U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on IrC4 by Materials Project
Abstract
IrC4 crystallizes in the trigonal P3_121 space group. The structure is three-dimensional. Ir4+ is bonded in a 8-coordinate geometry to eight C1- atoms. There are a spread of Ir–C bond distances ranging from 2.11–2.27 Å. There are three inequivalent C1- sites. In the first C1- site, C1- is bonded to two equivalent Ir4+ and two C1- atoms to form a mixture of corner and edge-sharing CIr2C2 tetrahedra. There is one shorter (1.50 Å) and one longer (1.51 Å) C–C bond length. In the second C1- site, C1- is bonded to two equivalent Ir4+ and two equivalent C1- atoms to form a mixture of distorted corner and edge-sharing CIr2C2 tetrahedra. In the third C1- site, C1- is bonded to two equivalent Ir4+ and two equivalent C1- atoms to form a mixture of corner and edge-sharing CIr2C2 tetrahedra.
- Publication Date:
- Other Number(s):
- mp-1104673
- 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; C-Ir; crystal structure; IrC4
- OSTI Identifier:
- 1672656
- DOI:
- https://doi.org/10.17188/1672656
Citation Formats
Materials Data on IrC4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1672656.
Materials Data on IrC4 by Materials Project. United States. doi:https://doi.org/10.17188/1672656
2020.
"Materials Data on IrC4 by Materials Project". United States. doi:https://doi.org/10.17188/1672656. https://www.osti.gov/servlets/purl/1672656. Pub date:Fri May 01 20:00:00 EDT 2020
@article{osti_1672656,
title = {Materials Data on IrC4 by Materials Project},
abstractNote = {IrC4 crystallizes in the trigonal P3_121 space group. The structure is three-dimensional. Ir4+ is bonded in a 8-coordinate geometry to eight C1- atoms. There are a spread of Ir–C bond distances ranging from 2.11–2.27 Å. There are three inequivalent C1- sites. In the first C1- site, C1- is bonded to two equivalent Ir4+ and two C1- atoms to form a mixture of corner and edge-sharing CIr2C2 tetrahedra. There is one shorter (1.50 Å) and one longer (1.51 Å) C–C bond length. In the second C1- site, C1- is bonded to two equivalent Ir4+ and two equivalent C1- atoms to form a mixture of distorted corner and edge-sharing CIr2C2 tetrahedra. In the third C1- site, C1- is bonded to two equivalent Ir4+ and two equivalent C1- atoms to form a mixture of corner and edge-sharing CIr2C2 tetrahedra.},
doi = {10.17188/1672656},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}