Materials Data on YNiP by Materials Project
Abstract
YNiP 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 Y sites. In the first Y site, Y is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of face and edge-sharing YNi6P6 cuboctahedra. All Y–Ni bond lengths are 3.01 Å. All Y–P bond lengths are 2.95 Å. In the second Y site, Y is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of face and edge-sharing YNi6P6 cuboctahedra. All Y–Ni bond lengths are 2.96 Å. All Y–P bond lengths are 3.01 Å. Ni is bonded in a 3-coordinate geometry to six Y and three equivalent P atoms. All Ni–P bond lengths are 2.26 Å. P is bonded in a 3-coordinate geometry to six Y and three equivalent Ni atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1102854
- 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; YNiP; Ni-P-Y
- OSTI Identifier:
- 1663474
- DOI:
- https://doi.org/10.17188/1663474
Citation Formats
The Materials Project. Materials Data on YNiP by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1663474.
The Materials Project. Materials Data on YNiP by Materials Project. United States. doi:https://doi.org/10.17188/1663474
The Materials Project. 2020.
"Materials Data on YNiP by Materials Project". United States. doi:https://doi.org/10.17188/1663474. https://www.osti.gov/servlets/purl/1663474. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1663474,
title = {Materials Data on YNiP by Materials Project},
author = {The Materials Project},
abstractNote = {YNiP 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 Y sites. In the first Y site, Y is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of face and edge-sharing YNi6P6 cuboctahedra. All Y–Ni bond lengths are 3.01 Å. All Y–P bond lengths are 2.95 Å. In the second Y site, Y is bonded to six equivalent Ni and six equivalent P atoms to form a mixture of face and edge-sharing YNi6P6 cuboctahedra. All Y–Ni bond lengths are 2.96 Å. All Y–P bond lengths are 3.01 Å. Ni is bonded in a 3-coordinate geometry to six Y and three equivalent P atoms. All Ni–P bond lengths are 2.26 Å. P is bonded in a 3-coordinate geometry to six Y and three equivalent Ni atoms.},
doi = {10.17188/1663474},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}