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

Title: Materials Data on NdNO5 by Materials Project

Abstract

NdNO5 crystallizes in the monoclinic P2_1 space group. The structure is two-dimensional and consists of one NdNO5 sheet oriented in the (0, 0, 1) direction. Nd is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Nd–O bond distances ranging from 2.37–2.56 Å. N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.21–1.33 Å. There are five inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to three equivalent Nd atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to three equivalent Nd atoms. In the third O site, O is bonded in a 1-coordinate geometry to two equivalent Nd and one N atom. In the fourth O site, O is bonded in a distorted water-like geometry to one Nd and one N atom. In the fifth O site, O is bonded in a single-bond geometry to one N atom.

Authors:
Publication Date:
Other Number(s):
mp-1104288
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; NdNO5; N-Nd-O
OSTI Identifier:
1731261
DOI:
https://doi.org/10.17188/1731261

Citation Formats

The Materials Project. Materials Data on NdNO5 by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1731261.
The Materials Project. Materials Data on NdNO5 by Materials Project. United States. doi:https://doi.org/10.17188/1731261
The Materials Project. 2018. "Materials Data on NdNO5 by Materials Project". United States. doi:https://doi.org/10.17188/1731261. https://www.osti.gov/servlets/purl/1731261. Pub date:Wed Jul 18 00:00:00 EDT 2018
@article{osti_1731261,
title = {Materials Data on NdNO5 by Materials Project},
author = {The Materials Project},
abstractNote = {NdNO5 crystallizes in the monoclinic P2_1 space group. The structure is two-dimensional and consists of one NdNO5 sheet oriented in the (0, 0, 1) direction. Nd is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Nd–O bond distances ranging from 2.37–2.56 Å. N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.21–1.33 Å. There are five inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to three equivalent Nd atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to three equivalent Nd atoms. In the third O site, O is bonded in a 1-coordinate geometry to two equivalent Nd and one N atom. In the fourth O site, O is bonded in a distorted water-like geometry to one Nd and one N atom. In the fifth O site, O is bonded in a single-bond geometry to one N atom.},
doi = {10.17188/1731261},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}