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Title: Materials Data on KFePO4F 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-6834
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; F-Fe-K-O-P; KFePO4F; crystal structure
OSTI Identifier:
1738581
DOI:
https://doi.org/10.17188/1738581

Citation Formats

Materials Data on KFePO4F by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1738581.
Materials Data on KFePO4F by Materials Project. United States. doi:https://doi.org/10.17188/1738581
2020. "Materials Data on KFePO4F by Materials Project". United States. doi:https://doi.org/10.17188/1738581. https://www.osti.gov/servlets/purl/1738581. Pub date:Thu Apr 30 04:00:00 UTC 2020
@article{osti_1738581,
title = {Materials Data on KFePO4F 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 = {10.17188/1738581},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}