Binary Lead Fluoride Pb3 F8.
H Lars DeubnerMalte SachsJascha BandemehrSergei I IvlevAntti J KarttunenStefan R KachelBenedikt P KleinLukas RuppenthalMaik SchönigerClaudio K KrugJan HerritschJ Michael GottfriedJamal N M AmanJörn Schmedt Auf der GünneFlorian KrausPublished in: Chemistry (Weinheim an der Bergstrasse, Germany) (2019)
The binary lead fluoride Pb3 F8 was synthesized by the reaction of anhydrous HF with Pb3 O4 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 19 F 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.
Keyphrases
- solid state
- heavy metals
- density functional theory
- high resolution
- molecular dynamics
- drinking water
- molecular dynamics simulations
- aqueous solution
- electron microscopy
- dual energy
- ionic liquid
- risk assessment
- energy transfer
- raman spectroscopy
- magnetic resonance imaging
- computed tomography
- mass spectrometry
- crystal structure
- atrial fibrillation
- quantum dots
- single molecule