Structural parameters of the nearest surrounding of lanthanide ions in aqueous solutions of their salts

Theoretical study of hydration models of trivalent rare-earth ions using model core potentials

(2010) Takayuki Fujiwara et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Analysis of the Detailed Configuration of Hydrated Lanthanoid(III) Ions in Aqueous Solution and Crystalline Salts by Using K- and L3-Edge XANES Spectroscopy

(2009) Paola D'Angelo et al.   CHEMISTRY-A EUROPEAN JOURNAL

Building a polarizable pair interaction potential for lanthanoids(III) in liquid water: A molecular dynamics study of structure and dynamics of the whole series

(2009) Magali Duvail et al.   JOURNAL OF CHEMICAL PHYSICS

Dynamics and Structure of Ln(III)−Aqua Ions: A Comparative Molecular Dynamics Study Using ab Initio Based Flexible and Polarizable Model Potentials

(2009) Alessandra Villa et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The structure and stability of aqueous rare-earth elements in hydrothermal fluids: New results on neodymium(III) aqua and chloroaqua complexes in aqueous solutions to 500 °C and 520 MPa

(2008) Robert A. Mayanovic et al.   CHEMICAL GEOLOGY

Hydration of Lanthanoid(III) Ions in Aqueous Solution and Crystalline Hydrates Studied by EXAFS Spectroscopy and Crystallography: The Myth of the “Gadolinium Break”

(2008) Ingmar Persson et al.   CHEMISTRY-A EUROPEAN JOURNAL

A Dynamic Model to Explain Hydration Behaviour along the Lanthanide Series

(2008) Magali Duvail et al.   CHEMPHYSCHEM

Ab initio and DFT study of Lu3+ hydration

(2008) Vladimir Buzko et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Thermodynamic and Structural Features of Aqueous Ce(III)

(2008) Adriana Dinescu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Molecular Dynamics Study of the Coordination Sphere of Trivalent Lanthanum in a Highly Concentrated LiCl Aqueous Solution: a Combined Classical and Ab Initio Approach

(2008) L. Petit et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The structure of the lanthanide aquo ions in solution as studied by 17O NMR spectroscopy and DFT calculations

(2007) Kristina Djanashvili et al.   DALTON TRANSACTIONS