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Title: Materials Data on ZrGeSe by Materials Project

Abstract

ZrGeSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr is bonded in a 9-coordinate geometry to four equivalent Ge and five equivalent Se atoms. All Zr–Ge bond lengths are 2.88 Å. There are four shorter (2.82 Å) and one longer (3.03 Å) Zr–Se bond lengths. Ge is bonded in a 8-coordinate geometry to four equivalent Zr and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.64 Å. Se is bonded in a 5-coordinate geometry to five equivalent Zr atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-4878
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; ZrGeSe; Ge-Se-Zr
OSTI Identifier:
1208460
DOI:
10.17188/1208460

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on ZrGeSe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1208460.
Persson, Kristin, & Project, Materials. Materials Data on ZrGeSe by Materials Project. United States. doi:10.17188/1208460.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on ZrGeSe by Materials Project". United States. doi:10.17188/1208460. https://www.osti.gov/servlets/purl/1208460. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1208460,
title = {Materials Data on ZrGeSe by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {ZrGeSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr is bonded in a 9-coordinate geometry to four equivalent Ge and five equivalent Se atoms. All Zr–Ge bond lengths are 2.88 Å. There are four shorter (2.82 Å) and one longer (3.03 Å) Zr–Se bond lengths. Ge is bonded in a 8-coordinate geometry to four equivalent Zr and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.64 Å. Se is bonded in a 5-coordinate geometry to five equivalent Zr atoms.},
doi = {10.17188/1208460},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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