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Title: Materials Data on PaSb2 by Materials Project

Abstract

PaSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa5+ is bonded in a 9-coordinate geometry to nine Sb+2.50- atoms. There are a spread of Pa–Sb bond distances ranging from 3.15–3.26 Å. There are two inequivalent Sb+2.50- sites. In the first Sb+2.50- site, Sb+2.50- is bonded to five equivalent Pa5+ atoms to form a mixture of distorted corner and edge-sharing SbPa5 trigonal bipyramids. In the second Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pa5+ and four equivalent Sb+2.50- atoms. All Sb–Sb bond lengths are 3.06 Å.

Publication Date:
Other Number(s):
mp-1018880
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; Pa-Sb; PaSb2; crystal structure
OSTI Identifier:
1350488
DOI:
https://doi.org/10.17188/1350488

Citation Formats

Materials Data on PaSb2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1350488.
Materials Data on PaSb2 by Materials Project. United States. doi:https://doi.org/10.17188/1350488
2020. "Materials Data on PaSb2 by Materials Project". United States. doi:https://doi.org/10.17188/1350488. https://www.osti.gov/servlets/purl/1350488. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1350488,
title = {Materials Data on PaSb2 by Materials Project},
abstractNote = {PaSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa5+ is bonded in a 9-coordinate geometry to nine Sb+2.50- atoms. There are a spread of Pa–Sb bond distances ranging from 3.15–3.26 Å. There are two inequivalent Sb+2.50- sites. In the first Sb+2.50- site, Sb+2.50- is bonded to five equivalent Pa5+ atoms to form a mixture of distorted corner and edge-sharing SbPa5 trigonal bipyramids. In the second Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pa5+ and four equivalent Sb+2.50- atoms. All Sb–Sb bond lengths are 3.06 Å.},
doi = {10.17188/1350488},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}