Wood, Aidan P. Thompson:
Permutation-adapted complete and independent basis for atomic cluster expansion descriptors. J. Comput. Phys. 510: 113073 (2024)- [c4]Kylee Santos, Stan G. Moore, Tomas Oppelstrup, Amirali Sharifian, Ilya Sharapov, Aidan P. Thompson, Delyan Z. Kalchev, Danny Perez, Robert Schreiber, Scott Pakin, Edgar A. Leon, James H. Laros III, Michael James, Sivasankaran Rajamanickam:
Breaking the Molecular Dynamics Timescale Barrier Using a Wafer-Scale System. SC 2024: 8 - [i4]Kylee Santos, Stan G. Moore, Tomas Oppelstrup, Amirali Sharifian, Ilya Sharapov, Aidan P. Thompson, Delyan Z. Kalchev, Danny Perez, Robert Schreiber, Scott Pakin, Edgar A. Leon, James H. Laros III, Michael James, Sivasankaran Rajamanickam:
Breaking the Molecular Dynamics Timescale Barrier Using a Wafer-Scale System. CoRR abs/2405.07898 (2024) - 2023
- [j6]Germain Clavier
, Aidan P. Thompson:
Computation of the thermal elastic constants for arbitrary manybody potentials in LAMMPS using the stress-fluctuation formalism. Comput. Phys. Commun. 286: 108674 (2023) - [j5]Andrew Rohskopf, C. Sievers, Nicholas Lubbers, Mary Alice Cusentnio, James Goff, Jan Janssen, Megan McCarthy, David Montes Oca de Zapiain, Svetoslav Nikolov, Khachik Sargsyan, Dionysios Sema, Ember Sikorski, Logan Williams, Aidan P. Thompson, Mitchell A. Wood:
FitSNAP: Atomistic machine learning with LAMMPS. J. Open Source Softw. 8(83): 5118 (2023) - 2022
- [j4]Aidan P. Thompson, Hasan Metin Aktulga, Richard Berger, Dan S. Bolintineanu, W. Michael Brown, Paul S. Crozier, Pieter J. in 't Veld, Axel Kohlmeyer, Stan G. Moore, Trung Dac Nguyen, Ray Shan, Mark J. Stevens, Julien Tranchida, Christian Trott, Steven J. Plimpton:
LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales. Comput. Phys. Commun. 271: 108171 (2022) - 2021
- [c3]Kien Nguyen-Cong, Jonathan T. Willman, Stan G. Moore, Anatoly B. Belonoshko, Rahulkumar Gayatri, Evan Weinberg, Mitchell A. Wood, Aidan P. Thompson, Ivan I. Oleynik:
Billion atom molecular dynamics simulations of carbon at extreme conditions and experimental time and length scales. SC 2021: 4 - 2020
- [i3]Anh Tran, Julien Tranchida, Tim Wildey, Aidan P. Thompson:
Multi-fidelity machine-learning with uncertainty quantification and Bayesian optimization for materials design: Application to ternary random alloys. CoRR abs/2006.00139 (2020) - [i2]J. Austin Ellis, Attila Cangi, Normand A. Modine, J. Adam Stephens, Aidan P. Thompson, Sivasankaran Rajamanickam:
Accelerating Finite-temperature Kohn-Sham Density Functional Theory with Deep Neural Networks. CoRR abs/2010.04905 (2020) - [i1]Rahulkumar Gayatri, Stan G. Moore, Evan Weinberg, Nicholas Lubbers, Sarah Anderson, Jack Deslippe, Danny Perez, Aidan P. Thompson:
Rapid Exploration of Optimization Strategies on Advanced Architectures using TestSNAP and LAMMPS. CoRR abs/2011.12875 (2020)
2010 – 2019
- 2018
- [j3]Julien Tranchida, Steven J. Plimpton, Pascal Thibaudeau, Aidan P. Thompson:
Massively parallel symplectic algorithm for coupled magnetic spin dynamics and molecular dynamics. J. Comput. Phys. 372: 406-425 (2018) - 2015
- [j2]Scott Levy, Kurt B. Ferreira, Patrick G. Bridges, Aidan P. Thompson, Christian R. Trott:
A study of the viability of exploiting memory content similarity to improve resilience to memory errors. Int. J. High Perform. Comput. Appl. 29(1): 5-20 (2015) - [j1]Aidan P. Thompson, Laura P. Swiler, Christian R. Trott, S. M. Foiles, Garritt J. Tucker:
Spectral neighbor analysis method for automated generation of quantum-accurate interatomic potentials. J. Comput. Phys. 285: 316-330 (2015) - 2014
- [c2]Christian R. Trott, Simon D. Hammond, Aidan P. Thompson:
SNAP: Strong Scaling High Fidelity Molecular Dynamics Simulations on Leadership-Class Computing Platforms. ISC 2014: 19-34 - 2013
- [c1]Scott Levy, Patrick G. Bridges, Kurt B. Ferreira, Aidan P. Thompson, Christian R. Trott:
Evaluating the feasibility of using memory content similarity to improve system resilience. ROSS@ICS 2013: 7:1-7:8
Coauthor Index
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