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Title: Materials Data on La5Ir2 by Materials Project

Abstract

La5Ir2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent La sites. In the first La site, La is bonded in a distorted bent 150 degrees geometry to three equivalent Ir atoms. There are a spread of La–Ir bond distances ranging from 2.82–3.73 Å. In the second La site, La is bonded to four equivalent Ir atoms to form distorted edge-sharing LaIr4 tetrahedra. There are two shorter (3.05 Å) and two longer (3.07 Å) La–Ir bond lengths. In the third La site, La is bonded in a 3-coordinate geometry to three equivalent Ir atoms. There are a spread of La–Ir bond distances ranging from 2.92–3.33 Å. Ir is bonded in a 7-coordinate geometry to eight La atoms.

Publication Date:
Other Number(s):
mp-1104396
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; La5Ir2; Ir-La
OSTI Identifier:
1749180
DOI:
https://doi.org/10.17188/1749180

Citation Formats

The Materials Project. Materials Data on La5Ir2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1749180.
The Materials Project. Materials Data on La5Ir2 by Materials Project. United States. doi:https://doi.org/10.17188/1749180
The Materials Project. 2020. "Materials Data on La5Ir2 by Materials Project". United States. doi:https://doi.org/10.17188/1749180. https://www.osti.gov/servlets/purl/1749180. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1749180,
title = {Materials Data on La5Ir2 by Materials Project},
author = {The Materials Project},
abstractNote = {La5Ir2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent La sites. In the first La site, La is bonded in a distorted bent 150 degrees geometry to three equivalent Ir atoms. There are a spread of La–Ir bond distances ranging from 2.82–3.73 Å. In the second La site, La is bonded to four equivalent Ir atoms to form distorted edge-sharing LaIr4 tetrahedra. There are two shorter (3.05 Å) and two longer (3.07 Å) La–Ir bond lengths. In the third La site, La is bonded in a 3-coordinate geometry to three equivalent Ir atoms. There are a spread of La–Ir bond distances ranging from 2.92–3.33 Å. Ir is bonded in a 7-coordinate geometry to eight La atoms.},
doi = {10.17188/1749180},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}