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Binary Lead Fluoride Pb3F8
Authors:Dipl-Chem H Lars Deubner  Malte Sachs  Jascha Bandemehr  Dr Sergei I Ivlev  Prof Dr Antti J Karttunen  Stefan R Kachel  Benedikt P Klein  Lukas Ruppenthal  Maik Schöniger  Claudio K Krug  Jan Herritsch  Prof Dr J Michael Gottfried  Jamal N M Aman  Prof Dr Jörn Schmedt auf der Günne  Prof Dr Florian Kraus
Institution:1. Fachbereich Chemie, Philipps-Universität Marburg, Hans-Meerwein-Str. 4, 35032 Marburg, Germany

These authors contributed equally.;2. Fachbereich Chemie, Philipps-Universität Marburg, Hans-Meerwein-Str. 4, 35032 Marburg, Germany;3. Department of Chemistry and Materials Science, Aalto University, 00076 Aalto, Finland;4. Inorganic Materials Chemistry, University of Siegen, Adolf-Reichwein-Str. 2, 57076 Siegen, Germany

Abstract:The binary lead fluoride Pb3F8 was synthesized by the reaction of anhydrous HF with Pb3O4 or by the reaction of BrF3 with PbF2. The compound was characterized by single-crystal and powder X-ray diffraction, IR, Raman, and solid-state MAS 19F NMR spectroscopy, as well as thermogravimetric analysis, XP and near-edge X-ray absorption fine structure (NEXAFS) spectroscopy. Solid-state quantum-chemical calculations are provided for the vibrational analyses and band assignments. The electronic band structure offers an inside view of the mixed valence compound.
Keywords:IR and Raman spectroscopy  lead fluoride  NEXAFS  NMR spectroscopy  quantum chemical calculations
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