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Title: Materials Data on Ho11(In3Ge2)2 by Materials Project

Abstract

Ho11(In3Ge2)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are four inequivalent Ho sites. In the first Ho site, Ho is bonded in a 7-coordinate geometry to four equivalent In and three Ge atoms. There are two shorter (3.35 Å) and two longer (3.43 Å) Ho–In bond lengths. There are a spread of Ho–Ge bond distances ranging from 3.06–3.21 Å. In the second Ho site, Ho is bonded in a 5-coordinate geometry to four In and three Ge atoms. There are two shorter (3.07 Å) and two longer (3.33 Å) Ho–In bond lengths. All Ho–Ge bond lengths are 2.99 Å. In the third Ho site, Ho is bonded in a 7-coordinate geometry to three In and four Ge atoms. There are one shorter (3.27 Å) and two longer (3.44 Å) Ho–In bond lengths. There are two shorter (2.82 Å) and two longer (3.33 Å) Ho–Ge bond lengths. In the fourth Ho site, Ho is bonded in a 9-coordinate geometry to eight In and one Ge atom. There are four shorter (3.34 Å) and four longer (3.43 Å) Ho–In bond lengths. The Ho–Ge bond length is 3.52 Å. There are two inequivalent In sites. In the firstmore » In site, In is bonded in a 10-coordinate geometry to eight Ho and two In atoms. There are one shorter (2.93 Å) and one longer (3.05 Å) In–In bond lengths. In the second In site, In is bonded in a 11-coordinate geometry to seven Ho and four In atoms. Both In–In bond lengths are 2.96 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to eight Ho atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to nine Ho atoms. In the third Ge site, Ge is bonded in a 8-coordinate geometry to eight Ho atoms.« less

Publication Date:
Other Number(s):
mp-1201298
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; Ho11(In3Ge2)2; Ge-Ho-In
OSTI Identifier:
1651438
DOI:
https://doi.org/10.17188/1651438

Citation Formats

The Materials Project. Materials Data on Ho11(In3Ge2)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1651438.
The Materials Project. Materials Data on Ho11(In3Ge2)2 by Materials Project. United States. doi:https://doi.org/10.17188/1651438
The Materials Project. 2020. "Materials Data on Ho11(In3Ge2)2 by Materials Project". United States. doi:https://doi.org/10.17188/1651438. https://www.osti.gov/servlets/purl/1651438. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1651438,
title = {Materials Data on Ho11(In3Ge2)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Ho11(In3Ge2)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are four inequivalent Ho sites. In the first Ho site, Ho is bonded in a 7-coordinate geometry to four equivalent In and three Ge atoms. There are two shorter (3.35 Å) and two longer (3.43 Å) Ho–In bond lengths. There are a spread of Ho–Ge bond distances ranging from 3.06–3.21 Å. In the second Ho site, Ho is bonded in a 5-coordinate geometry to four In and three Ge atoms. There are two shorter (3.07 Å) and two longer (3.33 Å) Ho–In bond lengths. All Ho–Ge bond lengths are 2.99 Å. In the third Ho site, Ho is bonded in a 7-coordinate geometry to three In and four Ge atoms. There are one shorter (3.27 Å) and two longer (3.44 Å) Ho–In bond lengths. There are two shorter (2.82 Å) and two longer (3.33 Å) Ho–Ge bond lengths. In the fourth Ho site, Ho is bonded in a 9-coordinate geometry to eight In and one Ge atom. There are four shorter (3.34 Å) and four longer (3.43 Å) Ho–In bond lengths. The Ho–Ge bond length is 3.52 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 10-coordinate geometry to eight Ho and two In atoms. There are one shorter (2.93 Å) and one longer (3.05 Å) In–In bond lengths. In the second In site, In is bonded in a 11-coordinate geometry to seven Ho and four In atoms. Both In–In bond lengths are 2.96 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to eight Ho atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to nine Ho atoms. In the third Ge site, Ge is bonded in a 8-coordinate geometry to eight Ho atoms.},
doi = {10.17188/1651438},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}