U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Mn3(CuBi)4 by Materials Project
Abstract
Mn3Cu4Bi4 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mn is bonded in a distorted q6 geometry to four equivalent Cu and six Bi atoms. All Mn–Cu bond lengths are 2.73 Å. There are two shorter (3.01 Å) and four longer (3.04 Å) Mn–Bi bond lengths. Cu is bonded in a 10-coordinate geometry to three equivalent Mn, three equivalent Cu, and four Bi atoms. All Cu–Cu bond lengths are 2.65 Å. There are three shorter (2.82 Å) and one longer (2.93 Å) Cu–Bi bond lengths. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded in a 8-coordinate geometry to four equivalent Mn and four equivalent Cu atoms. In the second Bi site, Bi is bonded in a distorted q6 geometry to six equivalent Mn and four equivalent Cu atoms.
- Publication Date:
- Other Number(s):
- mp-30450
- 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; Bi-Cu-Mn; Mn3(CuBi)4; crystal structure
- OSTI Identifier:
- 1204858
- DOI:
- https://doi.org/10.17188/1204858
Citation Formats
Materials Data on Mn3(CuBi)4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1204858.
Materials Data on Mn3(CuBi)4 by Materials Project. United States. doi:https://doi.org/10.17188/1204858
2020.
"Materials Data on Mn3(CuBi)4 by Materials Project". United States. doi:https://doi.org/10.17188/1204858. https://www.osti.gov/servlets/purl/1204858. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1204858,
title = {Materials Data on Mn3(CuBi)4 by Materials Project},
abstractNote = {Mn3Cu4Bi4 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mn is bonded in a distorted q6 geometry to four equivalent Cu and six Bi atoms. All Mn–Cu bond lengths are 2.73 Å. There are two shorter (3.01 Å) and four longer (3.04 Å) Mn–Bi bond lengths. Cu is bonded in a 10-coordinate geometry to three equivalent Mn, three equivalent Cu, and four Bi atoms. All Cu–Cu bond lengths are 2.65 Å. There are three shorter (2.82 Å) and one longer (2.93 Å) Cu–Bi bond lengths. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded in a 8-coordinate geometry to four equivalent Mn and four equivalent Cu atoms. In the second Bi site, Bi is bonded in a distorted q6 geometry to six equivalent Mn and four equivalent Cu atoms.},
doi = {10.17188/1204858},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Jul 14 04:00:00 UTC 2020},
month = {Tue Jul 14 04:00:00 UTC 2020}
}