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Title: Materials Data on PF5 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1308963· OSTI ID:1308963

PF5 crystallizes in the hexagonal P6_3/mmc space group. The structure is zero-dimensional and consists of two phosphorus pentafluoride molecules. P5+ is bonded in a trigonal bipyramidal geometry to five F1- atoms. There is three shorter (1.56 Å) and two longer (1.61 Å) P–F bond length. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one P5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one P5+ atom.

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:
1308963
Report Number(s):
mp-8511
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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