Journal of Physics Condensed Matter, volume 34, issue 13, pages 135403
Pressure-stabilized high-energy-density material YN10
Publication type: Journal Article
Publication date: 2022-01-20
Journal:
Journal of Physics Condensed Matter
Quartile SCImago
Q2
Quartile WOS
Q3
Impact factor: 2.7
ISSN: 09538984, 1361648X
Condensed Matter Physics
General Materials Science
Abstract
Polynitrogen compounds have been intensively studied for potential applications as high energy density materials, especially in energy and military fields. Here, using the swarm intelligence algorithm in combination with first-principles calculations, we systematically explored the variable stoichiometries of yttrium–nitrogen compounds on the nitrogen-rich regime at high pressure, where a new stable phase of YN10 adopting I4/m symmetry was discovered at the pressure of 35 GPa and showed metallic character from the analysis of electronic properties. In YN10, all the nitrogen atoms were sp 2-hybridized in the form of N5 ring. Furthermore, the gravimetric and volumetric energy densities were estimated to be 3.05 kJ g−1 and 9.27 kJ cm−1 respectively. Particularly, the calculated detonation velocity and pressure of YN10 (12.0 km s−1, 82.7 GPa) was higher than that of TNT (6.9 km s−1, 19.0 GPa) and HMX (9.1 km s−1, 39.3 GPa), making it a potential candidate as a high-energy-density material.
Top-30
Citations by journals
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1
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Matter and Radiation at Extremes
1 publication, 16.67%
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Ceramics International
1 publication, 16.67%
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Physica Scripta
1 publication, 16.67%
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Journal Physics D: Applied Physics
1 publication, 16.67%
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Computational Materials Science
1 publication, 16.67%
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Russian Chemical Reviews
1 publication, 16.67%
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1
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Citations by publishers
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1
2
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Elsevier
2 publications, 33.33%
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IOP Publishing
2 publications, 33.33%
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American Institute of Physics (AIP)
1 publication, 16.67%
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Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
1 publication, 16.67%
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- We do not take into account publications without a DOI.
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- Statistics recalculated weekly.
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Lu W. et al. Pressure-stabilized high-energy-density material YN10 // Journal of Physics Condensed Matter. 2022. Vol. 34. No. 13. p. 135403.
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Lu W., Hao K., Liu S., Lv J., Zhou M., Gao P. Pressure-stabilized high-energy-density material YN10 // Journal of Physics Condensed Matter. 2022. Vol. 34. No. 13. p. 135403.
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TY - JOUR
DO - 10.1088/1361-648x/ac48c0
UR - https://doi.org/10.1088/1361-648x/ac48c0
TI - Pressure-stabilized high-energy-density material YN10
T2 - Journal of Physics Condensed Matter
AU - Lu, Wencheng
AU - Hao, Kun
AU - Liu, Siyu
AU - Lv, Jian
AU - Zhou, Mi
AU - Gao, Pengyue
PY - 2022
DA - 2022/01/20 00:00:00
PB - IOP Publishing
SP - 135403
IS - 13
VL - 34
SN - 0953-8984
SN - 1361-648X
ER -
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@article{2022_Lu,
author = {Wencheng Lu and Kun Hao and Siyu Liu and Jian Lv and Mi Zhou and Pengyue Gao},
title = {Pressure-stabilized high-energy-density material YN10},
journal = {Journal of Physics Condensed Matter},
year = {2022},
volume = {34},
publisher = {IOP Publishing},
month = {jan},
url = {https://doi.org/10.1088/1361-648x/ac48c0},
number = {13},
pages = {135403},
doi = {10.1088/1361-648x/ac48c0}
}
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Lu, Wencheng, et al. “Pressure-stabilized high-energy-density material YN10.” Journal of Physics Condensed Matter, vol. 34, no. 13, Jan. 2022, p. 135403. https://doi.org/10.1088/1361-648x/ac48c0.