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Title: Materials Data on GaBiO3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1290087· OSTI ID:1290087

BiGaO3 is Ilmenite-like structured and crystallizes in the trigonal R3c space group. The structure is three-dimensional. Ga3+ is bonded to six equivalent O2- atoms to form corner-sharing GaO6 octahedra. The corner-sharing octahedral tilt angles are 26°. There are three shorter (1.96 Å) and three longer (2.11 Å) Ga–O bond lengths. Bi3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. There are three shorter (2.33 Å) and three longer (2.48 Å) Bi–O bond lengths. O2- is bonded in a distorted see-saw-like geometry to two equivalent Ga3+ and two equivalent Bi3+ atoms.

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:
1290087
Report Number(s):
mp-755568
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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