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Title: Materials Data on Zr2N by Materials Project

Abstract

Zr2N is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Zr is bonded in a distorted T-shaped geometry to three equivalent N atoms. There are one shorter (2.27 Å) and two longer (2.29 Å) Zr–N bond lengths. N is bonded to six equivalent Zr atoms to form a mixture of corner and edge-sharing NZr6 octahedra. The corner-sharing octahedral tilt angles are 47°.

Publication Date:
Other Number(s):
mp-1014265
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Zr2N; N-Zr
OSTI Identifier:
1337295
DOI:
10.17188/1337295

Citation Formats

The Materials Project. Materials Data on Zr2N by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1337295.
The Materials Project. Materials Data on Zr2N by Materials Project. United States. doi:10.17188/1337295.
The Materials Project. 2020. "Materials Data on Zr2N by Materials Project". United States. doi:10.17188/1337295. https://www.osti.gov/servlets/purl/1337295. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1337295,
title = {Materials Data on Zr2N by Materials Project},
author = {The Materials Project},
abstractNote = {Zr2N is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Zr is bonded in a distorted T-shaped geometry to three equivalent N atoms. There are one shorter (2.27 Å) and two longer (2.29 Å) Zr–N bond lengths. N is bonded to six equivalent Zr atoms to form a mixture of corner and edge-sharing NZr6 octahedra. The corner-sharing octahedral tilt angles are 47°.},
doi = {10.17188/1337295},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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