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Title: Materials Data on Hf5Ir3 by Materials Project

Abstract

Hf5Ir3 crystallizes in the hexagonal P6_122 space group. The structure is three-dimensional. there are four inequivalent Hf sites. In the first Hf site, Hf is bonded in a 4-coordinate geometry to four Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.71–2.97 Å. In the second Hf site, Hf is bonded in a 6-coordinate geometry to six Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.78–2.96 Å. In the third Hf site, Hf is bonded in a 6-coordinate geometry to six Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.71–2.97 Å. In the fourth Hf site, Hf is bonded in a 5-coordinate geometry to five Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.73–2.93 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to nine Hf atoms. In the second Ir site, Ir is bonded in a 8-coordinate geometry to eight Hf atoms.

Publication Date:
Other Number(s):
mp-1212499
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; Hf5Ir3; Hf-Ir
OSTI Identifier:
1724983
DOI:
https://doi.org/10.17188/1724983

Citation Formats

The Materials Project. Materials Data on Hf5Ir3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1724983.
The Materials Project. Materials Data on Hf5Ir3 by Materials Project. United States. doi:https://doi.org/10.17188/1724983
The Materials Project. 2020. "Materials Data on Hf5Ir3 by Materials Project". United States. doi:https://doi.org/10.17188/1724983. https://www.osti.gov/servlets/purl/1724983. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1724983,
title = {Materials Data on Hf5Ir3 by Materials Project},
author = {The Materials Project},
abstractNote = {Hf5Ir3 crystallizes in the hexagonal P6_122 space group. The structure is three-dimensional. there are four inequivalent Hf sites. In the first Hf site, Hf is bonded in a 4-coordinate geometry to four Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.71–2.97 Å. In the second Hf site, Hf is bonded in a 6-coordinate geometry to six Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.78–2.96 Å. In the third Hf site, Hf is bonded in a 6-coordinate geometry to six Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.71–2.97 Å. In the fourth Hf site, Hf is bonded in a 5-coordinate geometry to five Ir atoms. There are a spread of Hf–Ir bond distances ranging from 2.73–2.93 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to nine Hf atoms. In the second Ir site, Ir is bonded in a 8-coordinate geometry to eight Hf atoms.},
doi = {10.17188/1724983},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}