U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TbNiP by Materials Project
Abstract
TbNiP is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of edge and face-sharing TbNi6P6 cuboctahedra. All Tb–Ni bond lengths are 2.95 Å. All Tb–P bond lengths are 3.00 Å. In the second Tb site, Tb is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of edge and face-sharing TbNi6P6 cuboctahedra. All Tb–Ni bond lengths are 3.01 Å. All Tb–P bond lengths are 2.95 Å. Ni is bonded in a 3-coordinate geometry to six Tb and three equivalent P atoms. All Ni–P bond lengths are 2.26 Å. P is bonded in a 3-coordinate geometry to six Tb and three equivalent Ni atoms.
- Publication Date:
- Other Number(s):
- mp-1208320
- 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; crystal structure; Ni-P-Tb; TbNiP
- OSTI Identifier:
- 1752733
- DOI:
- https://doi.org/10.17188/1752733
Citation Formats
Materials Data on TbNiP by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1752733.
Materials Data on TbNiP by Materials Project. United States. doi:https://doi.org/10.17188/1752733
2020.
"Materials Data on TbNiP by Materials Project". United States. doi:https://doi.org/10.17188/1752733. https://www.osti.gov/servlets/purl/1752733. Pub date:Fri May 01 20:00:00 EDT 2020
@article{osti_1752733,
title = {Materials Data on TbNiP by Materials Project},
abstractNote = {TbNiP is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of edge and face-sharing TbNi6P6 cuboctahedra. All Tb–Ni bond lengths are 2.95 Å. All Tb–P bond lengths are 3.00 Å. In the second Tb site, Tb is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of edge and face-sharing TbNi6P6 cuboctahedra. All Tb–Ni bond lengths are 3.01 Å. All Tb–P bond lengths are 2.95 Å. Ni is bonded in a 3-coordinate geometry to six Tb and three equivalent P atoms. All Ni–P bond lengths are 2.26 Å. P is bonded in a 3-coordinate geometry to six Tb and three equivalent Ni atoms.},
doi = {10.17188/1752733},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}