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Title: Materials Data on Pr2SbO2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1282985· OSTI ID:1282985

Pr2SbO2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Pr3+ sites. In the first Pr3+ site, Pr3+ is bonded in a 4-coordinate geometry to four equivalent Sb2- and four O2- atoms. There are a spread of Pr–Sb bond distances ranging from 3.48–3.68 Å. There are a spread of Pr–O bond distances ranging from 2.33–2.37 Å. In the second Pr3+ site, Pr3+ is bonded in a 4-coordinate geometry to four equivalent Sb2- and four O2- atoms. There are a spread of Pr–Sb bond distances ranging from 3.49–3.70 Å. There are a spread of Pr–O bond distances ranging from 2.33–2.36 Å. Sb2- is bonded in a body-centered cubic geometry to eight Pr3+ atoms. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Pr3+ atoms to form a mixture of edge and corner-sharing OPr4 tetrahedra. In the second O2- site, O2- is bonded to four Pr3+ atoms to form a mixture of edge and corner-sharing OPr4 tetrahedra.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1282985
Report Number(s):
mp-676273
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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