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Title: Materials Data on H14C5(NO)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-556451
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 H14 N2 O2; C-H-N-O; ICSD-110584
OSTI Identifier:
1268412
DOI:
10.17188/1268412

Citation Formats

Persson, Kristin. Materials Data on H14C5(NO)2 (SG:14) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1268412.
Persson, Kristin. Materials Data on H14C5(NO)2 (SG:14) by Materials Project. United States. doi:10.17188/1268412.
Persson, Kristin. 2016. "Materials Data on H14C5(NO)2 (SG:14) by Materials Project". United States. doi:10.17188/1268412. https://www.osti.gov/servlets/purl/1268412. Pub date:Thu Feb 11 00:00:00 EST 2016
@article{osti_1268412,
title = {Materials Data on H14C5(NO)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 = {10.17188/1268412},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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