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Title: Materials Data on CuH12(BrO6)2 (SG:205) 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-740737
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; Br2 Cu1 H12 O12; Br-Cu-H-O; ICSD-71532
OSTI Identifier:
1287939
DOI:
10.17188/1287939

Citation Formats

Persson, Kristin. Materials Data on CuH12(BrO6)2 (SG:205) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1287939.
Persson, Kristin. Materials Data on CuH12(BrO6)2 (SG:205) by Materials Project. United States. doi:10.17188/1287939.
Persson, Kristin. 2016. "Materials Data on CuH12(BrO6)2 (SG:205) by Materials Project". United States. doi:10.17188/1287939. https://www.osti.gov/servlets/purl/1287939. Pub date:Thu Jul 28 00:00:00 EDT 2016
@article{osti_1287939,
title = {Materials Data on CuH12(BrO6)2 (SG:205) 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 = {10.17188/1287939},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {7}
}

Dataset:

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