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Title: Materials Data on HfSnIr by Materials Project

Abstract

HfIrSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Hf is bonded in a 11-coordinate geometry to five Ir and six equivalent Sn atoms. There are one shorter (2.91 Å) and four longer (2.92 Å) Hf–Ir bond lengths. There are two shorter (3.10 Å) and four longer (3.17 Å) Hf–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 Hf and six equivalent Sn atoms. All Ir–Sn bond lengths are 2.70 Å. In the second Ir site, Ir is bonded in a 9-coordinate geometry to six equivalent Hf and three equivalent Sn atoms. All Ir–Sn bond lengths are 2.73 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Hf and four Ir atoms.

Authors:
Publication Date:
Other Number(s):
mp-1079038
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; HfSnIr; Hf-Ir-Sn
OSTI Identifier:
1685205
DOI:
https://doi.org/10.17188/1685205

Citation Formats

The Materials Project. Materials Data on HfSnIr by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1685205.
The Materials Project. Materials Data on HfSnIr by Materials Project. United States. doi:https://doi.org/10.17188/1685205
The Materials Project. 2020. "Materials Data on HfSnIr by Materials Project". United States. doi:https://doi.org/10.17188/1685205. https://www.osti.gov/servlets/purl/1685205. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1685205,
title = {Materials Data on HfSnIr by Materials Project},
author = {The Materials Project},
abstractNote = {HfIrSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Hf is bonded in a 11-coordinate geometry to five Ir and six equivalent Sn atoms. There are one shorter (2.91 Å) and four longer (2.92 Å) Hf–Ir bond lengths. There are two shorter (3.10 Å) and four longer (3.17 Å) Hf–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 Hf and six equivalent Sn atoms. All Ir–Sn bond lengths are 2.70 Å. In the second Ir site, Ir is bonded in a 9-coordinate geometry to six equivalent Hf and three equivalent Sn atoms. All Ir–Sn bond lengths are 2.73 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Hf and four Ir atoms.},
doi = {10.17188/1685205},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}