Materials Data on CoNiP by Materials Project
Abstract
CoNiP crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Co1+ is bonded to four P3- atoms to form CoP4 tetrahedra that share corners with ten equivalent CoP4 tetrahedra, corners with six equivalent NiP5 trigonal bipyramids, edges with two equivalent CoP4 tetrahedra, and edges with six equivalent NiP5 trigonal bipyramids. There are two shorter (2.17 Å) and two longer (2.25 Å) Co–P bond lengths. Ni2+ is bonded to five P3- atoms to form distorted NiP5 trigonal bipyramids that share corners with six equivalent CoP4 tetrahedra, corners with ten equivalent NiP5 trigonal bipyramids, edges with six equivalent CoP4 tetrahedra, and edges with six equivalent NiP5 trigonal bipyramids. There are one shorter (2.30 Å) and four longer (2.44 Å) Ni–P bond lengths. There are two inequivalent P3- sites. In the first P3- site, P3- is bonded in a 9-coordinate geometry to six equivalent Co1+ and three equivalent Ni2+ atoms. In the second P3- site, P3- is bonded in a 9-coordinate geometry to three equivalent Co1+ and six equivalent Ni2+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1226037
- 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; CoNiP; Co-Ni-P
- OSTI Identifier:
- 1711573
- DOI:
- https://doi.org/10.17188/1711573
Citation Formats
The Materials Project. Materials Data on CoNiP by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1711573.
The Materials Project. Materials Data on CoNiP by Materials Project. United States. doi:https://doi.org/10.17188/1711573
The Materials Project. 2020.
"Materials Data on CoNiP by Materials Project". United States. doi:https://doi.org/10.17188/1711573. https://www.osti.gov/servlets/purl/1711573. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1711573,
title = {Materials Data on CoNiP by Materials Project},
author = {The Materials Project},
abstractNote = {CoNiP crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Co1+ is bonded to four P3- atoms to form CoP4 tetrahedra that share corners with ten equivalent CoP4 tetrahedra, corners with six equivalent NiP5 trigonal bipyramids, edges with two equivalent CoP4 tetrahedra, and edges with six equivalent NiP5 trigonal bipyramids. There are two shorter (2.17 Å) and two longer (2.25 Å) Co–P bond lengths. Ni2+ is bonded to five P3- atoms to form distorted NiP5 trigonal bipyramids that share corners with six equivalent CoP4 tetrahedra, corners with ten equivalent NiP5 trigonal bipyramids, edges with six equivalent CoP4 tetrahedra, and edges with six equivalent NiP5 trigonal bipyramids. There are one shorter (2.30 Å) and four longer (2.44 Å) Ni–P bond lengths. There are two inequivalent P3- sites. In the first P3- site, P3- is bonded in a 9-coordinate geometry to six equivalent Co1+ and three equivalent Ni2+ atoms. In the second P3- site, P3- is bonded in a 9-coordinate geometry to three equivalent Co1+ and six equivalent Ni2+ atoms.},
doi = {10.17188/1711573},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}