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Title: Materials Data on KCaCl3 (SG:148) 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-998421
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; Ca1 Cl3 K1; Ca-Cl-K;
OSTI Identifier:
1317328
DOI:
10.17188/1317328

Citation Formats

Persson, Kristin. Materials Data on KCaCl3 (SG:148) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1317328.
Persson, Kristin. Materials Data on KCaCl3 (SG:148) by Materials Project. United States. doi:10.17188/1317328.
Persson, Kristin. 2016. "Materials Data on KCaCl3 (SG:148) by Materials Project". United States. doi:10.17188/1317328. https://www.osti.gov/servlets/purl/1317328. Pub date:Sun May 15 00:00:00 EDT 2016
@article{osti_1317328,
title = {Materials Data on KCaCl3 (SG:148) 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 = {10.17188/1317328},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {5}
}

Dataset:

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