U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZrN by Materials Project
Abstract
ZrN is Molybdenum Carbide MAX Phase-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Zr3+ is bonded to six equivalent N3- atoms to form a mixture of distorted edge and corner-sharing ZrN6 pentagonal pyramids. All Zr–N bond lengths are 2.31 Å. N3- is bonded to six equivalent Zr3+ atoms to form a mixture of edge, corner, and face-sharing NZr6 octahedra. The corner-sharing octahedral tilt angles are 47°.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1093992
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; ZrN; N-Zr
- OSTI Identifier:
- 1729305
- DOI:
- https://doi.org/10.17188/1729305
Citation Formats
The Materials Project. Materials Data on ZrN by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1729305.
The Materials Project. Materials Data on ZrN by Materials Project. United States. doi:https://doi.org/10.17188/1729305
The Materials Project. 2020.
"Materials Data on ZrN by Materials Project". United States. doi:https://doi.org/10.17188/1729305. https://www.osti.gov/servlets/purl/1729305. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1729305,
title = {Materials Data on ZrN by Materials Project},
author = {The Materials Project},
abstractNote = {ZrN is Molybdenum Carbide MAX Phase-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Zr3+ is bonded to six equivalent N3- atoms to form a mixture of distorted edge and corner-sharing ZrN6 pentagonal pyramids. All Zr–N bond lengths are 2.31 Å. N3- is bonded to six equivalent Zr3+ atoms to form a mixture of edge, corner, and face-sharing NZr6 octahedra. The corner-sharing octahedral tilt angles are 47°.},
doi = {10.17188/1729305},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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Works referenced in this record:
Production and characterization of hard films of ZrN with temperature variations
journal, August 2005
- Jiménez, H.; Molina, C. M.; Benavides, V.
- physica status solidi (c), Vol. 2, Issue 10
Chemical reactivity of PVD-coated WC–Co tools with steel
journal, January 2007
- Giménez, S.; Huang, S. G.; Van der Biest, O.
- Applied Surface Science, Vol. 253, Issue 7