U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Fe9B4Ir3 by Materials Project
Abstract
Fe9Ir3B4 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are five inequivalent Fe sites. In the first Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.07–2.44 Å. In the second Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.42 Å. In the third Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.36 Å. In the fourth Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.37 Å. In the fifth Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.14–2.58 Å. There are three inequivalent Ir sites. In the first Ir site, Ir is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Ir–B bond distances ranging from 2.14–2.59 Å. In the second Ir site, Ir is bondedmore »
- Publication Date:
- Other Number(s):
- mp-1225266
- 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; B-Fe-Ir; Fe9B4Ir3; crystal structure
- OSTI Identifier:
- 1738018
- DOI:
- https://doi.org/10.17188/1738018
Citation Formats
Materials Data on Fe9B4Ir3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1738018.
Materials Data on Fe9B4Ir3 by Materials Project. United States. doi:https://doi.org/10.17188/1738018
2020.
"Materials Data on Fe9B4Ir3 by Materials Project". United States. doi:https://doi.org/10.17188/1738018. https://www.osti.gov/servlets/purl/1738018. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1738018,
title = {Materials Data on Fe9B4Ir3 by Materials Project},
abstractNote = {Fe9Ir3B4 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are five inequivalent Fe sites. In the first Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.07–2.44 Å. In the second Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.42 Å. In the third Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.36 Å. In the fourth Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.11–2.37 Å. In the fifth Fe site, Fe is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Fe–B bond distances ranging from 2.14–2.58 Å. There are three inequivalent Ir sites. In the first Ir site, Ir is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Ir–B bond distances ranging from 2.14–2.59 Å. In the second Ir site, Ir is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Ir–B bond distances ranging from 2.17–2.55 Å. In the third Ir site, Ir is bonded in a 2-coordinate geometry to three B atoms. There are a spread of Ir–B bond distances ranging from 2.14–2.57 Å. There are four inequivalent B sites. In the first B site, B is bonded in a 9-coordinate geometry to seven Fe and two equivalent Ir atoms. In the second B site, B is bonded in a 9-coordinate geometry to eight Fe and one Ir atom. In the third B site, B is bonded in a 9-coordinate geometry to six Fe and three Ir atoms. In the fourth B site, B is bonded in a 9-coordinate geometry to six Fe and three Ir atoms.},
doi = {10.17188/1738018},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}