skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on LiCu2PO4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1290976· OSTI ID:1290976

LiCu2PO4 is Stannite structured and crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent O2- atoms to form distorted LiO4 tetrahedra that share corners with four equivalent PO4 tetrahedra and corners with eight equivalent CuO4 tetrahedra. All Li–O bond lengths are 2.02 Å. Cu1+ is bonded to four equivalent O2- atoms to form CuO4 tetrahedra that share corners with four equivalent LiO4 tetrahedra, corners with four equivalent CuO4 tetrahedra, and corners with four equivalent PO4 tetrahedra. All Cu–O bond lengths are 2.10 Å. P5+ is bonded to four equivalent O2- atoms to form PO4 tetrahedra that share corners with four equivalent LiO4 tetrahedra and corners with eight equivalent CuO4 tetrahedra. All P–O bond lengths are 1.56 Å. O2- is bonded to one Li1+, two equivalent Cu1+, and one P5+ atom to form distorted corner-sharing OLiCu2P tetrahedra.

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:
1290976
Report Number(s):
mp-758070
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on LiCu2PO4 by Materials Project
Dataset · Wed Apr 29 00:00:00 EDT 2020 · OSTI ID:1290976

Materials Data on LiCu2PO4 by Materials Project
Dataset · Thu Apr 30 00:00:00 EDT 2020 · OSTI ID:1290976

Materials Data on LiCu2PO4 by Materials Project
Dataset · Wed Apr 29 00:00:00 EDT 2020 · OSTI ID:1290976