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Title: Materials Data on YGe2Pd by Materials Project

Abstract

YPdGe2 crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 12-coordinate geometry to six equivalent Pd and eight Ge atoms. There are four shorter (3.23 Å) and two longer (3.30 Å) Y–Pd bond lengths. There are six shorter (3.02 Å) and two longer (3.08 Å) Y–Ge bond lengths. In the second Y site, Y is bonded in a 8-coordinate geometry to four equivalent Pd and ten Ge atoms. All Y–Pd bond lengths are 3.25 Å. There are a spread of Y–Ge bond distances ranging from 3.26–3.40 Å. Pd is bonded in a 10-coordinate geometry to five Y and five Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.49–2.68 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Y, two equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.43 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to four Y, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.66 Å. In the third Ge site,more » Ge is bonded in a 2-coordinate geometry to four equivalent Y, two equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.44 Å.« less

Authors:
Publication Date:
Other Number(s):
mp-1207628
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; YGe2Pd; Ge-Pd-Y
OSTI Identifier:
1718495
DOI:
https://doi.org/10.17188/1718495

Citation Formats

The Materials Project. Materials Data on YGe2Pd by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1718495.
The Materials Project. Materials Data on YGe2Pd by Materials Project. United States. doi:https://doi.org/10.17188/1718495
The Materials Project. 2019. "Materials Data on YGe2Pd by Materials Project". United States. doi:https://doi.org/10.17188/1718495. https://www.osti.gov/servlets/purl/1718495. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1718495,
title = {Materials Data on YGe2Pd by Materials Project},
author = {The Materials Project},
abstractNote = {YPdGe2 crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 12-coordinate geometry to six equivalent Pd and eight Ge atoms. There are four shorter (3.23 Å) and two longer (3.30 Å) Y–Pd bond lengths. There are six shorter (3.02 Å) and two longer (3.08 Å) Y–Ge bond lengths. In the second Y site, Y is bonded in a 8-coordinate geometry to four equivalent Pd and ten Ge atoms. All Y–Pd bond lengths are 3.25 Å. There are a spread of Y–Ge bond distances ranging from 3.26–3.40 Å. Pd is bonded in a 10-coordinate geometry to five Y and five Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.49–2.68 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Y, two equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.43 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to four Y, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.66 Å. In the third Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Y, two equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.44 Å.},
doi = {10.17188/1718495},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}