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Title: Materials Data on Pr2FeSn4 by Materials Project

Abstract

Pr2FeSn4 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 11-coordinate geometry to one Fe and ten Sn atoms. The Pr–Fe bond length is 3.34 Å. There are a spread of Pr–Sn bond distances ranging from 3.32–3.45 Å. In the second Pr site, Pr is bonded in a 10-coordinate geometry to ten Sn atoms. There are a spread of Pr–Sn bond distances ranging from 3.39–3.69 Å. Fe is bonded in a 5-coordinate geometry to one Pr and five Sn atoms. There are a spread of Fe–Sn bond distances ranging from 2.49–2.52 Å. There are four inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to four Pr and two equivalent Fe atoms. In the second Sn site, Sn is bonded in a 2-coordinate geometry to four Pr and two equivalent Fe atoms. In the third Sn site, Sn is bonded in a 1-coordinate geometry to six Pr, one Fe, and two equivalent Sn atoms. Both Sn–Sn bond lengths are 3.06 Å. In the fourth Sn site, Sn is bonded in a 4-coordinate geometry to six Prmore » and two equivalent Sn atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-1220032
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; Pr2FeSn4; Fe-Pr-Sn
OSTI Identifier:
1738687
DOI:
https://doi.org/10.17188/1738687

Citation Formats

The Materials Project. Materials Data on Pr2FeSn4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1738687.
The Materials Project. Materials Data on Pr2FeSn4 by Materials Project. United States. doi:https://doi.org/10.17188/1738687
The Materials Project. 2020. "Materials Data on Pr2FeSn4 by Materials Project". United States. doi:https://doi.org/10.17188/1738687. https://www.osti.gov/servlets/purl/1738687. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1738687,
title = {Materials Data on Pr2FeSn4 by Materials Project},
author = {The Materials Project},
abstractNote = {Pr2FeSn4 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 11-coordinate geometry to one Fe and ten Sn atoms. The Pr–Fe bond length is 3.34 Å. There are a spread of Pr–Sn bond distances ranging from 3.32–3.45 Å. In the second Pr site, Pr is bonded in a 10-coordinate geometry to ten Sn atoms. There are a spread of Pr–Sn bond distances ranging from 3.39–3.69 Å. Fe is bonded in a 5-coordinate geometry to one Pr and five Sn atoms. There are a spread of Fe–Sn bond distances ranging from 2.49–2.52 Å. There are four inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to four Pr and two equivalent Fe atoms. In the second Sn site, Sn is bonded in a 2-coordinate geometry to four Pr and two equivalent Fe atoms. In the third Sn site, Sn is bonded in a 1-coordinate geometry to six Pr, one Fe, and two equivalent Sn atoms. Both Sn–Sn bond lengths are 3.06 Å. In the fourth Sn site, Sn is bonded in a 4-coordinate geometry to six Pr and two equivalent Sn atoms.},
doi = {10.17188/1738687},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}