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Title: Materials Data on Rb2PbO3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1196941· OSTI ID:1196941

Rb2PbO3 is Krennerite-derived structured and crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.82–3.23 Å. Pb4+ is bonded to five O2- atoms to form distorted edge-sharing PbO5 trigonal bipyramids. There are a spread of Pb–O bond distances ranging from 2.06–2.23 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to four equivalent Rb1+ and one Pb4+ atom. In the second O2- site, O2- is bonded to four equivalent Rb1+ and two equivalent Pb4+ atoms to form a mixture of distorted corner, edge, and face-sharing ORb4Pb2 octahedra. The corner-sharing octahedra tilt angles range from 37–49°.

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:
1196941
Report Number(s):
mp-21489
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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