Systematic Raman spectroscopic study of the complexation of uranyl with fluoride
Yating Yang, Qian Liu, Youshi Lan, Qianci Zhang, Liyang Zhu, Suliang Yang, Guoxin Tian, Xiaoyan Cao, Michael Dolg
Abstract
complexes need to be treated explicitly in order to obtain vibrational frequencies in very good agreement with experimental data. The thermodynamics and structural information obtained in this work and the developed methodology could be instructive for the future experimental and computational research on the complexation of the uranyl ion.
Topics & Concepts
UranylRaman spectroscopyAqueous solutionFluorideChemistryInorganic chemistryUraniumNuclear chemistryPhysical chemistryMaterials scienceIonOrganic chemistryMetallurgyPhysicsOpticsRadioactive element chemistry and processingAtmospheric and Environmental Gas DynamicsChemical Thermodynamics and Molecular Structure