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Title: Materials Data on UCr3 by Materials Project

Abstract

UCr3 is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are a spread of U–Cr bond distances ranging from 2.64–3.11 Å. In the second U site, U is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are a spread of U–Cr bond distances ranging from 2.64–3.11 Å. There are three inequivalent Cr sites. In the first Cr site, Cr is bonded in a 8-coordinate geometry to four U and four Cr atoms. All Cr–Cr bond lengths are 2.64 Å. In the second Cr site, Cr is bonded in a 8-coordinate geometry to six U and eight equivalent Cr atoms. In the third Cr site, Cr is bonded in a 8-coordinate geometry to six U and eight equivalent Cr atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-981233
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; UCr3; Cr-U
OSTI Identifier:
1272861
DOI:
10.17188/1272861

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on UCr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1272861.
Persson, Kristin, & Project, Materials. Materials Data on UCr3 by Materials Project. United States. doi:10.17188/1272861.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on UCr3 by Materials Project". United States. doi:10.17188/1272861. https://www.osti.gov/servlets/purl/1272861. Pub date:Tue Jul 21 00:00:00 EDT 2020
@article{osti_1272861,
title = {Materials Data on UCr3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {UCr3 is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are a spread of U–Cr bond distances ranging from 2.64–3.11 Å. In the second U site, U is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are a spread of U–Cr bond distances ranging from 2.64–3.11 Å. There are three inequivalent Cr sites. In the first Cr site, Cr is bonded in a 8-coordinate geometry to four U and four Cr atoms. All Cr–Cr bond lengths are 2.64 Å. In the second Cr site, Cr is bonded in a 8-coordinate geometry to six U and eight equivalent Cr atoms. In the third Cr site, Cr is bonded in a 8-coordinate geometry to six U and eight equivalent Cr atoms.},
doi = {10.17188/1272861},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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