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Title: Materials Data on NiP by Materials Project

Abstract

NiP crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Ni2+ sites. In the first Ni2+ site, Ni2+ is bonded in a 5-coordinate geometry to five P2- atoms. There are a spread of Ni–P bond distances ranging from 2.26–2.34 Å. In the second Ni2+ site, Ni2+ is bonded to six P2- atoms to form distorted face-sharing NiP6 octahedra. There are a spread of Ni–P bond distances ranging from 2.28–2.37 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded in a 6-coordinate geometry to six Ni2+ atoms. In the second P2- site, P2- is bonded in a 5-coordinate geometry to five Ni2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1102036
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; NiP; Ni-P
OSTI Identifier:
1749123
DOI:
https://doi.org/10.17188/1749123

Citation Formats

The Materials Project. Materials Data on NiP by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1749123.
The Materials Project. Materials Data on NiP by Materials Project. United States. doi:https://doi.org/10.17188/1749123
The Materials Project. 2020. "Materials Data on NiP by Materials Project". United States. doi:https://doi.org/10.17188/1749123. https://www.osti.gov/servlets/purl/1749123. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1749123,
title = {Materials Data on NiP by Materials Project},
author = {The Materials Project},
abstractNote = {NiP crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Ni2+ sites. In the first Ni2+ site, Ni2+ is bonded in a 5-coordinate geometry to five P2- atoms. There are a spread of Ni–P bond distances ranging from 2.26–2.34 Å. In the second Ni2+ site, Ni2+ is bonded to six P2- atoms to form distorted face-sharing NiP6 octahedra. There are a spread of Ni–P bond distances ranging from 2.28–2.37 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded in a 6-coordinate geometry to six Ni2+ atoms. In the second P2- site, P2- is bonded in a 5-coordinate geometry to five Ni2+ atoms.},
doi = {10.17188/1749123},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}