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Title: Materials Data on K2ZnCu3P3O12F (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

Creator(s)/Author(s):
Publication Date:
Other Number(s):
mp-556333
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; Cu3 F1 K2 O12 P3 Zn1; Cu-F-K-O-P-Zn; ICSD-85711; electronic bandstructure
OSTI Identifier:
1269295
DOI:
10.17188/1269295

Citation Formats

Persson, Kristin. Materials Data on K2ZnCu3P3O12F (SG:11) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1269295.
Persson, Kristin. Materials Data on K2ZnCu3P3O12F (SG:11) by Materials Project. United States. doi:10.17188/1269295.
Persson, Kristin. 2016. "Materials Data on K2ZnCu3P3O12F (SG:11) by Materials Project". United States. doi:10.17188/1269295. https://www.osti.gov/servlets/purl/1269295. Pub date:Wed Feb 10 00:00:00 EST 2016
@article{osti_1269295,
title = {Materials Data on K2ZnCu3P3O12F (SG:11) 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 = {10.17188/1269295},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

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