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Title: Materials Data on Dy11Sn10 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1205010· OSTI ID:1205010

Dy11Sn10 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are four inequivalent Dy sites. In the first Dy site, Dy is bonded to seven Sn atoms to form a mixture of distorted face, edge, and corner-sharing DySn7 pentagonal bipyramids. There are a spread of Dy–Sn bond distances ranging from 3.08–3.46 Å. In the second Dy site, Dy is bonded in a 7-coordinate geometry to seven Sn atoms. There are a spread of Dy–Sn bond distances ranging from 2.94–3.59 Å. In the third Dy site, Dy is bonded in a 9-coordinate geometry to nine Sn atoms. There are a spread of Dy–Sn bond distances ranging from 3.41–3.82 Å. In the fourth Dy site, Dy is bonded in a 7-coordinate geometry to seven Sn atoms. There are a spread of Dy–Sn bond distances ranging from 3.07–3.28 Å. There are five inequivalent Sn sites. In the first Sn site, Sn is bonded in a 8-coordinate geometry to eight Dy atoms. In the second Sn site, Sn is bonded in a 9-coordinate geometry to nine Dy atoms. In the third Sn site, Sn is bonded in a 11-coordinate geometry to seven Dy and four Sn atoms. There are two shorter (3.02 Å) and two longer (3.26 Å) Sn–Sn bond lengths. In the fourth Sn site, Sn is bonded in a 8-coordinate geometry to eight Dy atoms. In the fifth Sn site, Sn is bonded in a 2-coordinate geometry to eight Dy and two Sn atoms. The Sn–Sn bond length is 2.91 Å.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1205010
Report Number(s):
mp-30624
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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