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Title: Materials Data on Tb7O12 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1197339· OSTI ID:1197339

Tb7O12 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. there are two inequivalent Tb+3.43+ sites. In the first Tb+3.43+ site, Tb+3.43+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Tb–O bond distances ranging from 2.28–2.52 Å. In the second Tb+3.43+ site, Tb+3.43+ is bonded in a distorted octahedral geometry to six equivalent O2- atoms. All Tb–O bond lengths are 2.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Tb+3.43+ atoms to form a mixture of distorted edge and corner-sharing OTb4 tetrahedra. In the second O2- site, O2- is bonded to four equivalent Tb+3.43+ atoms to form a mixture of edge and corner-sharing OTb4 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:
1197339
Report Number(s):
mp-22083
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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