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Title: Materials Data on Ca2AlH10ClO8 (SG:15) 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-42175
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; Al1 Ca2 Cl1 H10 O8; Al-Ca-Cl-H-O; ; electronic bandstructure
OSTI Identifier:
1207971
DOI:
10.17188/1207971

Citation Formats

Persson, Kristin. Materials Data on Ca2AlH10ClO8 (SG:15) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1207971.
Persson, Kristin. Materials Data on Ca2AlH10ClO8 (SG:15) by Materials Project. United States. doi:10.17188/1207971.
Persson, Kristin. 2016. "Materials Data on Ca2AlH10ClO8 (SG:15) by Materials Project". United States. doi:10.17188/1207971. https://www.osti.gov/servlets/purl/1207971. Pub date:Fri Feb 05 00:00:00 EST 2016
@article{osti_1207971,
title = {Materials Data on Ca2AlH10ClO8 (SG:15) 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 = {10.17188/1207971},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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