skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on CuPH6NO5 (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-733866
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 H6 N1 O5 P1; Cu-H-N-O-P; ICSD-86160
OSTI Identifier:
1287721
DOI:
10.17188/1287721

Citation Formats

Persson, Kristin. Materials Data on CuPH6NO5 (SG:14) by Materials Project. United States: N. p., 2016. Web. doi:10.17188/1287721.
Persson, Kristin. Materials Data on CuPH6NO5 (SG:14) by Materials Project. United States. doi:10.17188/1287721.
Persson, Kristin. 2016. "Materials Data on CuPH6NO5 (SG:14) by Materials Project". United States. doi:10.17188/1287721. https://www.osti.gov/servlets/purl/1287721. Pub date:Mon Mar 28 00:00:00 EDT 2016
@article{osti_1287721,
title = {Materials Data on CuPH6NO5 (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 = {10.17188/1287721},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {3}
}

Dataset:

Save / Share: