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Title: Materials Data on K2RbSb by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1315043· OSTI ID:1315043

K2RbSb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight equivalent K1+ and six equivalent Sb3- atoms. All Rb–K bond lengths are 3.75 Å. All Rb–Sb bond lengths are 4.33 Å. K1+ is bonded to four equivalent Rb1+ and four equivalent Sb3- atoms to form a mixture of distorted corner, edge, and face-sharing KRb4Sb4 tetrahedra. All K–Sb bond lengths are 3.75 Å. Sb3- is bonded in a body-centered cubic geometry to six equivalent Rb1+ and eight equivalent K1+ 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:
1315043
Report Number(s):
mp-976148
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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