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Title: Materials Data on ZrIn by Materials Project

Abstract

ZrIn is Tetraauricupride structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Zr is bonded to four equivalent Zr and eight equivalent In atoms to form distorted ZrZr4In8 cuboctahedra that share corners with twelve equivalent ZrZr4In8 cuboctahedra, edges with eight equivalent ZrZr4In8 cuboctahedra, edges with sixteen equivalent InZr8In4 cuboctahedra, faces with eight equivalent InZr8In4 cuboctahedra, and faces with ten equivalent ZrZr4In8 cuboctahedra. All Zr–Zr bond lengths are 3.16 Å. All Zr–In bond lengths are 3.16 Å. In is bonded to eight equivalent Zr and four equivalent In atoms to form distorted InZr8In4 cuboctahedra that share corners with twelve equivalent InZr8In4 cuboctahedra, edges with eight equivalent InZr8In4 cuboctahedra, edges with sixteen equivalent ZrZr4In8 cuboctahedra, faces with eight equivalent ZrZr4In8 cuboctahedra, and faces with ten equivalent InZr8In4 cuboctahedra. All In–In bond lengths are 3.16 Å.

Authors:
Publication Date:
Other Number(s):
mp-1207380
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; ZrIn; In-Zr
OSTI Identifier:
1685302
DOI:
https://doi.org/10.17188/1685302

Citation Formats

The Materials Project. Materials Data on ZrIn by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1685302.
The Materials Project. Materials Data on ZrIn by Materials Project. United States. doi:https://doi.org/10.17188/1685302
The Materials Project. 2020. "Materials Data on ZrIn by Materials Project". United States. doi:https://doi.org/10.17188/1685302. https://www.osti.gov/servlets/purl/1685302. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1685302,
title = {Materials Data on ZrIn by Materials Project},
author = {The Materials Project},
abstractNote = {ZrIn is Tetraauricupride structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Zr is bonded to four equivalent Zr and eight equivalent In atoms to form distorted ZrZr4In8 cuboctahedra that share corners with twelve equivalent ZrZr4In8 cuboctahedra, edges with eight equivalent ZrZr4In8 cuboctahedra, edges with sixteen equivalent InZr8In4 cuboctahedra, faces with eight equivalent InZr8In4 cuboctahedra, and faces with ten equivalent ZrZr4In8 cuboctahedra. All Zr–Zr bond lengths are 3.16 Å. All Zr–In bond lengths are 3.16 Å. In is bonded to eight equivalent Zr and four equivalent In atoms to form distorted InZr8In4 cuboctahedra that share corners with twelve equivalent InZr8In4 cuboctahedra, edges with eight equivalent InZr8In4 cuboctahedra, edges with sixteen equivalent ZrZr4In8 cuboctahedra, faces with eight equivalent ZrZr4In8 cuboctahedra, and faces with ten equivalent InZr8In4 cuboctahedra. All In–In bond lengths are 3.16 Å.},
doi = {10.17188/1685302},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}