Title: Materials Data on Sm2Tl by Materials Project

Abstract

Sm2Tl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Sm sites. In the first Sm site, Sm is bonded in a 6-coordinate geometry to eight Sm and six equivalent Tl atoms. There are two shorter (3.44 Å) and six longer (3.62 Å) Sm–Sm bond lengths. All Sm–Tl bond lengths are 3.62 Å. In the second Sm site, Sm is bonded to six equivalent Sm and five equivalent Tl atoms to form a mixture of distorted corner and face-sharing SmSm6Tl5 trigonal bipyramids. There are three shorter (3.19 Å) and two longer (3.44 Å) Sm–Tl bond lengths. Tl is bonded in a 11-coordinate geometry to eleven Sm atoms.

Publication Date:
Other Number(s):
mp-319
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; crystal structure; Sm-Tl; Sm2Tl
OSTI Identifier:
1205963
DOI:
https://doi.org/10.17188/1205963

Citation Formats

Materials Data on Sm2Tl by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205963.
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Materials Data on Sm2Tl by Materials Project. United States. doi:https://doi.org/10.17188/1205963
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2020. "Materials Data on Sm2Tl by Materials Project". United States. doi:https://doi.org/10.17188/1205963. https://www.osti.gov/servlets/purl/1205963. Pub date:Mon Jul 13 20:00:00 EDT 2020
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@article{osti_1205963,
title = {Materials Data on Sm2Tl by Materials Project},
abstractNote = {Sm2Tl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Sm sites. In the first Sm site, Sm is bonded in a 6-coordinate geometry to eight Sm and six equivalent Tl atoms. There are two shorter (3.44 Å) and six longer (3.62 Å) Sm–Sm bond lengths. All Sm–Tl bond lengths are 3.62 Å. In the second Sm site, Sm is bonded to six equivalent Sm and five equivalent Tl atoms to form a mixture of distorted corner and face-sharing SmSm6Tl5 trigonal bipyramids. There are three shorter (3.19 Å) and two longer (3.44 Å) Sm–Tl bond lengths. Tl is bonded in a 11-coordinate geometry to eleven Sm atoms.},
doi = {10.17188/1205963},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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DOI: https://doi.org/10.17188/1205963
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