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Title: Materials Data on Ti2Cu3 by Materials Project

Abstract

Ti2Cu3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ti is bonded in a 9-coordinate geometry to nine Cu atoms. There are a spread of Ti–Cu bond distances ranging from 2.63–2.68 Å. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a body-centered cubic geometry to eight equivalent Ti atoms. In the second Cu site, Cu is bonded in a 9-coordinate geometry to five equivalent Ti and four equivalent Cu atoms. All Cu–Cu bond lengths are 2.55 Å.

Publication Date:
Other Number(s):
mp-30599
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; Ti2Cu3; Cu-Ti
OSTI Identifier:
1204986
DOI:
10.17188/1204986

Citation Formats

The Materials Project. Materials Data on Ti2Cu3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204986.
The Materials Project. Materials Data on Ti2Cu3 by Materials Project. United States. doi:10.17188/1204986.
The Materials Project. 2020. "Materials Data on Ti2Cu3 by Materials Project". United States. doi:10.17188/1204986. https://www.osti.gov/servlets/purl/1204986. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1204986,
title = {Materials Data on Ti2Cu3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ti2Cu3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ti is bonded in a 9-coordinate geometry to nine Cu atoms. There are a spread of Ti–Cu bond distances ranging from 2.63–2.68 Å. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a body-centered cubic geometry to eight equivalent Ti atoms. In the second Cu site, Cu is bonded in a 9-coordinate geometry to five equivalent Ti and four equivalent Cu atoms. All Cu–Cu bond lengths are 2.55 Å.},
doi = {10.17188/1204986},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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