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Title: Materials Data on Na3GdCl6 by Materials Project

Abstract

Na3GdCl6 is High-temperature superconductor-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight sodium molecules and one NaGdCl6 framework. In the NaGdCl6 framework, Na1+ is bonded to six equivalent Cl1- atoms to form NaCl6 octahedra that share corners with six equivalent GdCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Na–Cl bond lengths are 2.70 Å. Gd3+ is bonded to six equivalent Cl1- atoms to form GdCl6 octahedra that share corners with six equivalent NaCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–Cl bond lengths are 2.65 Å. Cl1- is bonded in a linear geometry to one Na1+ and one Gd3+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1111894
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; Na3GdCl6; Cl-Gd-Na
OSTI Identifier:
1687415
DOI:
https://doi.org/10.17188/1687415

Citation Formats

The Materials Project. Materials Data on Na3GdCl6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1687415.
The Materials Project. Materials Data on Na3GdCl6 by Materials Project. United States. doi:https://doi.org/10.17188/1687415
The Materials Project. 2020. "Materials Data on Na3GdCl6 by Materials Project". United States. doi:https://doi.org/10.17188/1687415. https://www.osti.gov/servlets/purl/1687415. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1687415,
title = {Materials Data on Na3GdCl6 by Materials Project},
author = {The Materials Project},
abstractNote = {Na3GdCl6 is High-temperature superconductor-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight sodium molecules and one NaGdCl6 framework. In the NaGdCl6 framework, Na1+ is bonded to six equivalent Cl1- atoms to form NaCl6 octahedra that share corners with six equivalent GdCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Na–Cl bond lengths are 2.70 Å. Gd3+ is bonded to six equivalent Cl1- atoms to form GdCl6 octahedra that share corners with six equivalent NaCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–Cl bond lengths are 2.65 Å. Cl1- is bonded in a linear geometry to one Na1+ and one Gd3+ atom.},
doi = {10.17188/1687415},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}