U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZnSnF4 by Materials Project
Abstract
ZnSnF4 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Zn2+ sites. In the first Zn2+ site, Zn2+ is bonded to six F1- atoms to form corner-sharing ZnF6 octahedra. The corner-sharing octahedra tilt angles range from 45–50°. There are a spread of Zn–F bond distances ranging from 2.05–2.11 Å. In the second Zn2+ site, Zn2+ is bonded to six F1- atoms to form corner-sharing ZnF6 octahedra. The corner-sharing octahedra tilt angles range from 45–50°. There are a spread of Zn–F bond distances ranging from 2.03–2.12 Å. There are two inequivalent Sn2+ sites. In the first Sn2+ site, Sn2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sn–F bond distances ranging from 2.17–2.68 Å. In the second Sn2+ site, Sn2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sn–F bond distances ranging from 2.18–2.67 Å. There are eight inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and two Sn2+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and twomore »
- Authors:
- Publication Date:
- Other Number(s):
- mvc-3242
- 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; ZnSnF4; F-Sn-Zn
- OSTI Identifier:
- 1320490
- DOI:
- https://doi.org/10.17188/1320490
Citation Formats
The Materials Project. Materials Data on ZnSnF4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1320490.
The Materials Project. Materials Data on ZnSnF4 by Materials Project. United States. doi:https://doi.org/10.17188/1320490
The Materials Project. 2020.
"Materials Data on ZnSnF4 by Materials Project". United States. doi:https://doi.org/10.17188/1320490. https://www.osti.gov/servlets/purl/1320490. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1320490,
title = {Materials Data on ZnSnF4 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnSnF4 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Zn2+ sites. In the first Zn2+ site, Zn2+ is bonded to six F1- atoms to form corner-sharing ZnF6 octahedra. The corner-sharing octahedra tilt angles range from 45–50°. There are a spread of Zn–F bond distances ranging from 2.05–2.11 Å. In the second Zn2+ site, Zn2+ is bonded to six F1- atoms to form corner-sharing ZnF6 octahedra. The corner-sharing octahedra tilt angles range from 45–50°. There are a spread of Zn–F bond distances ranging from 2.03–2.12 Å. There are two inequivalent Sn2+ sites. In the first Sn2+ site, Sn2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sn–F bond distances ranging from 2.17–2.68 Å. In the second Sn2+ site, Sn2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sn–F bond distances ranging from 2.18–2.67 Å. There are eight inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and two Sn2+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and two Sn2+ atoms. In the third F1- site, F1- is bonded in a 2-coordinate geometry to two Zn2+ and one Sn2+ atom. In the fourth F1- site, F1- is bonded in a 2-coordinate geometry to two Zn2+ and one Sn2+ atom. In the fifth F1- site, F1- is bonded in a 2-coordinate geometry to two Zn2+ and one Sn2+ atom. In the sixth F1- site, F1- is bonded in a distorted trigonal planar geometry to two Zn2+ and one Sn2+ atom. In the seventh F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and two Sn2+ atoms. In the eighth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Zn2+ and two Sn2+ atoms.},
doi = {10.17188/1320490},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}