Ionic versus covalent character in lanthanide complexes. A hybrid density functional study
- 4 April 1997
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 268 (1-2) , 61-68
- https://doi.org/10.1016/s0009-2614(97)00177-2
Abstract
No abstract availableKeywords
This publication has 28 references indexed in Scilit:
- Natural Energy Decomposition Analysis: Explicit Evaluation of Electrostatic and Polarization Effects with Application to Aqueous Clusters of Alkali Metal Cations and NeutralsJournal of the American Chemical Society, 1996
- Effective core potential studies of lanthanide complexesThe Journal of Chemical Physics, 1995
- Prediction of the Molecular Shape of Lanthanide TrihalidesThe Journal of Physical Chemistry, 1995
- The performance of density-functional/Hartree–Fock hybrid methods: Cationic transition-metal methyl complexes MCH+3 (M=Sc–Cu,La,Hf–Au)The Journal of Chemical Physics, 1995
- Successive Binding Energies of Fe(CO)5+The Journal of Physical Chemistry, 1994
- Approximate density functional theory as a practical tool in molecular energetics and dynamicsChemical Reviews, 1991
- Intermolecular interactions from a natural bond orbital, donor-acceptor viewpointChemical Reviews, 1988
- A molecular orbital study of rare earth metal trihalide moleculesInorganic Chemistry, 1978
- Thermodynamic properties of lanthanide trihalide moleculesJournal of Chemical & Engineering Data, 1977
- Geometry and Infrared Spectra of Matrix-Isolated Rare-Earth Halides. I. LaF3, CeF3, PrF3, NdF3, SmF3, and EuF3The Journal of Chemical Physics, 1971