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RSC Advances, volume 11, issue 28, pages 17222-17228

Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study

Publication type: Journal Article
Publication date: 2021-05-11
Journal: RSC Advances
Quartile SCImago
Q1
Quartile WOS
Q2
SJR: 0.715
CiteScore: 7.5
Impact factor: 3.9
ISSN: 20462069
General Chemistry
General Chemical Engineering
Abstract

The Fddd-SrN6 structure can transform into P1̄-SrN6, and polymerized to infinite nitrogen chain structures at P = 22 GPa. For BaN6, the Fmmm-BaN6 structure can transform into C2/m-BaN6, and polymerized to N6 ring network structure at P = 110 GPa.

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Liu Z. et al. Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study // RSC Advances. 2021. Vol. 11. No. 28. pp. 17222-17228.
GOST all authors (up to 50) Copy
Liu Z., Wei S., Guo Y., Sun H., Sun H., Chang Q., Sun Y. P. Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study // RSC Advances. 2021. Vol. 11. No. 28. pp. 17222-17228.
RIS |
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RIS Copy
TY - JOUR
DO - 10.1039/d1ra01631h
UR - https://doi.org/10.1039/d1ra01631h
TI - Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study
T2 - RSC Advances
AU - Wei, Shuli
AU - Guo, Yanhui
AU - Sun, Haiyang
AU - Chang, Qiang
AU - Sun, Y. P.
AU - Liu, Zhipeng
AU - Sun, Hao
PY - 2021
DA - 2021/05/11
PB - Royal Society of Chemistry (RSC)
SP - 17222-17228
IS - 28
VL - 11
SN - 2046-2069
ER -
BibTex |
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BibTex Copy
@article{2021_Liu,
author = {Shuli Wei and Yanhui Guo and Haiyang Sun and Qiang Chang and Y. P. Sun and Zhipeng Liu and Hao Sun},
title = {Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study},
journal = {RSC Advances},
year = {2021},
volume = {11},
publisher = {Royal Society of Chemistry (RSC)},
month = {may},
url = {https://doi.org/10.1039/d1ra01631h},
number = {28},
pages = {17222--17228},
doi = {10.1039/d1ra01631h}
}
MLA
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MLA Copy
Liu, Zhipeng, et al. “Pressure-induced stability and polymeric nitrogen in alkaline earth metal N-rich nitrides (XN6, X = Ca, Sr and Ba): a first-principles study.” RSC Advances, vol. 11, no. 28, May. 2021, pp. 17222-17228. https://doi.org/10.1039/d1ra01631h.
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