U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ni3P by Materials Project
Abstract
Ni3P crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. there are three inequivalent Ni1+ sites. In the first Ni1+ site, Ni1+ is bonded in a water-like geometry to two equivalent P3- atoms. There are one shorter (2.21 Å) and one longer (2.26 Å) Ni–P bond lengths. In the second Ni1+ site, Ni1+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent P3- atoms. There are a spread of Ni–P bond distances ranging from 2.21–2.35 Å. In the third Ni1+ site, Ni1+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing NiP4 tetrahedra. There are a spread of Ni–P bond distances ranging from 2.29–2.33 Å. P3- is bonded in a 9-coordinate geometry to nine Ni1+ atoms.
- Publication Date:
- Other Number(s):
- mp-2296
- 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; Ni-P; Ni3P; crystal structure
- OSTI Identifier:
- 1199115
- DOI:
- https://doi.org/10.17188/1199115
Citation Formats
Materials Data on Ni3P by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1199115.
Materials Data on Ni3P by Materials Project. United States. doi:https://doi.org/10.17188/1199115
2020.
"Materials Data on Ni3P by Materials Project". United States. doi:https://doi.org/10.17188/1199115. https://www.osti.gov/servlets/purl/1199115. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1199115,
title = {Materials Data on Ni3P by Materials Project},
abstractNote = {Ni3P crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. there are three inequivalent Ni1+ sites. In the first Ni1+ site, Ni1+ is bonded in a water-like geometry to two equivalent P3- atoms. There are one shorter (2.21 Å) and one longer (2.26 Å) Ni–P bond lengths. In the second Ni1+ site, Ni1+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent P3- atoms. There are a spread of Ni–P bond distances ranging from 2.21–2.35 Å. In the third Ni1+ site, Ni1+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing NiP4 tetrahedra. There are a spread of Ni–P bond distances ranging from 2.29–2.33 Å. P3- is bonded in a 9-coordinate geometry to nine Ni1+ atoms.},
doi = {10.17188/1199115},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}