Materials Data on Sc(Fe2P)2 by Materials Project
Abstract
Sc(Fe2P)2 crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Sc is bonded to six equivalent P atoms to form a mixture of distorted edge and corner-sharing ScP6 octahedra. The corner-sharing octahedral tilt angles are 40°. There are two shorter (2.73 Å) and four longer (2.78 Å) Sc–P bond lengths. Fe is bonded in a 3-coordinate geometry to three equivalent P atoms. There are one shorter (2.24 Å) and two longer (2.29 Å) Fe–P bond lengths. P is bonded in a 9-coordinate geometry to three equivalent Sc and six equivalent Fe atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-510133
- 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; Sc(Fe2P)2; Fe-P-Sc
- OSTI Identifier:
- 1262843
- DOI:
- https://doi.org/10.17188/1262843
Citation Formats
The Materials Project. Materials Data on Sc(Fe2P)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1262843.
The Materials Project. Materials Data on Sc(Fe2P)2 by Materials Project. United States. doi:https://doi.org/10.17188/1262843
The Materials Project. 2020.
"Materials Data on Sc(Fe2P)2 by Materials Project". United States. doi:https://doi.org/10.17188/1262843. https://www.osti.gov/servlets/purl/1262843. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1262843,
title = {Materials Data on Sc(Fe2P)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Sc(Fe2P)2 crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Sc is bonded to six equivalent P atoms to form a mixture of distorted edge and corner-sharing ScP6 octahedra. The corner-sharing octahedral tilt angles are 40°. There are two shorter (2.73 Å) and four longer (2.78 Å) Sc–P bond lengths. Fe is bonded in a 3-coordinate geometry to three equivalent P atoms. There are one shorter (2.24 Å) and two longer (2.29 Å) Fe–P bond lengths. P is bonded in a 9-coordinate geometry to three equivalent Sc and six equivalent Fe atoms.},
doi = {10.17188/1262843},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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