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Title: Materials Data on Li(YGe)4 by Materials Project

Abstract

Li(YGe)4 is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li is bonded in a distorted T-shaped geometry to five Ge atoms. There are a spread of Li–Ge bond distances ranging from 2.71–3.17 Å. There are two inequivalent Y sites. In the first Y site, Y is bonded in a 6-coordinate geometry to six Ge atoms. There are a spread of Y–Ge bond distances ranging from 2.87–3.04 Å. In the second Y site, Y is bonded in a 7-coordinate geometry to seven Ge atoms. There are a spread of Y–Ge bond distances ranging from 2.99–3.40 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to one Li, six Y, and one Ge atom. The Ge–Ge bond length is 2.57 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to two equivalent Li, six Y, and one Ge atom. In the third Ge site, Ge is bonded in a 9-coordinate geometry to one Li, seven Y, and one Ge atom. The Ge–Ge bond length is 2.68 Å.

Publication Date:
Other Number(s):
mp-1210940
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; Li(YGe)4; Ge-Li-Y
OSTI Identifier:
1727485
DOI:
https://doi.org/10.17188/1727485

Citation Formats

The Materials Project. Materials Data on Li(YGe)4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1727485.
The Materials Project. Materials Data on Li(YGe)4 by Materials Project. United States. doi:https://doi.org/10.17188/1727485
The Materials Project. 2020. "Materials Data on Li(YGe)4 by Materials Project". United States. doi:https://doi.org/10.17188/1727485. https://www.osti.gov/servlets/purl/1727485. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1727485,
title = {Materials Data on Li(YGe)4 by Materials Project},
author = {The Materials Project},
abstractNote = {Li(YGe)4 is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li is bonded in a distorted T-shaped geometry to five Ge atoms. There are a spread of Li–Ge bond distances ranging from 2.71–3.17 Å. There are two inequivalent Y sites. In the first Y site, Y is bonded in a 6-coordinate geometry to six Ge atoms. There are a spread of Y–Ge bond distances ranging from 2.87–3.04 Å. In the second Y site, Y is bonded in a 7-coordinate geometry to seven Ge atoms. There are a spread of Y–Ge bond distances ranging from 2.99–3.40 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to one Li, six Y, and one Ge atom. The Ge–Ge bond length is 2.57 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to two equivalent Li, six Y, and one Ge atom. In the third Ge site, Ge is bonded in a 9-coordinate geometry to one Li, seven Y, and one Ge atom. The Ge–Ge bond length is 2.68 Å.},
doi = {10.17188/1727485},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}