U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Rb2Mn3Se4 by Materials Project
Abstract
Rb2Mn3Se4 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Rb1+ is bonded in a body-centered cubic geometry to eight equivalent Se2- atoms. There are a spread of Rb–Se bond distances ranging from 3.61–3.86 Å. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing MnSe4 tetrahedra. There are two shorter (2.56 Å) and two longer (2.62 Å) Mn–Se bond lengths. In the second Mn2+ site, Mn2+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing MnSe4 tetrahedra. All Mn–Se bond lengths are 2.58 Å. Se2- is bonded in a 3-coordinate geometry to four equivalent Rb1+ and three Mn2+ atoms.
- Publication Date:
- Other Number(s):
- mp-4052
- 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; Mn-Rb-Se; Rb2Mn3Se4; crystal structure
- OSTI Identifier:
- 1207802
- DOI:
- https://doi.org/10.17188/1207802
Citation Formats
Materials Data on Rb2Mn3Se4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1207802.
Materials Data on Rb2Mn3Se4 by Materials Project. United States. doi:https://doi.org/10.17188/1207802
2020.
"Materials Data on Rb2Mn3Se4 by Materials Project". United States. doi:https://doi.org/10.17188/1207802. https://www.osti.gov/servlets/purl/1207802. Pub date:Mon Aug 03 04:00:00 UTC 2020
@article{osti_1207802,
title = {Materials Data on Rb2Mn3Se4 by Materials Project},
abstractNote = {Rb2Mn3Se4 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Rb1+ is bonded in a body-centered cubic geometry to eight equivalent Se2- atoms. There are a spread of Rb–Se bond distances ranging from 3.61–3.86 Å. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing MnSe4 tetrahedra. There are two shorter (2.56 Å) and two longer (2.62 Å) Mn–Se bond lengths. In the second Mn2+ site, Mn2+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing MnSe4 tetrahedra. All Mn–Se bond lengths are 2.58 Å. Se2- is bonded in a 3-coordinate geometry to four equivalent Rb1+ and three Mn2+ atoms.},
doi = {10.17188/1207802},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}