U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TmBi3 by Materials Project
Abstract
TmBi3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Tm is bonded to twelve Bi atoms to form TmBi12 cuboctahedra that share corners with four equivalent TmBi12 cuboctahedra, edges with eight equivalent TmBi12 cuboctahedra, edges with sixteen equivalent BiTm4Bi8 cuboctahedra, faces with four equivalent TmBi12 cuboctahedra, and faces with eight equivalent BiTm4Bi8 cuboctahedra. There are four shorter (3.31 Å) and eight longer (3.61 Å) Tm–Bi bond lengths. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded to four equivalent Tm and eight Bi atoms to form distorted BiTm4Bi8 cuboctahedra that share corners with twelve equivalent BiTm4Bi8 cuboctahedra, edges with eight equivalent TmBi12 cuboctahedra, edges with eight equivalent BiTm4Bi8 cuboctahedra, faces with four equivalent TmBi12 cuboctahedra, and faces with ten equivalent BiTm4Bi8 cuboctahedra. There are four shorter (3.31 Å) and four longer (3.61 Å) Bi–Bi bond lengths. In the second Bi site, Bi is bonded in a square co-planar geometry to four equivalent Tm and eight equivalent Bi atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-971906
- 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; TmBi3; Bi-Tm
- OSTI Identifier:
- 1313664
- DOI:
- https://doi.org/10.17188/1313664
Citation Formats
The Materials Project. Materials Data on TmBi3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1313664.
The Materials Project. Materials Data on TmBi3 by Materials Project. United States. doi:https://doi.org/10.17188/1313664
The Materials Project. 2020.
"Materials Data on TmBi3 by Materials Project". United States. doi:https://doi.org/10.17188/1313664. https://www.osti.gov/servlets/purl/1313664. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1313664,
title = {Materials Data on TmBi3 by Materials Project},
author = {The Materials Project},
abstractNote = {TmBi3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Tm is bonded to twelve Bi atoms to form TmBi12 cuboctahedra that share corners with four equivalent TmBi12 cuboctahedra, edges with eight equivalent TmBi12 cuboctahedra, edges with sixteen equivalent BiTm4Bi8 cuboctahedra, faces with four equivalent TmBi12 cuboctahedra, and faces with eight equivalent BiTm4Bi8 cuboctahedra. There are four shorter (3.31 Å) and eight longer (3.61 Å) Tm–Bi bond lengths. There are two inequivalent Bi sites. In the first Bi site, Bi is bonded to four equivalent Tm and eight Bi atoms to form distorted BiTm4Bi8 cuboctahedra that share corners with twelve equivalent BiTm4Bi8 cuboctahedra, edges with eight equivalent TmBi12 cuboctahedra, edges with eight equivalent BiTm4Bi8 cuboctahedra, faces with four equivalent TmBi12 cuboctahedra, and faces with ten equivalent BiTm4Bi8 cuboctahedra. There are four shorter (3.31 Å) and four longer (3.61 Å) Bi–Bi bond lengths. In the second Bi site, Bi is bonded in a square co-planar geometry to four equivalent Tm and eight equivalent Bi atoms.},
doi = {10.17188/1313664},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}