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Title: Materials Data on KEuPO4 by Materials Project

Abstract

KEuPO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten O2- atoms. There are a spread of K–O bond distances ranging from 2.67–3.14 Å. Eu2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.59–3.06 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of P–O bond distances ranging from 1.55–1.57 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent K1+, two equivalent Eu2+, and one P5+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one K1+, three equivalent Eu2+, and one P5+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent K1+, two equivalent Eu2+, and one P5+ atom.

Publication Date:
Other Number(s):
mp-18045
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; KEuPO4; Eu-K-O-P
OSTI Identifier:
1192863
DOI:
https://doi.org/10.17188/1192863

Citation Formats

The Materials Project. Materials Data on KEuPO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192863.
The Materials Project. Materials Data on KEuPO4 by Materials Project. United States. doi:https://doi.org/10.17188/1192863
The Materials Project. 2020. "Materials Data on KEuPO4 by Materials Project". United States. doi:https://doi.org/10.17188/1192863. https://www.osti.gov/servlets/purl/1192863. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1192863,
title = {Materials Data on KEuPO4 by Materials Project},
author = {The Materials Project},
abstractNote = {KEuPO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten O2- atoms. There are a spread of K–O bond distances ranging from 2.67–3.14 Å. Eu2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.59–3.06 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of P–O bond distances ranging from 1.55–1.57 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent K1+, two equivalent Eu2+, and one P5+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one K1+, three equivalent Eu2+, and one P5+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent K1+, two equivalent Eu2+, and one P5+ atom.},
doi = {10.17188/1192863},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}