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Title: Materials Data on Ta9(FeS3)2 (SG:189) 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-3652
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; Fe2 S6 Ta9; Fe-S-Ta; ICSD-202083; electronic bandstructure
OSTI Identifier:
1207189
DOI:
10.17188/1207189

Citation Formats

Persson, Kristin. Materials Data on Ta9(FeS3)2 (SG:189) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1207189.
Persson, Kristin. Materials Data on Ta9(FeS3)2 (SG:189) by Materials Project. United States. doi:10.17188/1207189.
Persson, Kristin. 2016. "Materials Data on Ta9(FeS3)2 (SG:189) by Materials Project". United States. doi:10.17188/1207189. https://www.osti.gov/servlets/purl/1207189. Pub date:Wed Feb 10 00:00:00 EST 2016
@article{osti_1207189,
title = {Materials Data on Ta9(FeS3)2 (SG:189) 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 = {10.17188/1207189},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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