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Title: Materials Data on DyZn12 by Materials Project

Abstract

DyZn12 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Dy is bonded in a 12-coordinate geometry to twenty Zn atoms. There are a spread of Dy–Zn bond distances ranging from 3.18–3.40 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded to two equivalent Dy and ten Zn atoms to form a mixture of face, edge, and corner-sharing ZnDy2Zn10 cuboctahedra. There are a spread of Zn–Zn bond distances ranging from 2.57–2.74 Å. In the second Zn site, Zn is bonded in a distorted q6 geometry to two equivalent Dy and ten Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.74–2.86 Å. In the third Zn site, Zn is bonded in a 10-coordinate geometry to one Dy and nine Zn atoms. The Zn–Zn bond length is 2.54 Å.

Publication Date:
Other Number(s):
mp-1104551
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; DyZn12; Dy-Zn
OSTI Identifier:
1753016
DOI:
https://doi.org/10.17188/1753016

Citation Formats

The Materials Project. Materials Data on DyZn12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1753016.
The Materials Project. Materials Data on DyZn12 by Materials Project. United States. doi:https://doi.org/10.17188/1753016
The Materials Project. 2020. "Materials Data on DyZn12 by Materials Project". United States. doi:https://doi.org/10.17188/1753016. https://www.osti.gov/servlets/purl/1753016. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1753016,
title = {Materials Data on DyZn12 by Materials Project},
author = {The Materials Project},
abstractNote = {DyZn12 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Dy is bonded in a 12-coordinate geometry to twenty Zn atoms. There are a spread of Dy–Zn bond distances ranging from 3.18–3.40 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded to two equivalent Dy and ten Zn atoms to form a mixture of face, edge, and corner-sharing ZnDy2Zn10 cuboctahedra. There are a spread of Zn–Zn bond distances ranging from 2.57–2.74 Å. In the second Zn site, Zn is bonded in a distorted q6 geometry to two equivalent Dy and ten Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.74–2.86 Å. In the third Zn site, Zn is bonded in a 10-coordinate geometry to one Dy and nine Zn atoms. The Zn–Zn bond length is 2.54 Å.},
doi = {10.17188/1753016},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}