Journal of Physical Chemistry C, volume 122, issue 39, pages 22660-22666
Novel Phase of AlN4 as a Possible Superhard Material
Publication type: Journal Article
Publication date: 2018-09-18
Journal:
Journal of Physical Chemistry C
Quartile SCImago
Q1
Quartile WOS
Q2
Impact factor: 3.7
ISSN: 19327447, 19327455
Surfaces, Coatings and Films
Electronic, Optical and Magnetic Materials
Physical and Theoretical Chemistry
General Energy
Abstract
Nitrides have attracted great attention due to their outstanding applications as superconductors, high-energy materials, and hard materials. Utilizing particle swarm optimization algorithm on crystal structure prediction in combination with first-principle calculations, a novel stable stoichiometry, AlN4 with space group P31c, is thermodynamically stable above 123 GPa and remains metastable at ambient conditions. Structurally, AlN4 is intriguing with the appearance of N8 with distorted double triangular conical columns and Al atoms sharing the same lattice hP4 with sodium. The metastable of AlN4 stems from the inherent stability of three-dimensional covalent bonded nets from N8 and Al–N8. The new aluminum nitride with hardness of 45.7 GPa by Gao’s model is a potential hard material. Interestingly, the band gap of AlN4 is becoming wider with increasing pressure. Our work reveals a new form of N cluster and also provides a key perspective toward the understanding of novel chemical bonding in nitrogen-rich...
Top-30
Citations by journals
|
1
2
3
4
5
6
|
|
|
Physical Chemistry Chemical Physics
6 publications, 33.33%
|
|
|
Journal of Physical Chemistry C
2 publications, 11.11%
|
|
|
Physical Review Materials
1 publication, 5.56%
|
|
|
Physical Review B
1 publication, 5.56%
|
|
|
ECS Journal of Solid State Science and Technology
1 publication, 5.56%
|
|
|
Scientific Reports
1 publication, 5.56%
|
|
|
International Journal of Hydrogen Energy
1 publication, 5.56%
|
|
|
Solid State Communications
1 publication, 5.56%
|
|
|
Chinese Physics Letters
1 publication, 5.56%
|
|
|
Matter and Radiation at Extremes
1 publication, 5.56%
|
|
|
Dalton Transactions
1 publication, 5.56%
|
|
|
Russian Chemical Reviews
1 publication, 5.56%
|
|
|
1
2
3
4
5
6
|
Citations by publishers
|
1
2
3
4
5
6
7
|
|
|
Royal Society of Chemistry (RSC)
7 publications, 38.89%
|
|
|
American Physical Society (APS)
2 publications, 11.11%
|
|
|
American Chemical Society (ACS)
2 publications, 11.11%
|
|
|
Elsevier
2 publications, 11.11%
|
|
|
The Electrochemical Society
1 publication, 5.56%
|
|
|
Springer Nature
1 publication, 5.56%
|
|
|
IOP Publishing
1 publication, 5.56%
|
|
|
American Institute of Physics (AIP)
1 publication, 5.56%
|
|
|
Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
1 publication, 5.56%
|
|
|
1
2
3
4
5
6
7
|
- We do not take into account publications without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
{"yearsCitations":{"type":"bar","data":{"show":true,"labels":[2019,2020,2021,2022,2023,2024],"ids":[0,0,0,0,0,0],"codes":[0,0,0,0,0,0],"imageUrls":["","","","","",""],"datasets":[{"label":"Citations number","data":[1,1,4,6,5,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":["5.56","5.56","22.22","33.33","27.78","5.56"],"barThickness":null}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"journals":{"type":"bar","data":{"show":true,"labels":["Physical Chemistry Chemical Physics","Journal of Physical Chemistry C","Physical Review Materials","Physical Review B","ECS Journal of Solid State Science and Technology","Scientific Reports","International