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Title: Materials Data on PrAsO4 by Materials Project

Abstract

PrAsO4 is Zircon-like structured and crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are four shorter (2.48 Å) and four longer (2.53 Å) Pr–O bond lengths. As5+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All As–O bond lengths are 1.73 Å. O2- is bonded in a 3-coordinate geometry to two equivalent Pr3+ and one As5+ atom.

Authors:
Publication Date:
Other Number(s):
mp-754109
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; PrAsO4; As-O-Pr
OSTI Identifier:
1289247
DOI:
https://doi.org/10.17188/1289247

Citation Formats

The Materials Project. Materials Data on PrAsO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289247.
The Materials Project. Materials Data on PrAsO4 by Materials Project. United States. doi:https://doi.org/10.17188/1289247
The Materials Project. 2020. "Materials Data on PrAsO4 by Materials Project". United States. doi:https://doi.org/10.17188/1289247. https://www.osti.gov/servlets/purl/1289247. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1289247,
title = {Materials Data on PrAsO4 by Materials Project},
author = {The Materials Project},
abstractNote = {PrAsO4 is Zircon-like structured and crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are four shorter (2.48 Å) and four longer (2.53 Å) Pr–O bond lengths. As5+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All As–O bond lengths are 1.73 Å. O2- is bonded in a 3-coordinate geometry to two equivalent Pr3+ and one As5+ atom.},
doi = {10.17188/1289247},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}