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Title: Materials Data on K2Cu(ClF)2 (SG:64) 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

Authors:
Publication Date:
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)
OSTI Identifier:
1354943
Report Number(s):
mp-1023132
DOE Contract Number:
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Data Type:
Specialized Mix
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; Cl2 Cu1 F2 K2; Cl-Cu-F-K; electronic bandstructure

Citation Formats

Kristin Persson. Materials Data on K2Cu(ClF)2 (SG:64) by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1354943.
Kristin Persson. Materials Data on K2Cu(ClF)2 (SG:64) by Materials Project. United States. doi:10.17188/1354943.
Kristin Persson. Tue . "Materials Data on K2Cu(ClF)2 (SG:64) by Materials Project". United States. doi:10.17188/1354943. https://www.osti.gov/servlets/purl/1354943.
@article{osti_1354943,
title = {Materials Data on K2Cu(ClF)2 (SG:64) by Materials Project},
author = {Kristin Persson},
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 = {10.17188/1354943},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Apr 25 00:00:00 EDT 2017},
month = {Tue Apr 25 00:00:00 EDT 2017}
}

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