skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on EuH4S2NO8 by Materials Project

Abstract

Eu(SO4)2NH4 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of four ammonium molecules and one Eu(SO4)2 sheet oriented in the (1, 0, 0) direction. In the Eu(SO4)2 sheet, Eu3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.44–2.64 Å. There are two inequivalent S2+ sites. In the first S2+ site, S2+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.51 Å. In the second S2+ site, S2+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.51 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Eu3+ and one S2+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Eu3+ and one S2+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Eu3+ and one S2+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bondmore » geometry to two equivalent Eu3+ and one S2+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to one Eu3+ and one S2+ atom. In the sixth O2- site, O2- is bonded in a distorted water-like geometry to one Eu3+ and one S2+ atom. In the seventh O2- site, O2- is bonded in a single-bond geometry to one S2+ atom. In the eighth O2- site, O2- is bonded in a single-bond geometry to one S2+ atom.« less

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-774926
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; EuH4S2NO8; Eu-H-N-O-S
OSTI Identifier:
1302689
DOI:
10.17188/1302689

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on EuH4S2NO8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1302689.
Persson, Kristin, & Project, Materials. Materials Data on EuH4S2NO8 by Materials Project. United States. doi:10.17188/1302689.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on EuH4S2NO8 by Materials Project". United States. doi:10.17188/1302689. https://www.osti.gov/servlets/purl/1302689. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1302689,
title = {Materials Data on EuH4S2NO8 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Eu(SO4)2NH4 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of four ammonium molecules and one Eu(SO4)2 sheet oriented in the (1, 0, 0) direction. In the Eu(SO4)2 sheet, Eu3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.44–2.64 Å. There are two inequivalent S2+ sites. In the first S2+ site, S2+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.51 Å. In the second S2+ site, S2+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.51 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Eu3+ and one S2+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Eu3+ and one S2+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Eu3+ and one S2+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Eu3+ and one S2+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to one Eu3+ and one S2+ atom. In the sixth O2- site, O2- is bonded in a distorted water-like geometry to one Eu3+ and one S2+ atom. In the seventh O2- site, O2- is bonded in a single-bond geometry to one S2+ atom. In the eighth O2- site, O2- is bonded in a single-bond geometry to one S2+ atom.},
doi = {10.17188/1302689},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}

Dataset:

Save / Share: