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Title: Materials Data on HoGePd by Materials Project

Abstract

HoPdGe crystallizes in the orthorhombic Pmmn space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are a spread of Ho–Pd bond distances ranging from 2.96–3.15 Å. There are a spread of Ho–Ge bond distances ranging from 3.06–3.25 Å. In the second Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are two shorter (3.10 Å) and four longer (3.13 Å) Ho–Pd bond lengths. There are four shorter (3.10 Å) and two longer (3.22 Å) Ho–Ge bond lengths. In the third Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are four shorter (3.22 Å) and two longer (3.24 Å) Ho–Pd bond lengths. There are two shorter (3.00 Å) and four longer (3.04 Å) Ho–Ge bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 10-coordinate geometry to six Ho, one Pd, and three Ge atoms. The Pd–Pd bond length is 3.02 Å. There are two shorter (2.56 Å) and one longer (2.59 Å)more » Pd–Ge bond lengths. In the second Pd site, Pd is bonded in a 10-coordinate geometry to six Ho and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.58–2.82 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Ho and four Pd atoms. In the second Ge site, Ge is bonded in a 10-coordinate geometry to six Ho, three Pd, and one Ge atom. The Ge–Ge bond length is 2.74 Å.« less

Authors:
Publication Date:
Other Number(s):
mp-1190523
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; HoGePd; Ge-Ho-Pd
OSTI Identifier:
1730780
DOI:
https://doi.org/10.17188/1730780

Citation Formats

The Materials Project. Materials Data on HoGePd by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1730780.
The Materials Project. Materials Data on HoGePd by Materials Project. United States. doi:https://doi.org/10.17188/1730780
The Materials Project. 2020. "Materials Data on HoGePd by Materials Project". United States. doi:https://doi.org/10.17188/1730780. https://www.osti.gov/servlets/purl/1730780. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1730780,
title = {Materials Data on HoGePd by Materials Project},
author = {The Materials Project},
abstractNote = {HoPdGe crystallizes in the orthorhombic Pmmn space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are a spread of Ho–Pd bond distances ranging from 2.96–3.15 Å. There are a spread of Ho–Ge bond distances ranging from 3.06–3.25 Å. In the second Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are two shorter (3.10 Å) and four longer (3.13 Å) Ho–Pd bond lengths. There are four shorter (3.10 Å) and two longer (3.22 Å) Ho–Ge bond lengths. In the third Ho site, Ho is bonded in a 12-coordinate geometry to six Pd and six Ge atoms. There are four shorter (3.22 Å) and two longer (3.24 Å) Ho–Pd bond lengths. There are two shorter (3.00 Å) and four longer (3.04 Å) Ho–Ge bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 10-coordinate geometry to six Ho, one Pd, and three Ge atoms. The Pd–Pd bond length is 3.02 Å. There are two shorter (2.56 Å) and one longer (2.59 Å) Pd–Ge bond lengths. In the second Pd site, Pd is bonded in a 10-coordinate geometry to six Ho and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.58–2.82 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Ho and four Pd atoms. In the second Ge site, Ge is bonded in a 10-coordinate geometry to six Ho, three Pd, and one Ge atom. The Ge–Ge bond length is 2.74 Å.},
doi = {10.17188/1730780},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}