Materials Data on Co21(B3Mo)2 by Materials Project
Abstract
Co21(MoB3)2 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mo is bonded in a distorted tetrahedral geometry to four equivalent Co atoms. All Mo–Co bond lengths are 2.39 Å. There are three inequivalent Co sites. In the first Co site, Co is bonded in a cuboctahedral geometry to twelve equivalent Co atoms. All Co–Co bond lengths are 2.50 Å. In the second Co site, Co is bonded to one Mo and three equivalent B atoms to form a mixture of corner and edge-sharing CoB3Mo tetrahedra. All Co–B bond lengths are 2.07 Å. In the third Co site, Co is bonded in a distorted bent 150 degrees geometry to one Co and two equivalent B atoms. Both Co–B bond lengths are 2.08 Å. B is bonded in a 8-coordinate geometry to eight Co atoms.
- Authors:
- Publication Date:
- 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)
- Contributing Org.:
- MIT; UC Berkeley; Duke; U Louvain
- OSTI Identifier:
- 1266649
- Report Number(s):
- mp-542728
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Resource Type:
- Data
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; Co21(B3Mo)2; B-Co-Mo
Citation Formats
The Materials Project. Materials Data on Co21(B3Mo)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1266649.
The Materials Project. Materials Data on Co21(B3Mo)2 by Materials Project. United States. https://doi.org/10.17188/1266649
The Materials Project. 2020.
"Materials Data on Co21(B3Mo)2 by Materials Project". United States. https://doi.org/10.17188/1266649. https://www.osti.gov/servlets/purl/1266649.
@article{osti_1266649,
title = {Materials Data on Co21(B3Mo)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Co21(MoB3)2 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mo is bonded in a distorted tetrahedral geometry to four equivalent Co atoms. All Mo–Co bond lengths are 2.39 Å. There are three inequivalent Co sites. In the first Co site, Co is bonded in a cuboctahedral geometry to twelve equivalent Co atoms. All Co–Co bond lengths are 2.50 Å. In the second Co site, Co is bonded to one Mo and three equivalent B atoms to form a mixture of corner and edge-sharing CoB3Mo tetrahedra. All Co–B bond lengths are 2.07 Å. In the third Co site, Co is bonded in a distorted bent 150 degrees geometry to one Co and two equivalent B atoms. Both Co–B bond lengths are 2.08 Å. B is bonded in a 8-coordinate geometry to eight Co atoms.},
doi = {10.17188/1266649},
url = {https://www.osti.gov/biblio/1266649},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jun 24 00:00:00 EDT 2020},
month = {Wed Jun 24 00:00:00 EDT 2020}
}