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

Title: Materials Data on Th2Cu(NO)2 by Materials Project

Abstract

Th2Cu(NO)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th4+ is bonded in a body-centered cubic geometry to four equivalent N3- and four equivalent O2- atoms. All Th–N bond lengths are 2.36 Å. All Th–O bond lengths are 2.74 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 2.01 Å. N3- is bonded to four equivalent Th4+ atoms to form a mixture of corner and edge-sharing NTh4 tetrahedra. O2- is bonded in a distorted linear geometry to four equivalent Th4+ and two equivalent Cu2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1147743
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Th2Cu(NO)2; Cu-N-O-Th
OSTI Identifier:
1712286
DOI:
https://doi.org/10.17188/1712286

Citation Formats

The Materials Project. Materials Data on Th2Cu(NO)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1712286.
The Materials Project. Materials Data on Th2Cu(NO)2 by Materials Project. United States. doi:https://doi.org/10.17188/1712286
The Materials Project. 2020. "Materials Data on Th2Cu(NO)2 by Materials Project". United States. doi:https://doi.org/10.17188/1712286. https://www.osti.gov/servlets/purl/1712286. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1712286,
title = {Materials Data on Th2Cu(NO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Th2Cu(NO)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th4+ is bonded in a body-centered cubic geometry to four equivalent N3- and four equivalent O2- atoms. All Th–N bond lengths are 2.36 Å. All Th–O bond lengths are 2.74 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 2.01 Å. N3- is bonded to four equivalent Th4+ atoms to form a mixture of corner and edge-sharing NTh4 tetrahedra. O2- is bonded in a distorted linear geometry to four equivalent Th4+ and two equivalent Cu2+ atoms.},
doi = {10.17188/1712286},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}