Title: Materials Data on ErSnIr by Materials Project

Abstract

ErIrSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to five Ir and six equivalent Sn atoms. There are four shorter (3.00 Å) and one longer (3.05 Å) Er–Ir bond lengths. There are two shorter (3.17 Å) and four longer (3.31 Å) Er–Sn bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to three equivalent Er and six equivalent Sn atoms. All Ir–Sn bond lengths are 2.76 Å. In the second Ir site, Ir is bonded in a 9-coordinate geometry to six equivalent Er and three equivalent Sn atoms. All Ir–Sn bond lengths are 2.81 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Er and four Ir atoms.

Publication Date:
Other Number(s):
mp-1078876
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; Er-Ir-Sn; ErSnIr
OSTI Identifier:
1722048
DOI:
https://doi.org/10.17188/1722048

Citation Formats

Materials Data on ErSnIr by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1722048.
Materials Data on ErSnIr by Materials Project. United States. doi:https://doi.org/10.17188/1722048
2020. "Materials Data on ErSnIr by Materials Project". United States. doi:https://doi.org/10.17188/1722048. https://www.osti.gov/servlets/purl/1722048. Pub date:Fri May 01 20:00:00 EDT 2020
@article{osti_1722048,
title = {Materials Data on ErSnIr by Materials Project},
abstractNote = {ErIrSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to five Ir and six equivalent Sn atoms. There are four shorter (3.00 Å) and one longer (3.05 Å) Er–Ir bond lengths. There are two shorter (3.17 Å) and four longer (3.31 Å) Er–Sn bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to three equivalent Er and six equivalent Sn atoms. All Ir–Sn bond lengths are 2.76 Å. In the second Ir site, Ir is bonded in a 9-coordinate geometry to six equivalent Er and three equivalent Sn atoms. All Ir–Sn bond lengths are 2.81 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Er and four Ir atoms.},
doi = {10.17188/1722048},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}