Title: Materials Data on Ba2Fe2S2OF2 (SG:139) by Materials Project

Abstract

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Publication Date:
Other Number(s):
mp-554327
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Ba-F-Fe-O-S; Ba2 F2 Fe2 O1 S2; crystal structure; ICSD-249689
OSTI Identifier:
1267852
DOI:
https://doi.org/10.17188/1267852

Citation Formats

Materials Data on Ba2Fe2S2OF2 (SG:139) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1267852.
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Materials Data on Ba2Fe2S2OF2 (SG:139) by Materials Project. United States. doi:https://doi.org/10.17188/1267852
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2016. "Materials Data on Ba2Fe2S2OF2 (SG:139) by Materials Project". United States. doi:https://doi.org/10.17188/1267852. https://www.osti.gov/servlets/purl/1267852. Pub date:Fri Apr 22 20:00:00 EDT 2016
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@article{osti_1267852,
title = {Materials Data on Ba2Fe2S2OF2 (SG:139) by Materials Project},
abstractNote = {Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations},
doi = {10.17188/1267852},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {4}
}
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DOI: https://doi.org/10.17188/1267852
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