Accelerating crystal structure prediction by machine-learning interatomic potentials with active learning
- Authors:
- Publication Date:
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1496896
- Grant/Contract Number:
- AC52-06NA25396; NA-0003525
- Resource Type:
- Publisher's Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Name: Physical Review B Journal Volume: 99 Journal Issue: 6; Journal ID: ISSN 2469-9950
- Publisher:
- American Physical Society
- Country of Publication:
- United States
- Language:
- English
Citation Formats
Podryabinkin, Evgeny V., Tikhonov, Evgeny V., Shapeev, Alexander V., and Oganov, Artem R. Accelerating crystal structure prediction by machine-learning interatomic potentials with active learning. United States: N. p., 2019.
Web. doi:10.1103/PhysRevB.99.064114.
Podryabinkin, Evgeny V., Tikhonov, Evgeny V., Shapeev, Alexander V., & Oganov, Artem R. Accelerating crystal structure prediction by machine-learning interatomic potentials with active learning. United States. https://doi.org/10.1103/PhysRevB.99.064114
Podryabinkin, Evgeny V., Tikhonov, Evgeny V., Shapeev, Alexander V., and Oganov, Artem R. Wed .
"Accelerating crystal structure prediction by machine-learning interatomic potentials with active learning". United States. https://doi.org/10.1103/PhysRevB.99.064114.
@article{osti_1496896,
title = {Accelerating crystal structure prediction by machine-learning interatomic potentials with active learning},
author = {Podryabinkin, Evgeny V. and Tikhonov, Evgeny V. and Shapeev, Alexander V. and Oganov, Artem R.},
abstractNote = {},
doi = {10.1103/PhysRevB.99.064114},
journal = {Physical Review B},
number = 6,
volume = 99,
place = {United States},
year = {Wed Feb 27 00:00:00 EST 2019},
month = {Wed Feb 27 00:00:00 EST 2019}
}
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https://doi.org/10.1103/PhysRevB.99.064114
https://doi.org/10.1103/PhysRevB.99.064114
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