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Title: Materials Data on CuH12Se(NO)4 (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-707052
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; Cu1 H12 N4 O4 Se1; Cu-H-N-O-Se; ICSD-23190
OSTI Identifier:
1286315
DOI:
10.17188/1286315

Citation Formats

Persson, Kristin. Materials Data on CuH12Se(NO)4 (SG:14) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1286315.
Persson, Kristin. Materials Data on CuH12Se(NO)4 (SG:14) by Materials Project. United States. doi:10.17188/1286315.
Persson, Kristin. 2016. "Materials Data on CuH12Se(NO)4 (SG:14) by Materials Project". United States. doi:10.17188/1286315. https://www.osti.gov/servlets/purl/1286315. Pub date:Mon May 02 00:00:00 EDT 2016
@article{osti_1286315,
title = {Materials Data on CuH12Se(NO)4 (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 = {10.17188/1286315},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {5}
}

Dataset:

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