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Title: Materials Data on Mn3Be by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1314560· OSTI ID:1314560

BeMn3 is alpha Samarium-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Be is bonded to twelve equivalent Mn atoms to form BeMn12 cuboctahedra that share corners with six equivalent BeMn12 cuboctahedra, corners with twelve equivalent MnMn8Be4 cuboctahedra, edges with eighteen equivalent MnMn8Be4 cuboctahedra, faces with eight equivalent BeMn12 cuboctahedra, and faces with twelve equivalent MnMn8Be4 cuboctahedra. There are six shorter (2.40 Å) and six longer (2.42 Å) Be–Mn bond lengths. Mn is bonded to four equivalent Be and eight equivalent Mn atoms to form MnMn8Be4 cuboctahedra that share corners with four equivalent BeMn12 cuboctahedra, corners with fourteen equivalent MnMn8Be4 cuboctahedra, edges with six equivalent BeMn12 cuboctahedra, edges with twelve equivalent MnMn8Be4 cuboctahedra, faces with four equivalent BeMn12 cuboctahedra, and faces with sixteen equivalent MnMn8Be4 cuboctahedra. There are two shorter (2.32 Å) and six longer (2.47 Å) Mn–Mn bond lengths.

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:
1314560
Report Number(s):
mp-974571
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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