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Title: Materials Data on NbFe3Cu2(PO4)6 (SG:146) 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

Creator(s)/Author(s):
Publication Date:
Other Number(s):
mp-776878
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Cu2 Fe3 Nb1 O24 P6; Cu-Fe-Nb-O-P; ; electronic bandstructure
OSTI Identifier:
1304523
DOI:
10.17188/1304523

Citation Formats

Persson, Kristin. Materials Data on NbFe3Cu2(PO4)6 (SG:146) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1304523.
Persson, Kristin. Materials Data on NbFe3Cu2(PO4)6 (SG:146) by Materials Project. United States. doi:10.17188/1304523.
Persson, Kristin. 2016. "Materials Data on NbFe3Cu2(PO4)6 (SG:146) by Materials Project". United States. doi:10.17188/1304523. https://www.osti.gov/servlets/purl/1304523. Pub date:Fri Apr 22 00:00:00 EDT 2016
@article{osti_1304523,
title = {Materials Data on NbFe3Cu2(PO4)6 (SG:146) by Materials Project},
author = {Persson, Kristin},
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 = {10.17188/1304523},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {4}
}

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