U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Li2PtF6 by Materials Project
Abstract
Li2PtF6 is Hydrophilite-derived structured and crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Li1+ is bonded to six F1- atoms to form LiF6 octahedra that share corners with four equivalent LiF6 octahedra, corners with four equivalent PtF6 octahedra, an edgeedge with one LiF6 octahedra, and an edgeedge with one PtF6 octahedra. The corner-sharing octahedra tilt angles range from 48–53°. There are a spread of Li–F bond distances ranging from 2.05–2.08 Å. Pt4+ is bonded to six F1- atoms to form PtF6 octahedra that share corners with eight equivalent LiF6 octahedra and edges with two equivalent LiF6 octahedra. The corner-sharing octahedra tilt angles range from 48–49°. All Pt–F bond lengths are 1.98 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Pt4+ atom. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Pt4+ atom.
- Publication Date:
- Other Number(s):
- mp-13986
- 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-Li-Pt; Li2PtF6; crystal structure
- OSTI Identifier:
- 1189861
- DOI:
- https://doi.org/10.17188/1189861
Citation Formats
Materials Data on Li2PtF6 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1189861.
Materials Data on Li2PtF6 by Materials Project. United States. doi:https://doi.org/10.17188/1189861
2017.
"Materials Data on Li2PtF6 by Materials Project". United States. doi:https://doi.org/10.17188/1189861. https://www.osti.gov/servlets/purl/1189861. Pub date:Thu May 11 00:00:00 EDT 2017
@article{osti_1189861,
title = {Materials Data on Li2PtF6 by Materials Project},
abstractNote = {Li2PtF6 is Hydrophilite-derived structured and crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Li1+ is bonded to six F1- atoms to form LiF6 octahedra that share corners with four equivalent LiF6 octahedra, corners with four equivalent PtF6 octahedra, an edgeedge with one LiF6 octahedra, and an edgeedge with one PtF6 octahedra. The corner-sharing octahedra tilt angles range from 48–53°. There are a spread of Li–F bond distances ranging from 2.05–2.08 Å. Pt4+ is bonded to six F1- atoms to form PtF6 octahedra that share corners with eight equivalent LiF6 octahedra and edges with two equivalent LiF6 octahedra. The corner-sharing octahedra tilt angles range from 48–49°. All Pt–F bond lengths are 1.98 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Pt4+ atom. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Pt4+ atom.},
doi = {10.17188/1189861},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}