U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TbCuAs2 by Materials Project
Abstract
TbCuAs2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Tb4+ is bonded in a 8-coordinate geometry to eight As3- atoms. There are four shorter (2.95 Å) and four longer (3.07 Å) Tb–As bond lengths. Cu2+ is bonded to four equivalent As3- atoms to form a mixture of edge and corner-sharing CuAs4 tetrahedra. All Cu–As bond lengths are 2.52 Å. There are two inequivalent As3- sites. In the first As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Tb4+ and four equivalent As3- atoms. All As–As bond lengths are 2.77 Å. In the second As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Tb4+ and four equivalent Cu2+ atoms.
- Publication Date:
- Other Number(s):
- mp-7194
- 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; As-Cu-Tb; TbCuAs2; crystal structure
- OSTI Identifier:
- 1287105
- DOI:
- https://doi.org/10.17188/1287105
Citation Formats
Materials Data on TbCuAs2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1287105.
Materials Data on TbCuAs2 by Materials Project. United States. doi:https://doi.org/10.17188/1287105
2020.
"Materials Data on TbCuAs2 by Materials Project". United States. doi:https://doi.org/10.17188/1287105. https://www.osti.gov/servlets/purl/1287105. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1287105,
title = {Materials Data on TbCuAs2 by Materials Project},
abstractNote = {TbCuAs2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Tb4+ is bonded in a 8-coordinate geometry to eight As3- atoms. There are four shorter (2.95 Å) and four longer (3.07 Å) Tb–As bond lengths. Cu2+ is bonded to four equivalent As3- atoms to form a mixture of edge and corner-sharing CuAs4 tetrahedra. All Cu–As bond lengths are 2.52 Å. There are two inequivalent As3- sites. In the first As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Tb4+ and four equivalent As3- atoms. All As–As bond lengths are 2.77 Å. In the second As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Tb4+ and four equivalent Cu2+ atoms.},
doi = {10.17188/1287105},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.