Materials Data on Mg4P6Rh7 by Materials Project
Abstract
Mg4Rh7P6 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Mg is bonded to six equivalent Rh and six equivalent P atoms to form MgP6Rh6 cuboctahedra that share corners with twelve equivalent MgP6Rh6 cuboctahedra, faces with six equivalent MgP6Rh6 cuboctahedra, and faces with two equivalent RhP6 octahedra. All Mg–Rh bond lengths are 2.80 Å. All Mg–P bond lengths are 2.85 Å. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded to six equivalent P atoms to form RhP6 octahedra that share faces with eight equivalent MgP6Rh6 cuboctahedra. All Rh–P bond lengths are 2.52 Å. In the second Rh site, Rh is bonded in a 12-coordinate geometry to four equivalent Mg and four equivalent P atoms. All Rh–P bond lengths are 2.44 Å. P is bonded in a 9-coordinate geometry to four equivalent Mg and five Rh atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-20241
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Mg4P6Rh7; Mg-P-Rh
- OSTI Identifier:
- 1195374
- DOI:
- https://doi.org/10.17188/1195374
Citation Formats
The Materials Project. Materials Data on Mg4P6Rh7 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1195374.
The Materials Project. Materials Data on Mg4P6Rh7 by Materials Project. United States. doi:https://doi.org/10.17188/1195374
The Materials Project. 2020.
"Materials Data on Mg4P6Rh7 by Materials Project". United States. doi:https://doi.org/10.17188/1195374. https://www.osti.gov/servlets/purl/1195374. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1195374,
title = {Materials Data on Mg4P6Rh7 by Materials Project},
author = {The Materials Project},
abstractNote = {Mg4Rh7P6 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Mg is bonded to six equivalent Rh and six equivalent P atoms to form MgP6Rh6 cuboctahedra that share corners with twelve equivalent MgP6Rh6 cuboctahedra, faces with six equivalent MgP6Rh6 cuboctahedra, and faces with two equivalent RhP6 octahedra. All Mg–Rh bond lengths are 2.80 Å. All Mg–P bond lengths are 2.85 Å. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded to six equivalent P atoms to form RhP6 octahedra that share faces with eight equivalent MgP6Rh6 cuboctahedra. All Rh–P bond lengths are 2.52 Å. In the second Rh site, Rh is bonded in a 12-coordinate geometry to four equivalent Mg and four equivalent P atoms. All Rh–P bond lengths are 2.44 Å. P is bonded in a 9-coordinate geometry to four equivalent Mg and five Rh atoms.},
doi = {10.17188/1195374},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Jul 14 00:00:00 EDT 2020},
month = {Tue Jul 14 00:00:00 EDT 2020}
}