U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Sr2InF7 by Materials Project
Abstract
Sr2InF7 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.49–2.73 Å. In the second Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.49–2.71 Å. In3+ is bonded in a distorted pentagonal bipyramidal geometry to seven F1- atoms. There are a spread of In–F bond distances ranging from 2.13–2.23 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded to three Sr2+ and one In3+ atom to form a mixture of edge and corner-sharing FSr3In tetrahedra. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one In3+ atom. In the third F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one In3+ atom. In the fourth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two Sr2+ and one In3+ atom. In the fifth F1- site, F1- is bonded to three Sr2+more »
- Publication Date:
- Other Number(s):
- mp-14283
- 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; F-In-Sr; Sr2InF7; crystal structure
- OSTI Identifier:
- 1190593
- DOI:
- https://doi.org/10.17188/1190593
Citation Formats
Materials Data on Sr2InF7 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1190593.
Materials Data on Sr2InF7 by Materials Project. United States. doi:https://doi.org/10.17188/1190593
2020.
"Materials Data on Sr2InF7 by Materials Project". United States. doi:https://doi.org/10.17188/1190593. https://www.osti.gov/servlets/purl/1190593. Pub date:Wed Jul 15 04:00:00 UTC 2020
@article{osti_1190593,
title = {Materials Data on Sr2InF7 by Materials Project},
abstractNote = {Sr2InF7 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.49–2.73 Å. In the second Sr2+ site, Sr2+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Sr–F bond distances ranging from 2.49–2.71 Å. In3+ is bonded in a distorted pentagonal bipyramidal geometry to seven F1- atoms. There are a spread of In–F bond distances ranging from 2.13–2.23 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded to three Sr2+ and one In3+ atom to form a mixture of edge and corner-sharing FSr3In tetrahedra. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one In3+ atom. In the third F1- site, F1- is bonded in a 3-coordinate geometry to two Sr2+ and one In3+ atom. In the fourth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two Sr2+ and one In3+ atom. In the fifth F1- site, F1- is bonded to three Sr2+ and one In3+ atom to form a mixture of distorted edge and corner-sharing FSr3In tetrahedra. In the sixth F1- site, F1- is bonded to three Sr2+ and one In3+ atom to form a mixture of distorted edge and corner-sharing FSr3In tetrahedra. In the seventh F1- site, F1- is bonded to three Sr2+ and one In3+ atom to form a mixture of edge and corner-sharing FSr3In tetrahedra.},
doi = {10.17188/1190593},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}