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Title: Materials Data on K3BiO3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1203990· OSTI ID:1203990

K3BiO3 crystallizes in the cubic I-43m space group. The structure is three-dimensional. K1+ is bonded to five equivalent O2- atoms to form a mixture of distorted edge and corner-sharing KO5 square pyramids. There are a spread of K–O bond distances ranging from 2.72–2.91 Å. Bi3+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent O2- atoms. All Bi–O bond lengths are 2.11 Å. O2- is bonded to five equivalent K1+ and one Bi3+ atom to form a mixture of distorted edge and corner-sharing OK5Bi octahedra. The corner-sharing octahedral tilt angles are 20°.

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:
1203990
Report Number(s):
mp-29524
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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