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

Title: Materials Data on AsPbF7 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204425· OSTI ID:1204425

PbF(AsF6) crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Pb2+ is bonded in a 1-coordinate geometry to nine F1- atoms. There are a spread of Pb–F bond distances ranging from 2.31–3.15 Å. As5+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of As–F bond distances ranging from 1.76–1.79 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted single-bond geometry to one Pb2+ and one As5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Pb2+ and one As5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Pb2+ and one As5+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one Pb2+ and one As5+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to three equivalent Pb2+ atoms. In the sixth F1- site, F1- is bonded in a single-bond geometry to one Pb2+ and one As5+ atom. In the seventh F1- site, F1- is bonded in a single-bond geometry to one Pb2+ and one As5+ 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:
1204425
Report Number(s):
mp-29992
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on Te2As2Se8S(OF6)2 by Materials Project
Dataset · Wed Apr 29 00:00:00 EDT 2020 · OSTI ID:1204425

Materials Data on Ge3Pb11O17 by Materials Project
Dataset · Fri Aug 05 00:00:00 EDT 2016 · OSTI ID:1204425

Materials Data on TeAs(IF2)3 by Materials Project
Dataset · Wed Apr 29 00:00:00 EDT 2020 · OSTI ID:1204425