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Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions. / Kostenko, Maxim G.; Li, Jingyu; Zeng, Zhi и др.
в: Journal of Alloys and Compounds, Том 891, 162063, 25.01.2022.

Результаты исследований: Вклад в журнал › Статья › Рецензирование

Harvard

Kostenko, MG, Li, J, Zeng, Z, Zhang, Y, Sharf, SV, Gusev, AI & Lukoyanov, AV 2022, 'Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions', Journal of Alloys and Compounds, Том. 891, 162063. https://doi.org/10.1016/j.jallcom.2021.162063

APA

Kostenko, M. G., Li, J., Zeng, Z., Zhang, Y., Sharf, S. V., Gusev, A. I., & Lukoyanov, A. V. (2022). Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions. Journal of Alloys and Compounds, 891, [162063]. https://doi.org/10.1016/j.jallcom.2021.162063

Vancouver

Kostenko MG, Li J, Zeng Z, Zhang Y, Sharf SV, Gusev AI и др. Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions. Journal of Alloys and Compounds. 2022 янв. 25;891:162063. doi: 10.1016/j.jallcom.2021.162063

Author

Kostenko, Maxim G. ; Li, Jingyu ; Zeng, Zhi и др. / Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions. в: Journal of Alloys and Compounds. 2022 ; Том 891.

BibTeX

@article{a8f75d3f14824b649684112708b1373a,
title = "Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions",
keywords = "Crystal structure prediction, First-principles calculations, Hafnium carbide, Mechanical properties, Nonstoichiometry, Ordering, Superstructures, Vacancies, CARBON, STABILITY, TOTAL-ENERGY CALCULATIONS, MECHANICAL-PROPERTIES",
author = "Kostenko, {Maxim G.} and Jingyu Li and Zhi Zeng and Yongsheng Zhang and Sharf, {Sergey V.} and Gusev, {Aleksandr I.} and Lukoyanov, {Alexey V.}",
note = "Funding Information: The reported study was funded by the Russian Foundation for Basic Research according to the research project ? 20-52-53010 and the National Natural Science Foundation of China Grant Nos. 12011530066 and 11774347. USPEX predictions were performed on the Uran supercomputer at the IMM UB RAS. Funding Information: The reported study was funded by the Russian Foundation for Basic Research according to the research project № 20-52-53010 and the National Natural Science Foundation of China Grant Nos. 12011530066 and 11774347 . USPEX predictions were performed on the Uran supercomputer at the IMM UB RAS.",
year = "2022",
month = jan,
day = "25",
doi = "10.1016/j.jallcom.2021.162063",
language = "English",
volume = "891",
journal = "Journal of Alloys and Compounds",
issn = "0925-8388",
publisher = "Elsevier Inc.",

}

RIS

TY - JOUR

T1 - Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions

AU - Kostenko, Maxim G.

AU - Li, Jingyu

AU - Zeng, Zhi

AU - Zhang, Yongsheng

AU - Sharf, Sergey V.

AU - Gusev, Aleksandr I.

AU - Lukoyanov, Alexey V.

N1 - Funding Information: The reported study was funded by the Russian Foundation for Basic Research according to the research project ? 20-52-53010 and the National Natural Science Foundation of China Grant Nos. 12011530066 and 11774347. USPEX predictions were performed on the Uran supercomputer at the IMM UB RAS. Funding Information: The reported study was funded by the Russian Foundation for Basic Research according to the research project № 20-52-53010 and the National Natural Science Foundation of China Grant Nos. 12011530066 and 11774347 . USPEX predictions were performed on the Uran supercomputer at the IMM UB RAS.

PY - 2022/1/25

Y1 - 2022/1/25

KW - Crystal structure prediction

KW - First-principles calculations

KW - Hafnium carbide

KW - Mechanical properties

KW - Nonstoichiometry

KW - Ordering

KW - Superstructures

KW - Vacancies

KW - CARBON

KW - STABILITY

KW - TOTAL-ENERGY CALCULATIONS

KW - MECHANICAL-PROPERTIES

UR - http://www.scopus.com/inward/record.url?scp=85115917554&partnerID=8YFLogxK

UR - https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=tsmetrics&SrcApp=tsm_test&DestApp=WOS_CPL&DestLinkType=FullRecord&KeyUT=000706783800006

UR - https://elibrary.ru/item.asp?id=47105741

U2 - 10.1016/j.jallcom.2021.162063

DO - 10.1016/j.jallcom.2021.162063

M3 - Article

AN - SCOPUS:85115917554

VL - 891

JO - Journal of Alloys and Compounds

JF - Journal of Alloys and Compounds

SN - 0925-8388

M1 - 162063

ER -

ID: 23889689