DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on NiBi6Rh by Materials Project

Abstract

RhNiBi6 crystallizes in the orthorhombic Pmc2_1 space group. The structure is one-dimensional and consists of two RhNiBi6 ribbons oriented in the (1, 0, 0) direction. Rh is bonded in a 9-coordinate geometry to two equivalent Ni and seven Bi atoms. Both Rh–Ni bond lengths are 2.76 Å. There are a spread of Rh–Bi bond distances ranging from 2.79–2.83 Å. Ni is bonded in a 9-coordinate geometry to two equivalent Rh and seven Bi atoms. There are a spread of Ni–Bi bond distances ranging from 2.71–2.93 Å. There are six inequivalent Bi sites. In the first Bi site, Bi is bonded in a 3-coordinate geometry to two equivalent Rh and one Ni atom. In the second Bi site, Bi is bonded in a 3-coordinate geometry to one Rh and two equivalent Ni atoms. In the third Bi site, Bi is bonded in a 2-coordinate geometry to two equivalent Rh and one Ni atom. In the fourth Bi site, Bi is bonded in a 3-coordinate geometry to one Rh and two equivalent Ni atoms. In the fifth Bi site, Bi is bonded in a distorted single-bond geometry to one Ni atom. In the sixth Bi site, Bi is bonded in a single-bondmore » geometry to one Rh atom.« less

Publication Date:
Other Number(s):
mp-1220131
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; NiBi6Rh; Bi-Ni-Rh
OSTI Identifier:
1724891
DOI:
https://doi.org/10.17188/1724891

Citation Formats

The Materials Project. Materials Data on NiBi6Rh by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1724891.
The Materials Project. Materials Data on NiBi6Rh by Materials Project. United States. doi:https://doi.org/10.17188/1724891
The Materials Project. 2020. "Materials Data on NiBi6Rh by Materials Project". United States. doi:https://doi.org/10.17188/1724891. https://www.osti.gov/servlets/purl/1724891. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1724891,
title = {Materials Data on NiBi6Rh by Materials Project},
author = {The Materials Project},
abstractNote = {RhNiBi6 crystallizes in the orthorhombic Pmc2_1 space group. The structure is one-dimensional and consists of two RhNiBi6 ribbons oriented in the (1, 0, 0) direction. Rh is bonded in a 9-coordinate geometry to two equivalent Ni and seven Bi atoms. Both Rh–Ni bond lengths are 2.76 Å. There are a spread of Rh–Bi bond distances ranging from 2.79–2.83 Å. Ni is bonded in a 9-coordinate geometry to two equivalent Rh and seven Bi atoms. There are a spread of Ni–Bi bond distances ranging from 2.71–2.93 Å. There are six inequivalent Bi sites. In the first Bi site, Bi is bonded in a 3-coordinate geometry to two equivalent Rh and one Ni atom. In the second Bi site, Bi is bonded in a 3-coordinate geometry to one Rh and two equivalent Ni atoms. In the third Bi site, Bi is bonded in a 2-coordinate geometry to two equivalent Rh and one Ni atom. In the fourth Bi site, Bi is bonded in a 3-coordinate geometry to one Rh and two equivalent Ni atoms. In the fifth Bi site, Bi is bonded in a distorted single-bond geometry to one Ni atom. In the sixth Bi site, Bi is bonded in a single-bond geometry to one Rh atom.},
doi = {10.17188/1724891},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}