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Title: Materials Data on As4S11(N6Cl7)2 (SG:114) 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-706455
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; As4 Cl14 N12 S11; As-Cl-N-S; ICSD-61249
OSTI Identifier:
1286189
DOI:
10.17188/1286189

Citation Formats

Persson, Kristin. Materials Data on As4S11(N6Cl7)2 (SG:114) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1286189.
Persson, Kristin. Materials Data on As4S11(N6Cl7)2 (SG:114) by Materials Project. United States. doi:10.17188/1286189.
Persson, Kristin. 2016. "Materials Data on As4S11(N6Cl7)2 (SG:114) by Materials Project". United States. doi:10.17188/1286189. https://www.osti.gov/servlets/purl/1286189. Pub date:Fri Apr 22 00:00:00 EDT 2016
@article{osti_1286189,
title = {Materials Data on As4S11(N6Cl7)2 (SG:114) 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 = {10.17188/1286189},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {4}
}

Dataset:

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