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Title: Materials Data on Rb4Zr6CCl18 (SG:12) 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-862605
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; C1 Cl18 Rb4 Zr6; C-Cl-Rb-Zr; ICSD-165401; electronic bandstructure
OSTI Identifier:
1282077
DOI:
10.17188/1282077

Citation Formats

Persson, Kristin. Materials Data on Rb4Zr6CCl18 (SG:12) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1282077.
Persson, Kristin. Materials Data on Rb4Zr6CCl18 (SG:12) by Materials Project. United States. doi:10.17188/1282077.
Persson, Kristin. 2016. "Materials Data on Rb4Zr6CCl18 (SG:12) by Materials Project". United States. doi:10.17188/1282077. https://www.osti.gov/servlets/purl/1282077. Pub date:Sun Mar 27 00:00:00 EDT 2016
@article{osti_1282077,
title = {Materials Data on Rb4Zr6CCl18 (SG:12) 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 = {10.17188/1282077},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {3}
}

Dataset:

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