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Title: Materials Data on ThGaRh by Materials Project

Abstract

ThRhGa crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Th is bonded in a 11-coordinate geometry to five Rh and six equivalent Ga atoms. There are four shorter (2.99 Å) and one longer (3.01 Å) Th–Rh bond lengths. There are two shorter (3.24 Å) and four longer (3.30 Å) Th–Ga bond lengths. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 9-coordinate geometry to three equivalent Th and six equivalent Ga atoms. All Rh–Ga bond lengths are 2.69 Å. In the second Rh site, Rh is bonded in a 9-coordinate geometry to six equivalent Th and three equivalent Ga atoms. All Rh–Ga bond lengths are 2.83 Å. Ga is bonded in a 4-coordinate geometry to six equivalent Th and four Rh atoms.

Publication Date:
Other Number(s):
mp-1078694
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; ThGaRh; Ga-Rh-Th
OSTI Identifier:
1652561
DOI:
https://doi.org/10.17188/1652561

Citation Formats

The Materials Project. Materials Data on ThGaRh by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1652561.
The Materials Project. Materials Data on ThGaRh by Materials Project. United States. doi:https://doi.org/10.17188/1652561
The Materials Project. 2020. "Materials Data on ThGaRh by Materials Project". United States. doi:https://doi.org/10.17188/1652561. https://www.osti.gov/servlets/purl/1652561. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1652561,
title = {Materials Data on ThGaRh by Materials Project},
author = {The Materials Project},
abstractNote = {ThRhGa crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Th is bonded in a 11-coordinate geometry to five Rh and six equivalent Ga atoms. There are four shorter (2.99 Å) and one longer (3.01 Å) Th–Rh bond lengths. There are two shorter (3.24 Å) and four longer (3.30 Å) Th–Ga bond lengths. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 9-coordinate geometry to three equivalent Th and six equivalent Ga atoms. All Rh–Ga bond lengths are 2.69 Å. In the second Rh site, Rh is bonded in a 9-coordinate geometry to six equivalent Th and three equivalent Ga atoms. All Rh–Ga bond lengths are 2.83 Å. Ga is bonded in a 4-coordinate geometry to six equivalent Th and four Rh atoms.},
doi = {10.17188/1652561},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}