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Title: Materials Data on PH6C2S2N(ClO2)2 (SG:14) 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-555563
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; C2 Cl2 H6 N1 O4 P1 S2; C-Cl-H-N-O-P-S; ICSD-163027
OSTI Identifier:
1268877
DOI:
10.17188/1268877

Citation Formats

Persson, Kristin. Materials Data on PH6C2S2N(ClO2)2 (SG:14) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1268877.
Persson, Kristin. Materials Data on PH6C2S2N(ClO2)2 (SG:14) by Materials Project. United States. doi:10.17188/1268877.
Persson, Kristin. 2016. "Materials Data on PH6C2S2N(ClO2)2 (SG:14) by Materials Project". United States. doi:10.17188/1268877. https://www.osti.gov/servlets/purl/1268877. Pub date:Fri Feb 05 00:00:00 EST 2016
@article{osti_1268877,
title = {Materials Data on PH6C2S2N(ClO2)2 (SG:14) 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 = {10.17188/1268877},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

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