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Title: Materials Data on MnCuP by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195343· OSTI ID:1195343

MnCuP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mn2+ is bonded in a 5-coordinate geometry to five equivalent P3- atoms. There are a spread of Mn–P bond distances ranging from 2.42–2.65 Å. Cu1+ is bonded to four equivalent P3- atoms to form a mixture of distorted edge and corner-sharing CuP4 tetrahedra. There are one shorter (2.28 Å) and three longer (2.37 Å) Cu–P bond lengths. P3- is bonded in a 9-coordinate geometry to five equivalent Mn2+ and four equivalent Cu1+ 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:
1195343
Report Number(s):
mp-20203
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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