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Title: Materials Data on TlFeBr3 (SG:62) 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-504821
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; Br3 Fe1 Tl1; Br-Fe-Tl; ICSD-36217; electronic bandstructure
OSTI Identifier:
1262076
DOI:
10.17188/1262076

Citation Formats

Persson, Kristin. Materials Data on TlFeBr3 (SG:62) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1262076.
Persson, Kristin. Materials Data on TlFeBr3 (SG:62) by Materials Project. United States. doi:10.17188/1262076.
Persson, Kristin. 2016. "Materials Data on TlFeBr3 (SG:62) by Materials Project". United States. doi:10.17188/1262076. https://www.osti.gov/servlets/purl/1262076. Pub date:Wed Feb 10 00:00:00 EST 2016
@article{osti_1262076,
title = {Materials Data on TlFeBr3 (SG:62) 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 = {10.17188/1262076},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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