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Title: Materials Data on EuScO3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1198400· OSTI ID:1198400

EuScO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Eu3+ is bonded in a 4-coordinate geometry to eight O2- atoms. There are a spread of Eu–O bond distances ranging from 2.32–2.87 Å. Sc3+ is bonded to six O2- atoms to form corner-sharing ScO6 octahedra. The corner-sharing octahedra tilt angles range from 35–38°. There are a spread of Sc–O bond distances ranging from 2.11–2.13 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Eu3+ and two equivalent Sc3+ atoms. In the second O2- site, O2- is bonded to two equivalent Eu3+ and two equivalent Sc3+ atoms to form distorted corner-sharing OEu2Sc2 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:
1198400
Report Number(s):
mp-22487
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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