Materials Data on Rb2PrO3 by Materials Project

Dataset · Sat Jul 18 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1282158· OSTI ID:1282158

The Materials Project

Rb2PrO3 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 2.78–3.30 Å. Pr4+ is bonded to five O2- atoms to form distorted edge-sharing PrO5 trigonal bipyramids. There are a spread of Pr–O bond distances ranging from 2.23–2.37 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to four equivalent Rb1+ and two equivalent Pr4+ atoms. In the second O2- site, O2- is bonded in a 5-coordinate geometry to four equivalent Rb1+ and one Pr4+ atom.

• 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: 1282158
• Report Number(s): mp-755057
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Rb2PrO3
O-Pr-Rb