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Title: Materials Data on SrYCu3Se4 by Materials Project

Abstract

SrYCu3Se4 crystallizes in the cubic P-43m space group. The structure is three-dimensional. Sr2+ is bonded to four equivalent Se2- atoms to form SrSe4 tetrahedra that share corners with four equivalent YSe4 tetrahedra and corners with twelve equivalent CuSe4 tetrahedra. All Sr–Se bond lengths are 2.86 Å. Y3+ is bonded to four equivalent Se2- atoms to form YSe4 tetrahedra that share corners with four equivalent SrSe4 tetrahedra and edges with six equivalent CuSe4 tetrahedra. All Y–Se bond lengths are 2.58 Å. Cu1+ is bonded to four equivalent Se2- atoms to form CuSe4 tetrahedra that share corners with four equivalent SrSe4 tetrahedra, corners with eight equivalent CuSe4 tetrahedra, and edges with two equivalent YSe4 tetrahedra. All Cu–Se bond lengths are 2.68 Å. Se2- is bonded in a distorted pentagonal planar geometry to one Sr2+, one Y3+, and three equivalent Cu1+ atoms.

Publication Date:
Other Number(s):
mp-1179003
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; SrYCu3Se4; Cu-Se-Sr-Y
OSTI Identifier:
1682663
DOI:
https://doi.org/10.17188/1682663

Citation Formats

The Materials Project. Materials Data on SrYCu3Se4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1682663.
The Materials Project. Materials Data on SrYCu3Se4 by Materials Project. United States. doi:https://doi.org/10.17188/1682663
The Materials Project. 2020. "Materials Data on SrYCu3Se4 by Materials Project". United States. doi:https://doi.org/10.17188/1682663. https://www.osti.gov/servlets/purl/1682663. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1682663,
title = {Materials Data on SrYCu3Se4 by Materials Project},
author = {The Materials Project},
abstractNote = {SrYCu3Se4 crystallizes in the cubic P-43m space group. The structure is three-dimensional. Sr2+ is bonded to four equivalent Se2- atoms to form SrSe4 tetrahedra that share corners with four equivalent YSe4 tetrahedra and corners with twelve equivalent CuSe4 tetrahedra. All Sr–Se bond lengths are 2.86 Å. Y3+ is bonded to four equivalent Se2- atoms to form YSe4 tetrahedra that share corners with four equivalent SrSe4 tetrahedra and edges with six equivalent CuSe4 tetrahedra. All Y–Se bond lengths are 2.58 Å. Cu1+ is bonded to four equivalent Se2- atoms to form CuSe4 tetrahedra that share corners with four equivalent SrSe4 tetrahedra, corners with eight equivalent CuSe4 tetrahedra, and edges with two equivalent YSe4 tetrahedra. All Cu–Se bond lengths are 2.68 Å. Se2- is bonded in a distorted pentagonal planar geometry to one Sr2+, one Y3+, and three equivalent Cu1+ atoms.},
doi = {10.17188/1682663},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}