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Title: Materials Data on K2Be2PbF8 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1287881· OSTI ID:1287881

K2Be2PbF8 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of K–F bond distances ranging from 2.58–2.87 Å. Be2+ is bonded in a tetrahedral geometry to four F1- atoms. There is one shorter (1.55 Å) and three longer (1.58 Å) Be–F bond length. Pb2+ is bonded in a 12-coordinate geometry to six equivalent F1- atoms. All Pb–F bond lengths are 2.59 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to three equivalent K1+, one Be2+, and one Pb2+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to one K1+ and one Be2+ 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:
1287881
Report Number(s):
mp-7385
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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