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Title: Materials Data on Na2AgAsF6 by Materials Project

Abstract

Na2AgAsF6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent F1- atoms to form distorted NaF12 cuboctahedra that share corners with twelve equivalent NaF12 cuboctahedra, faces with six equivalent NaF12 cuboctahedra, faces with four equivalent AgF6 octahedra, and faces with four equivalent AsF6 octahedra. All Na–F bond lengths are 3.13 Å. Ag1+ is bonded to six equivalent F1- atoms to form AgF6 octahedra that share corners with six equivalent AsF6 octahedra and faces with eight equivalent NaF12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ag–F bond lengths are 2.37 Å. As3+ is bonded to six equivalent F1- atoms to form AsF6 octahedra that share corners with six equivalent AgF6 octahedra and faces with eight equivalent NaF12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All As–F bond lengths are 2.05 Å. F1- is bonded in a linear geometry to four equivalent Na1+, one Ag1+, and one As3+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1111093
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; Na2AgAsF6; Ag-As-F-Na
OSTI Identifier:
1758010
DOI:
https://doi.org/10.17188/1758010

Citation Formats

The Materials Project. Materials Data on Na2AgAsF6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1758010.
The Materials Project. Materials Data on Na2AgAsF6 by Materials Project. United States. doi:https://doi.org/10.17188/1758010
The Materials Project. 2020. "Materials Data on Na2AgAsF6 by Materials Project". United States. doi:https://doi.org/10.17188/1758010. https://www.osti.gov/servlets/purl/1758010. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1758010,
title = {Materials Data on Na2AgAsF6 by Materials Project},
author = {The Materials Project},
abstractNote = {Na2AgAsF6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent F1- atoms to form distorted NaF12 cuboctahedra that share corners with twelve equivalent NaF12 cuboctahedra, faces with six equivalent NaF12 cuboctahedra, faces with four equivalent AgF6 octahedra, and faces with four equivalent AsF6 octahedra. All Na–F bond lengths are 3.13 Å. Ag1+ is bonded to six equivalent F1- atoms to form AgF6 octahedra that share corners with six equivalent AsF6 octahedra and faces with eight equivalent NaF12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ag–F bond lengths are 2.37 Å. As3+ is bonded to six equivalent F1- atoms to form AsF6 octahedra that share corners with six equivalent AgF6 octahedra and faces with eight equivalent NaF12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All As–F bond lengths are 2.05 Å. F1- is bonded in a linear geometry to four equivalent Na1+, one Ag1+, and one As3+ atom.},
doi = {10.17188/1758010},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}