U.S. Department of EnergyOffice of Scientific and Technical Information
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.
- Publication Date:
- Other Number(s):
- mp-754109
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; As-O-Pr; PrAsO4; crystal structure
- OSTI Identifier:
- 1289247
- DOI:
- https://doi.org/10.17188/1289247
Citation Formats
Materials Data on PrAsO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1289247.
Materials Data on PrAsO4 by Materials Project. United States. doi:https://doi.org/10.17188/1289247
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},
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}
}
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