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Title: Materials Data on Na2Cd11 by Materials Project

Abstract

Cd11Na2 crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Na is bonded in a 12-coordinate geometry to twelve Cd atoms. There are a spread of Na–Cd bond distances ranging from 3.36–3.59 Å. There are five inequivalent Cd sites. In the first Cd site, Cd is bonded in a cuboctahedral geometry to twelve equivalent Cd atoms. All Cd–Cd bond lengths are 3.03 Å. In the second Cd site, Cd is bonded in a 12-coordinate geometry to three equivalent Na and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.90–3.21 Å. In the third Cd site, Cd is bonded in a 10-coordinate geometry to ten Cd atoms. There are a spread of Cd–Cd bond distances ranging from 3.03–3.22 Å. In the fourth Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Na and five Cd atoms. The Cd–Cd bond length is 3.15 Å. In the fifth Cd site, Cd is bonded in a 9-coordinate geometry to three equivalent Na and six Cd atoms.

Publication Date:
Other Number(s):
mp-1203422
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; Na2Cd11; Cd-Na
OSTI Identifier:
1707035
DOI:
https://doi.org/10.17188/1707035

Citation Formats

The Materials Project. Materials Data on Na2Cd11 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1707035.
The Materials Project. Materials Data on Na2Cd11 by Materials Project. United States. doi:https://doi.org/10.17188/1707035
The Materials Project. 2020. "Materials Data on Na2Cd11 by Materials Project". United States. doi:https://doi.org/10.17188/1707035. https://www.osti.gov/servlets/purl/1707035. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1707035,
title = {Materials Data on Na2Cd11 by Materials Project},
author = {The Materials Project},
abstractNote = {Cd11Na2 crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Na is bonded in a 12-coordinate geometry to twelve Cd atoms. There are a spread of Na–Cd bond distances ranging from 3.36–3.59 Å. There are five inequivalent Cd sites. In the first Cd site, Cd is bonded in a cuboctahedral geometry to twelve equivalent Cd atoms. All Cd–Cd bond lengths are 3.03 Å. In the second Cd site, Cd is bonded in a 12-coordinate geometry to three equivalent Na and nine Cd atoms. There are a spread of Cd–Cd bond distances ranging from 2.90–3.21 Å. In the third Cd site, Cd is bonded in a 10-coordinate geometry to ten Cd atoms. There are a spread of Cd–Cd bond distances ranging from 3.03–3.22 Å. In the fourth Cd site, Cd is bonded in a 2-coordinate geometry to two equivalent Na and five Cd atoms. The Cd–Cd bond length is 3.15 Å. In the fifth Cd site, Cd is bonded in a 9-coordinate geometry to three equivalent Na and six Cd atoms.},
doi = {10.17188/1707035},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}