U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on YbN3O14 by Materials Project
Abstract
YbN3O14 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two YbN3O14 ribbons oriented in the (1, 0, 0) direction. Yb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Yb–O bond distances ranging from 2.43–2.83 Å. There are three inequivalent N sites. In the first N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. In the second N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. In the third N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. There are fourteen inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Yb and one O atom. The O–O bond length is 1.23 Å. In the second O site, O is bonded in a bent 120 degrees geometry to two O atoms. Theremore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1201991
- 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; YbN3O14; N-O-Yb
- OSTI Identifier:
- 1744980
- DOI:
- https://doi.org/10.17188/1744980
Citation Formats
The Materials Project. Materials Data on YbN3O14 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1744980.
The Materials Project. Materials Data on YbN3O14 by Materials Project. United States. doi:https://doi.org/10.17188/1744980
The Materials Project. 2020.
"Materials Data on YbN3O14 by Materials Project". United States. doi:https://doi.org/10.17188/1744980. https://www.osti.gov/servlets/purl/1744980. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1744980,
title = {Materials Data on YbN3O14 by Materials Project},
author = {The Materials Project},
abstractNote = {YbN3O14 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two YbN3O14 ribbons oriented in the (1, 0, 0) direction. Yb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Yb–O bond distances ranging from 2.43–2.83 Å. There are three inequivalent N sites. In the first N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. In the second N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. In the third N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.23 Å) and two longer (1.28 Å) N–O bond length. There are fourteen inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Yb and one O atom. The O–O bond length is 1.23 Å. In the second O site, O is bonded in a bent 120 degrees geometry to two O atoms. There is one shorter (1.28 Å) and one longer (1.29 Å) O–O bond length. In the third O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the fourth O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the fifth O site, O is bonded in a single-bond geometry to one N atom. In the sixth O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the seventh O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the eighth O site, O is bonded in a single-bond geometry to one N atom. In the ninth O site, O is bonded in a distorted water-like geometry to one Yb and one N atom. In the tenth O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the eleventh O site, O is bonded in a single-bond geometry to one N atom. In the twelfth O site, O is bonded in a single-bond geometry to one O atom. In the thirteenth O site, O is bonded in a bent 150 degrees geometry to one Yb and one O atom. In the fourteenth O site, O is bonded in a bent 150 degrees geometry to one Yb and one O atom.},
doi = {10.17188/1744980},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}