Journal of Hydrogen Energy","Solid State Communications","Chinese Physics Letters","Matter and Radiation at Extremes","Dalton Transactions","Russian Chemical Reviews"],"ids":[1773,8859,7673,25280,8890,13767,8699,13041,22690,23140,8473,23802],"codes":[0,0,0,0,0,0,0,0,0,0,0,0],"imageUrls":["\/storage\/images\/resized\/leiAYcRDGTSl5B1eCnwpSGqmDEUEfDPPoYisFGhT_medium.webp","\/storage\/images\/resized\/iLiQsFqFaSEx6chlGQ5fbAwF6VYU3WWa08hkss0g_medium.webp","\/storage\/images\/resized\/nrK64iXHTzj43wMrfN1ZoUQ0vanswGzWPN45K3jA_medium.webp","\/storage\/images\/resized\/nrK64iXHTzj43wMrfN1ZoUQ0vanswGzWPN45K3jA_medium.webp","\/storage\/images\/resized\/s6nfxitVCZUsdJiJZESaAXqdmMJxom8q4Ps6ayL2_medium.webp","\/storage\/images\/resized\/voXLqlsvTwv5p3iMQ8Dhs95nqB4AXOG7Taj7G4ra_medium.webp","\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/LsKy6OnmmmRGcAU6CZgWQvNiP1polbaSLNrN7zqj_medium.webp","\/storage\/images\/resized\/ARM4e6URKRsbRZvIF0vFis9DjxGloBjnBYJXbHmZ_medium.webp","\/storage\/images\/resized\/leiAYcRDGTSl5B1eCnwpSGqmDEUEfDPPoYisFGhT_medium.webp","\/storage\/images\/resized\/9Mus3KG1Tkd7Bwaurt8H3RwWh0CxRlGoO6ng9UK1_medium.webp"],"datasets":[{"label":"","data":[6,2,1,1,1,1,1,1,1,1,1,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":[33.33,11.11,5.56,5.56,5.56,5.56,5.56,5.56,5.56,5.56,5.56,5.56],"barThickness":13}]},"options":{"indexAxis":"y","maintainAspectRatio":false,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":null,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Journals","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"publishers":{"type":"bar","data":{"show":true,"labels":["Royal Society of Chemistry (RSC)","American Physical Society (APS)","American Chemical Society (ACS)","Elsevier","The Electrochemical Society","Springer Nature","IOP Publishing","American Institute of Physics (AIP)","Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii"],"ids":[123,1539,40,17,6916,8,2075,250,9422],"codes":[0,0,0,0,0,0,0,0,0],"imageUrls":["\/storage\/images\/resized\/leiAYcRDGTSl5B1eCnwpSGqmDEUEfDPPoYisFGhT_medium.webp","\/storage\/images\/resized\/nrK64iXHTzj43wMrfN1ZoUQ0vanswGzWPN45K3jA_medium.webp","\/storage\/images\/resized\/iLiQsFqFaSEx6chlGQ5fbAwF6VYU3WWa08hkss0g_medium.webp","\/storage\/images\/resized\/GDnYOu1UpMMfMMRV6Aqle4H0YLLsraeD9IP9qScG_medium.webp","\/storage\/images\/resized\/s6nfxitVCZUsdJiJZESaAXqdmMJxom8q4Ps6ayL2_medium.webp","\/storage\/images\/resized\/voXLqlsvTwv5p3iMQ8Dhs95nqB4AXOG7Taj7G4ra_medium.webp","\/storage\/images\/resized\/LsKy6OnmmmRGcAU6CZgWQvNiP1polbaSLNrN7zqj_medium.webp","\/storage\/images\/resized\/ARM4e6URKRsbRZvIF0vFis9DjxGloBjnBYJXbHmZ_medium.webp","\/storage\/images\/resized\/9Mus3KG1Tkd7Bwaurt8H3RwWh0CxRlGoO6ng9UK1_medium.webp"],"datasets":[{"label":"","data":[7,2,2,2,1,1,1,1,1],"backgroundColor":["#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6","#3B82F6"],"percentage":[38.89,11.11,11.11,11.11,5.56,5.56,5.56,5.56,5.56],"barThickness":13}]},"options":{"indexAxis":"y","maintainAspectRatio":false,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false},"x":{"ticks":{"stepSize":null,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":false}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Publishers","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"yearsCitationsQuartiles":{"type":"bar","data":{"show":true,"labels":[2019,2020,2021,2022,2023,2024],"ids":[],"codes":[],"imageUrls":[],"datasets":[{"label":"Q4","backgroundColor":"rgb(221,90,78)","data":[0,0,0,0,0,0],"percentage":["0","0","0","0","0","0"]},{"label":"Q3","backgroundColor":"rgb(251, 