Title: Materials Data on PaP2 by Materials Project

Abstract

PaP2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa4+ is bonded in a 9-coordinate geometry to nine P2- atoms. There are a spread of Pa–P bond distances ranging from 2.80–2.92 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded to five equivalent Pa4+ atoms to form a mixture of distorted edge and corner-sharing PPa5 trigonal bipyramids. In the second P2- site, P2- is bonded in a 8-coordinate geometry to four equivalent Pa4+ and four equivalent P2- atoms. All P–P bond lengths are 2.73 Å.

Publication Date:
Other Number(s):
mp-1019093
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; crystal structure; P-Pa; PaP2
OSTI Identifier:
1350285
DOI:
https://doi.org/10.17188/1350285

Citation Formats

Materials Data on PaP2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1350285.
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Materials Data on PaP2 by Materials Project. United States. doi:https://doi.org/10.17188/1350285
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2020. "Materials Data on PaP2 by Materials Project". United States. doi:https://doi.org/10.17188/1350285. https://www.osti.gov/servlets/purl/1350285. Pub date:Wed Jul 15 20:00:00 EDT 2020
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@article{osti_1350285,
title = {Materials Data on PaP2 by Materials Project},
abstractNote = {PaP2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa4+ is bonded in a 9-coordinate geometry to nine P2- atoms. There are a spread of Pa–P bond distances ranging from 2.80–2.92 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded to five equivalent Pa4+ atoms to form a mixture of distorted edge and corner-sharing PPa5 trigonal bipyramids. In the second P2- site, P2- is bonded in a 8-coordinate geometry to four equivalent Pa4+ and four equivalent P2- atoms. All P–P bond lengths are 2.73 Å.},
doi = {10.17188/1350285},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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DOI: https://doi.org/10.17188/1350285
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