Title: Materials Data on KFeAs2O7 (SG:2) 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-565326
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; As-Fe-K-O; As2 Fe1 K1 O7; crystal structure; electronic bandstructure; ICSD-160288
OSTI Identifier:
1272465
DOI:
https://doi.org/10.17188/1272465

Citation Formats

Materials Data on KFeAs2O7 (SG:2) by Materials Project. United States: N. p., 2014. Web. doi:10.17188/1272465.
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Materials Data on KFeAs2O7 (SG:2) by Materials Project. United States. doi:https://doi.org/10.17188/1272465
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2014. "Materials Data on KFeAs2O7 (SG:2) by Materials Project". United States. doi:https://doi.org/10.17188/1272465. https://www.osti.gov/servlets/purl/1272465. Pub date:Tue Jul 08 20:00:00 EDT 2014
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@article{osti_1272465,
title = {Materials Data on KFeAs2O7 (SG:2) 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 = {10.17188/1272465},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2014},
month = {7}
}
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DOI: https://doi.org/10.17188/1272465
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