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Title: Materials Data on LiP by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1313358· OSTI ID:1313358

LiP crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 6-coordinate geometry to six P1- atoms. There are a spread of Li–P bond distances ranging from 2.58–2.79 Å. In the second Li1+ site, Li1+ is bonded in a 6-coordinate geometry to six P1- atoms. There are a spread of Li–P bond distances ranging from 2.58–2.77 Å. There are two inequivalent P1- sites. In the first P1- site, P1- is bonded in a 8-coordinate geometry to six Li1+ and two equivalent P1- atoms. There are one shorter (2.22 Å) and one longer (2.24 Å) P–P bond lengths. In the second P1- site, P1- is bonded in a 8-coordinate geometry to six Li1+ and two equivalent P1- 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:
1313358
Report Number(s):
mp-9588
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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