Materials Data on SrFeMoO5 by Materials Project
SrMoFeO5 crystallizes in the triclinic P1 space group. The structure is three-dimensional. Sr2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Sr–O bond distances ranging from 2.33–2.77 Å. Mo6+ is bonded to five O2- atoms to form MoO5 trigonal bipyramids that share corners with five equivalent FeO5 trigonal bipyramids. There are a spread of Mo–O bond distances ranging from 1.83–1.95 Å. Fe2+ is bonded to five O2- atoms to form FeO5 trigonal bipyramids that share corners with five equivalent MoO5 trigonal bipyramids. There are a spread of Fe–O bond distances ranging from 2.00–2.20 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Sr2+, one Mo6+, and one Fe2+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one Sr2+, one Mo6+, and one Fe2+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to one Sr2+, one Mo6+, and one Fe2+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to one Sr2+, one Mo6+, and one Fe2+ atom. In the fifth O2- site, O2- is bonded in a distorted trigonal planar geometry to one Sr2+, one Mo6+, and one Fe2+ atom.
- Research Organization:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Organization:
- MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- OSTI ID:
- 1284580
- Report Number(s):
- mp-690817
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Sr16Fe6Co2Mo8O45 by Materials Project
Materials Data on Cs4Fe(MoO4)3 by Materials Project