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Title: Materials Data on SnPO4 by Materials Project

Abstract

SnPO4 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one SnPO4 sheet oriented in the (1, 0, 0) direction. Sn3+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.09–2.24 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of P–O bond distances ranging from 1.56–1.58 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted L-shaped geometry to one Sn3+ and one P5+ atom. In the second O2- site, O2- is bonded in a distorted L-shaped geometry to one Sn3+ and one P5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Sn3+ and one P5+ atom. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Sn3+ and one P5+ atom.

Publication Date:
Other Number(s):
mp-672986
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; SnPO4; O-P-Sn
OSTI Identifier:
1282304
DOI:
https://doi.org/10.17188/1282304

Citation Formats

The Materials Project. Materials Data on SnPO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1282304.
The Materials Project. Materials Data on SnPO4 by Materials Project. United States. doi:https://doi.org/10.17188/1282304
The Materials Project. 2020. "Materials Data on SnPO4 by Materials Project". United States. doi:https://doi.org/10.17188/1282304. https://www.osti.gov/servlets/purl/1282304. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1282304,
title = {Materials Data on SnPO4 by Materials Project},
author = {The Materials Project},
abstractNote = {SnPO4 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one SnPO4 sheet oriented in the (1, 0, 0) direction. Sn3+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.09–2.24 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of P–O bond distances ranging from 1.56–1.58 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted L-shaped geometry to one Sn3+ and one P5+ atom. In the second O2- site, O2- is bonded in a distorted L-shaped geometry to one Sn3+ and one P5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Sn3+ and one P5+ atom. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Sn3+ and one P5+ atom.},
doi = {10.17188/1282304},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}