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Title: Materials Data on Cu3As4H18C8I3(NO2)2 (SG:15) 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-542554
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 C8 Cu3 H18 I3 N2 O4; As-C-Cu-H-I-N-O; ICSD-407043
OSTI Identifier:
1266575
DOI:
10.17188/1266575

Citation Formats

Persson, Kristin. Materials Data on Cu3As4H18C8I3(NO2)2 (SG:15) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1266575.
Persson, Kristin. Materials Data on Cu3As4H18C8I3(NO2)2 (SG:15) by Materials Project. United States. doi:10.17188/1266575.
Persson, Kristin. 2016. "Materials Data on Cu3As4H18C8I3(NO2)2 (SG:15) by Materials Project". United States. doi:10.17188/1266575. https://www.osti.gov/servlets/purl/1266575. Pub date:Thu Feb 11 00:00:00 EST 2016
@article{osti_1266575,
title = {Materials Data on Cu3As4H18C8I3(NO2)2 (SG:15) 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 = {10.17188/1266575},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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