U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Tm5Pb4 by Materials Project
Abstract
Tm5Pb4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent Tm sites. In the first Tm site, Tm is bonded to six Pb atoms to form a mixture of distorted corner, edge, and face-sharing TmPb6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 39–41°. There are a spread of Tm–Pb bond distances ranging from 3.07–3.26 Å. In the second Tm site, Tm is bonded in a 7-coordinate geometry to seven Pb atoms. There are a spread of Tm–Pb bond distances ranging from 3.12–3.85 Å. In the third Tm site, Tm is bonded to six Pb atoms to form a mixture of corner and face-sharing TmPb6 octahedra. The corner-sharing octahedra tilt angles range from 45–51°. There are a spread of Tm–Pb bond distances ranging from 3.09–3.24 Å. There are three inequivalent Pb sites. In the first Pb site, Pb is bonded in a 9-coordinate geometry to eight Tm atoms. In the second Pb site, Pb is bonded in a 7-coordinate geometry to eight Tm atoms. In the third Pb site, Pb is bonded in a 8-coordinate geometry to eight Tm atoms.
- Publication Date:
- Other Number(s):
- mp-1204885
- 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; Pb-Tm; Tm5Pb4; crystal structure
- OSTI Identifier:
- 1672359
- DOI:
- https://doi.org/10.17188/1672359
Citation Formats
Materials Data on Tm5Pb4 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1672359.
Materials Data on Tm5Pb4 by Materials Project. United States. doi:https://doi.org/10.17188/1672359
2019.
"Materials Data on Tm5Pb4 by Materials Project". United States. doi:https://doi.org/10.17188/1672359. https://www.osti.gov/servlets/purl/1672359. Pub date:Fri Jan 11 23:00:00 EST 2019
@article{osti_1672359,
title = {Materials Data on Tm5Pb4 by Materials Project},
abstractNote = {Tm5Pb4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent Tm sites. In the first Tm site, Tm is bonded to six Pb atoms to form a mixture of distorted corner, edge, and face-sharing TmPb6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 39–41°. There are a spread of Tm–Pb bond distances ranging from 3.07–3.26 Å. In the second Tm site, Tm is bonded in a 7-coordinate geometry to seven Pb atoms. There are a spread of Tm–Pb bond distances ranging from 3.12–3.85 Å. In the third Tm site, Tm is bonded to six Pb atoms to form a mixture of corner and face-sharing TmPb6 octahedra. The corner-sharing octahedra tilt angles range from 45–51°. There are a spread of Tm–Pb bond distances ranging from 3.09–3.24 Å. There are three inequivalent Pb sites. In the first Pb site, Pb is bonded in a 9-coordinate geometry to eight Tm atoms. In the second Pb site, Pb is bonded in a 7-coordinate geometry to eight Tm atoms. In the third Pb site, Pb is bonded in a 8-coordinate geometry to eight Tm atoms.},
doi = {10.17188/1672359},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}