Materials Data on YSeF by Materials Project
Abstract
YSeF crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Y3+ is bonded in a 2-coordinate geometry to five equivalent Se2- and two equivalent F1- atoms. There are a spread of Y–Se bond distances ranging from 2.87–3.17 Å. There are one shorter (2.17 Å) and one longer (2.18 Å) Y–F bond lengths. Se2- is bonded to five equivalent Y3+ and three equivalent F1- atoms to form a mixture of distorted edge and corner-sharing SeY5F3 hexagonal bipyramids. There are a spread of Se–F bond distances ranging from 3.00–3.18 Å. F1- is bonded in a distorted bent 150 degrees geometry to two equivalent Y3+ and three equivalent Se2- atoms.
- Authors:
- Publication Date:
- 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)
- Contributing Org.:
- MIT; UC Berkeley; Duke; U Louvain
- OSTI Identifier:
- 1269178
- Report Number(s):
- mp-556111
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Resource Type:
- Data
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; YSeF; F-Se-Y
Citation Formats
The Materials Project. Materials Data on YSeF by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1269178.
The Materials Project. Materials Data on YSeF by Materials Project. United States. https://doi.org/10.17188/1269178
The Materials Project. 2020.
"Materials Data on YSeF by Materials Project". United States. https://doi.org/10.17188/1269178. https://www.osti.gov/servlets/purl/1269178.
@article{osti_1269178,
title = {Materials Data on YSeF by Materials Project},
author = {The Materials Project},
abstractNote = {YSeF crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Y3+ is bonded in a 2-coordinate geometry to five equivalent Se2- and two equivalent F1- atoms. There are a spread of Y–Se bond distances ranging from 2.87–3.17 Å. There are one shorter (2.17 Å) and one longer (2.18 Å) Y–F bond lengths. Se2- is bonded to five equivalent Y3+ and three equivalent F1- atoms to form a mixture of distorted edge and corner-sharing SeY5F3 hexagonal bipyramids. There are a spread of Se–F bond distances ranging from 3.00–3.18 Å. F1- is bonded in a distorted bent 150 degrees geometry to two equivalent Y3+ and three equivalent Se2- atoms.},
doi = {10.17188/1269178},
url = {https://www.osti.gov/biblio/1269178},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 16 00:00:00 EDT 2020},
month = {Thu Jul 16 00:00:00 EDT 2020}
}
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