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Title: Materials Data on ZrH27C8N2Cl5O2 (SG:19) 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-738680
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; C8 Cl5 H27 N2 O2 Zr1; C-Cl-H-N-O-Zr; ICSD-110218
OSTI Identifier:
1287902
DOI:
10.17188/1287902

Citation Formats

Persson, Kristin. Materials Data on ZrH27C8N2Cl5O2 (SG:19) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1287902.
Persson, Kristin. Materials Data on ZrH27C8N2Cl5O2 (SG:19) by Materials Project. United States. doi:10.17188/1287902.
Persson, Kristin. 2016. "Materials Data on ZrH27C8N2Cl5O2 (SG:19) by Materials Project". United States. doi:10.17188/1287902. https://www.osti.gov/servlets/purl/1287902. Pub date:Thu Feb 11 00:00:00 EST 2016
@article{osti_1287902,
title = {Materials Data on ZrH27C8N2Cl5O2 (SG:19) 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 = {10.17188/1287902},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}

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