U.S. Department of EnergyOffice of Scientific and Technical Information
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.
- Publication Date:
- Other Number(s):
- mp-1189478
- 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; Er-Ir; Er3Ir; crystal structure
- OSTI Identifier:
- 1732701
- DOI:
- https://doi.org/10.17188/1732701
Citation Formats
Materials Data on Er3Ir by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1732701.
Materials Data on Er3Ir by Materials Project. United States. doi:https://doi.org/10.17188/1732701
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 04:00:00 UTC 2020
@article{osti_1732701,
title = {Materials Data on Er3Ir by 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}
}
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