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Title: Materials Data on H10C5SeS2N3Cl (SG:61) 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-600205
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; C5 Cl1 H10 N3 S2 Se1; C-Cl-H-N-S-Se; ICSD-110236
OSTI Identifier:
1268354
DOI:
10.17188/1268354

Citation Formats

Persson, Kristin. Materials Data on H10C5SeS2N3Cl (SG:61) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1268354.
Persson, Kristin. Materials Data on H10C5SeS2N3Cl (SG:61) by Materials Project. United States. doi:10.17188/1268354.
Persson, Kristin. 2016. "Materials Data on H10C5SeS2N3Cl (SG:61) by Materials Project". United States. doi:10.17188/1268354. https://www.osti.gov/servlets/purl/1268354. Pub date:Mon Mar 28 00:00:00 EDT 2016
@article{osti_1268354,
title = {Materials Data on H10C5SeS2N3Cl (SG:61) 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 = {10.17188/1268354},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {3}
}

Dataset:

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