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Title: Materials Data on Li(FeP)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1291142· OSTI ID:1291142

Li(FeP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Li1+ is bonded in a distorted body-centered cubic geometry to eight equivalent P3- atoms. All Li–P bond lengths are 2.90 Å. Fe+2.50+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing FeP4 tetrahedra. All Fe–P bond lengths are 2.19 Å. P3- is bonded in a 9-coordinate geometry to four equivalent Li1+, four equivalent Fe+2.50+, and one P3- atom. The P–P bond length is 2.29 Å.

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:
1291142
Report Number(s):
mp-758741
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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