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Title: Materials Data on HgH16C6(N2Cl)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-736272
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; C6 Cl2 H16 Hg1 N4; C-Cl-H-Hg-N; ICSD-110581; electronic bandstructure
OSTI Identifier:
1287856
DOI:
10.17188/1287856

Citation Formats

Persson, Kristin. Materials Data on HgH16C6(N2Cl)2 (SG:15) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1287856.
Persson, Kristin. Materials Data on HgH16C6(N2Cl)2 (SG:15) by Materials Project. United States. doi:10.17188/1287856.
Persson, Kristin. 2016. "Materials Data on HgH16C6(N2Cl)2 (SG:15) by Materials Project". United States. doi:10.17188/1287856. https://www.osti.gov/servlets/purl/1287856. Pub date:Thu Feb 04 00:00:00 EST 2016
@article{osti_1287856,
title = {Materials Data on HgH16C6(N2Cl)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 = {10.17188/1287856},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

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