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Title: Materials Data on CuHgSCl (SG:51) 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-672253
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; Cl1 Cu1 Hg1 S1; Cl-Cu-Hg-S; ICSD-98872; electronic bandstructure
OSTI Identifier:
1281803
DOI:
10.17188/1281803

Citation Formats

Persson, Kristin. Materials Data on CuHgSCl (SG:51) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1281803.
Persson, Kristin. Materials Data on CuHgSCl (SG:51) by Materials Project. United States. doi:10.17188/1281803.
Persson, Kristin. 2016. "Materials Data on CuHgSCl (SG:51) by Materials Project". United States. doi:10.17188/1281803. https://www.osti.gov/servlets/purl/1281803. Pub date:Wed Feb 10 00:00:00 EST 2016
@article{osti_1281803,
title = {Materials Data on CuHgSCl (SG:51) 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 = {10.17188/1281803},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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