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Materials Data on K3Mn by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1741236· OSTI ID:1741236

K3Mn crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent K sites. In the first K site, K is bonded in a distorted water-like geometry to two equivalent Mn atoms. Both K–Mn bond lengths are 3.87 Å. In the second K site, K is bonded in a square co-planar geometry to four equivalent Mn atoms. All K–Mn bond lengths are 4.09 Å. Mn is bonded to eight K atoms to form a mixture of distorted edge and corner-sharing MnK8 hexagonal bipyramids.

Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1741236
Report Number(s):
mp-1078656
Country of Publication:
United States
Language:
English

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