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Title: Materials Data on Ba2P7Cl (SG:11) 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

Authors:
Publication Date:
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)
OSTI Identifier:
1275182
Report Number(s):
mp-569613
DOE Contract Number:
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Data Type:
Specialized Mix
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; Ba2 Cl1 P7; Ba-Cl-P; ICSD-24398; electronic bandstructure

Citation Formats

Kristin Persson. Materials Data on Ba2P7Cl (SG:11) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1275182.
Kristin Persson. Materials Data on Ba2P7Cl (SG:11) by Materials Project. United States. doi:10.17188/1275182.
Kristin Persson. 2016. "Materials Data on Ba2P7Cl (SG:11) by Materials Project". United States. doi:10.17188/1275182. https://www.osti.gov/servlets/purl/1275182.
@article{osti_1275182,
title = {Materials Data on Ba2P7Cl (SG:11) by Materials Project},
author = {Kristin Persson},
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 = {10.17188/1275182},
journal = {},
number = ,
volume = ,
place = {United States},
year = 2016,
month = 7
}

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