Materials Data on Dy5B3O13 by Materials Project
Abstract
Dy5B3O13 crystallizes in the hexagonal P6_3/m space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded in a 9-coordinate geometry to nine O atoms. There are six shorter (2.34 Å) and three longer (2.64 Å) Dy–O bond lengths. In the second Dy site, Dy is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Dy–O bond distances ranging from 2.20–2.52 Å. B is bonded in a tetrahedral geometry to four O atoms. There are a spread of B–O bond distances ranging from 1.46–1.49 Å. There are four inequivalent O sites. In the first O site, O is bonded in a trigonal planar geometry to three equivalent Dy atoms. In the second O site, O is bonded in a 4-coordinate geometry to three Dy and one B atom. In the third O site, O is bonded in a 1-coordinate geometry to three Dy and one B atom. In the fourth O site, O is bonded in a distorted single-bond geometry to three Dy and one B atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1212938
- 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; Dy5B3O13; B-Dy-O
- OSTI Identifier:
- 1748515
- DOI:
- https://doi.org/10.17188/1748515
Citation Formats
The Materials Project. Materials Data on Dy5B3O13 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1748515.
The Materials Project. Materials Data on Dy5B3O13 by Materials Project. United States. doi:https://doi.org/10.17188/1748515
The Materials Project. 2020.
"Materials Data on Dy5B3O13 by Materials Project". United States. doi:https://doi.org/10.17188/1748515. https://www.osti.gov/servlets/purl/1748515. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1748515,
title = {Materials Data on Dy5B3O13 by Materials Project},
author = {The Materials Project},
abstractNote = {Dy5B3O13 crystallizes in the hexagonal P6_3/m space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded in a 9-coordinate geometry to nine O atoms. There are six shorter (2.34 Å) and three longer (2.64 Å) Dy–O bond lengths. In the second Dy site, Dy is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Dy–O bond distances ranging from 2.20–2.52 Å. B is bonded in a tetrahedral geometry to four O atoms. There are a spread of B–O bond distances ranging from 1.46–1.49 Å. There are four inequivalent O sites. In the first O site, O is bonded in a trigonal planar geometry to three equivalent Dy atoms. In the second O site, O is bonded in a 4-coordinate geometry to three Dy and one B atom. In the third O site, O is bonded in a 1-coordinate geometry to three Dy and one B atom. In the fourth O site, O is bonded in a distorted single-bond geometry to three Dy and one B atom.},
doi = {10.17188/1748515},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}