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Title: Materials Data on ErPaO4 by Materials Project

Abstract

PaErO4 is Fluorite-derived structured and crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Pa5+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Pa–O bond lengths are 2.09 Å. Er3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Er–O bond lengths are 2.07 Å. O2- is bonded to two equivalent Pa5+ and two equivalent Er3+ atoms to form a mixture of edge and corner-sharing OEr2Pa2 tetrahedra.

Publication Date:
Other Number(s):
mp-675871
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; ErPaO4; Er-O-Pa
OSTI Identifier:
1282870
DOI:
https://doi.org/10.17188/1282870

Citation Formats

The Materials Project. Materials Data on ErPaO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1282870.
The Materials Project. Materials Data on ErPaO4 by Materials Project. United States. doi:https://doi.org/10.17188/1282870
The Materials Project. 2020. "Materials Data on ErPaO4 by Materials Project". United States. doi:https://doi.org/10.17188/1282870. https://www.osti.gov/servlets/purl/1282870. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1282870,
title = {Materials Data on ErPaO4 by Materials Project},
author = {The Materials Project},
abstractNote = {PaErO4 is Fluorite-derived structured and crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Pa5+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Pa–O bond lengths are 2.09 Å. Er3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Er–O bond lengths are 2.07 Å. O2- is bonded to two equivalent Pa5+ and two equivalent Er3+ atoms to form a mixture of edge and corner-sharing OEr2Pa2 tetrahedra.},
doi = {10.17188/1282870},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}