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Title: Materials Data on Ba6Tl2NCl (SG:225) 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-989542
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; Ba6 Cl1 N1 Tl2; Ba-Cl-N-Tl; ; electronic bandstructure
OSTI Identifier:
1316841
DOI:
10.17188/1316841

Citation Formats

Persson, Kristin. Materials Data on Ba6Tl2NCl (SG:225) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1316841.
Persson, Kristin. Materials Data on Ba6Tl2NCl (SG:225) by Materials Project. United States. doi:10.17188/1316841.
Persson, Kristin. 2016. "Materials Data on Ba6Tl2NCl (SG:225) by Materials Project". United States. doi:10.17188/1316841. https://www.osti.gov/servlets/purl/1316841. Pub date:Thu Feb 11 00:00:00 EST 2016
@article{osti_1316841,
title = {Materials Data on Ba6Tl2NCl (SG:225) 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 = {10.17188/1316841},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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