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Title: Materials Data on MnH9CNCl3O2 (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

Authors:
Publication Date:
Other Number(s):
mp-743948
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; C1 Cl3 H9 Mn1 N1 O2; C-Cl-H-Mn-N-O; ICSD-110693; electronic bandstructure
OSTI Identifier:
1268407
DOI:
10.17188/1268407

Citation Formats

Persson, Kristin. Materials Data on MnH9CNCl3O2 (SG:14) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1268407.
Persson, Kristin. Materials Data on MnH9CNCl3O2 (SG:14) by Materials Project. United States. doi:10.17188/1268407.
Persson, Kristin. 2016. "Materials Data on MnH9CNCl3O2 (SG:14) by Materials Project". United States. doi:10.17188/1268407. https://www.osti.gov/servlets/purl/1268407. Pub date:Thu Feb 11 00:00:00 EST 2016
@article{osti_1268407,
title = {Materials Data on MnH9CNCl3O2 (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 = {10.17188/1268407},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

Dataset:

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