Nanohardness from First Principles with Active Learning on Atomic Environments

Podryabinkin E.V., Kvashnin A.G., Asgarpour M., Maslenikov I.I., Ovsyannikov D.A., Sorokin P.B., Popov M.Y., Shapeev A.V.
Тип документа: Journal Article
Дата публикации: 2022-01-06
Название журнала: Journal of Chemical Theory and Computation
Издатель: American Chemical Society
Квартиль: Q1
ISSN: 15499618, 15499626
DOI:  10.1021/acs.jctc.1c00783
  • Physical and Theoretical Chemistry
  • Computer Science Applications
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1. Podryabinkin E.V. и др. Nanohardness from First Principles with Active Learning on Atomic Environments // Journal of Chemical Theory and Computation. 2022.
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TY - JOUR

DO - 10.1021/acs.jctc.1c00783

UR - http://dx.doi.org/10.1021/acs.jctc.1c00783

TI - Nanohardness from First Principles with Active Learning on Atomic Environments

T2 - Journal of Chemical Theory and Computation

AU - Podryabinkin, Evgeny V.

AU - Kvashnin, Alexander G.

AU - Asgarpour, Milad

AU - Maslenikov, Igor I.

AU - Ovsyannikov, Danila A.

AU - Sorokin, Pavel B.

AU - Popov, Mikhail Yu

AU - Shapeev, Alexander V.

PY - 2022

DA - 2022/01/06

PB - American Chemical Society (ACS)

SN - 1549-9618

SN - 1549-9626

ER -

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@article{Podryabinkin_2022,

doi = {10.1021/acs.jctc.1c00783},

url = {https://doi.org/10.1021%2Facs.jctc.1c00783},

year = 2022,

month = {jan},

publisher = {American Chemical Society ({ACS})},

author = {Evgeny V. Podryabinkin and Alexander G. Kvashnin and Milad Asgarpour and Igor I. Maslenikov and Danila A. Ovsyannikov and Pavel B. Sorokin and Mikhail Yu Popov and Alexander V. Shapeev},

title = {Nanohardness from First Principles with Active Learning on Atomic Environments},

journal = {Journal of Chemical Theory and Computation}

}

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Podryabinkin, Evgeny V. et al. “Nanohardness from First Principles with Active Learning on Atomic Environments.” Journal of Chemical Theory and Computation (2022): n. pag. Crossref. Web.