163,83)","data":[0,0,0,0,1,0],"percentage":["0","0","0","0","5.56","0"]},{"label":"Q2","backgroundColor":"rgb(232, 213, 89)","data":[0,0,0,1,0,0],"percentage":["0","0","0","5.56","0","0"]},{"label":"Q1","backgroundColor":"rgb(164, 207, 99)","data":[1,1,4,5,4,1],"percentage":["5.56","5.56","22.22","27.78","22.22","5.56"]},{"label":"Quartile not defined","backgroundColor":"#E5E7EB","data":[0,0,0,0,0,0],"percentage":["0","0","0","0","0","0"]}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations quartiles by SCImago per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}},"yearsCitationsQuartilesWs":{"type":"bar","data":{"show":true,"labels":[2019,2020,2021,2022,2023,2024],"ids":[],"codes":[],"imageUrls":[],"datasets":[{"label":"Q4","backgroundColor":"rgb(221,90,78)","data":[0,0,0,0,0,0],"percentage":["0","0","0","0","0","0"]},{"label":"Q3","backgroundColor":"rgb(251, 163,83)","data":[0,1,0,1,1,0],"percentage":["0","5.56","0","5.56","5.56","0"]},{"label":"Q2","backgroundColor":"rgb(232, 213, 89)","data":[1,0,4,4,2,0],"percentage":["5.56","0","22.22","22.22","11.11","0"]},{"label":"Q1","backgroundColor":"rgb(164, 207, 99)","data":[0,0,0,1,2,1],"percentage":["0","0","0","5.56","11.11","5.56"]},{"label":"Quartile not defined","backgroundColor":"#E5E7EB","data":[0,0,0,0,0,0],"percentage":["0","0","0","0","0","0"]}]},"options":{"indexAxis":"x","maintainAspectRatio":true,"scales":{"y":{"ticks":{"precision":0,"autoSkip":false,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true},"x":{"ticks":{"stepSize":1,"precision":0,"font":{"family":"Montserrat"},"color":"#000000"},"stacked":true}},"plugins":{"legend":{"position":"top","labels":{"font":{"family":"Montserrat"},"color":"#000000"}},"title":{"display":true,"text":"Citations quartiles by WoS per year","font":{"size":24,"family":"Montserrat","weight":600},"color":"#000000"}}}}}
Are you a researcher?
Create a profile to get free access to personal recommendations for colleagues and new articles.
Metrics
Cite this
GOST |
RIS |
BibTex |
MLA
Cite this
GOST
Copy
Ma S. et al. Novel Phase of AlN4 as a Possible Superhard Material // Journal of Physical Chemistry C. 2018. Vol. 122. No. 39. pp. 22660-22666.
GOST all authors (up to 50)
Copy
Ma S., Peng F., Zhu S., Li S., Gao Tao 高. 涛. Novel Phase of AlN4 as a Possible Superhard Material // Journal of Physical Chemistry C. 2018. Vol. 122. No. 39. pp. 22660-22666.
Cite this
RIS
Copy
TY - JOUR
DO - 10.1021/acs.jpcc.8b07385
UR - https://doi.org/10.1021/acs.jpcc.8b07385
TI - Novel Phase of AlN4 as a Possible Superhard Material
T2 - Journal of Physical Chemistry C
AU - Zhu, Shuangshuang
AU - Ma, Shiyin
AU - Peng, Feng
AU - Li, Shichang
AU - Gao Tao, 高 涛
PY - 2018
DA - 2018/09/18 00:00:00
PB - American Chemical Society (ACS)
SP - 22660-22666
IS - 39
VL - 122
SN - 1932-7447
SN - 1932-7455
ER -
Cite this
BibTex
Copy
@article{2018_Ma,
author = {Shuangshuang Zhu and Shiyin Ma and Feng Peng and Shichang Li and 高 涛 Gao Tao},
title = {Novel Phase of AlN4 as a Possible Superhard Material},
journal = {Journal of Physical Chemistry C},
year = {2018},
volume = {122},
publisher = {American Chemical Society (ACS)},
month = {sep},
url = {https://doi.org/10.1021/acs.jpcc.8b07385},
number = {39},
pages = {22660--22666},
doi = {10.1021/acs.jpcc.8b07385}
}
Cite this
MLA
Copy
Ma, Shiyin, et al. “Novel Phase of AlN4 as a Possible Superhard Material.” Journal of Physical Chemistry C, vol. 122, no. 39, Sep. 2018, pp. 22660-22666. https://doi.org/10.1021/acs.jpcc.8b07385.