DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Er3Ir by Materials Project

Abstract

Er3Ir is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 2-coordinate geometry to three equivalent Ir atoms. There are a spread of Er–Ir bond distances ranging from 2.84–3.21 Å. In the second Er site, Er is bonded in a distorted bent 150 degrees geometry to two equivalent Ir atoms. There are one shorter (2.75 Å) and one longer (2.84 Å) Er–Ir bond lengths. Ir is bonded in a 6-coordinate geometry to eight Er atoms.

Authors:
Publication Date:
Other Number(s):
mp-1189478
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; Er3Ir; Er-Ir
OSTI Identifier:
1732701
DOI:
https://doi.org/10.17188/1732701

Citation Formats

The Materials Project. Materials Data on Er3Ir by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1732701.
The Materials Project. Materials Data on Er3Ir by Materials Project. United States. doi:https://doi.org/10.17188/1732701
The Materials Project. 2020. "Materials Data on Er3Ir by Materials Project". United States. doi:https://doi.org/10.17188/1732701. https://www.osti.gov/servlets/purl/1732701. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1732701,
title = {Materials Data on Er3Ir by Materials Project},
author = {The Materials Project},
abstractNote = {Er3Ir is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 2-coordinate geometry to three equivalent Ir atoms. There are a spread of Er–Ir bond distances ranging from 2.84–3.21 Å. In the second Er site, Er is bonded in a distorted bent 150 degrees geometry to two equivalent Ir atoms. There are one shorter (2.75 Å) and one longer (2.84 Å) Er–Ir bond lengths. Ir is bonded in a 6-coordinate geometry to eight Er atoms.},
doi = {10.17188/1732701},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}