Materials Data on K2MnCl6 by Materials Project

Dataset · Sun May 03 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1201515· OSTI ID:1201515

The Materials Project

K2MnCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K1+ is bonded to twelve equivalent Cl1- atoms to form KCl12 cuboctahedra that share corners with twelve equivalent KCl12 cuboctahedra, faces with six equivalent KCl12 cuboctahedra, and faces with four equivalent MnCl6 octahedra. All K–Cl bond lengths are 3.51 Å. Mn4+ is bonded to six equivalent Cl1- atoms to form MnCl6 octahedra that share faces with eight equivalent KCl12 cuboctahedra. All Mn–Cl bond lengths are 2.29 Å. Cl1- is bonded in a distorted single-bond geometry to four equivalent K1+ and one Mn4+ 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: 1201515
• Report Number(s): mp-27304
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
K2MnCl6
Cl-K-Mn