Recent developments in computational actinide chemistry.
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Formation of unprecedented actinide triple bond carbon in uranium methylidyne moleculesExperimental and quantum chemical studies of structure and reaction mechanisms of dioxouranium(VI) complexes in solution.Metal-ligand multiple bonding in uranium: structure and reactivity.Recent advances in computational actinoid chemistry.Hydration of lanthanoids(III) and actinoids(III): an experimental/theoretical saga.De novo design of an endohedral heteronuclear dimetallofullerene (U-Gd)@C60 with exceptional structural and electronic properties.Energy landscape of chelated uranyl: antibody interactions by dynamic force spectroscopy.A computational study on the complexation of Np(V) with N,N,N',N'-tetramethyl-3-oxa-glutaramide (TMOGA) and its carboxylate analogs.Single-molecule magnetism in a single-ion triamidoamine uranium(V) terminal mono-oxo complex.The distinct affinity of cyclopentadienyl ligands towards trivalent uranium over lanthanide ions. Evidence for cooperative ligation and back-bonding in the actinide complexes.Evaluating f-element bonding from structure and thermodynamics.Theoretical investigation on the mechanism and dynamics of oxo exchange of neptunyl(VI) hydroxide in aqueous solution.Defect-induced strong localization of uranium dicarbide on the graphene surface.Redox properties of biscyclopentadienyl uranium(V) imido-halide complexes: a relativistic DFT study.Understanding the origins of Oyl-U-Oyl bending in the uranyl (UO22+) ion.The separation mechanism of Am(iii) from Eu(iii) by diglycolamide and nitrilotriacetamide extraction reagents using DFT calculations.Reductive coupling of carbon monoxide by U(III) complexes--a computational study.A relativistic DFT probe of polypyrrolic macrocyclic diuranium(III) complexes with terminal solvents and iodines.Electronic structure and spectrum of UO2 2+ and UO2Cl4 2-.The nature of the U=C double bond: pushing the stability of high-oxidation-state uranium carbenes to the limit.The Effect of the Equatorial Environment on Oxo-Group Silylation of the Uranyl Dication: A Computational StudyEmission spectroscopy of uranium(iv) compounds: a combined synthetic, spectroscopic and computational study
P2860
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P2860
Recent developments in computational actinide chemistry.
description
2003 nî lūn-bûn
@nan
2003 թուականի Յունուարին հրատարակուած գիտական յօդուած
@hyw
2003 թվականի հունվարին հրատարակված գիտական հոդված
@hy
2003年の論文
@ja
2003年論文
@yue
2003年論文
@zh-hant
2003年論文
@zh-hk
2003年論文
@zh-mo
2003年論文
@zh-tw
2003年论文
@wuu
name
Recent developments in computational actinide chemistry.
@ast
Recent developments in computational actinide chemistry.
@en
type
label
Recent developments in computational actinide chemistry.
@ast
Recent developments in computational actinide chemistry.
@en
prefLabel
Recent developments in computational actinide chemistry.
@ast
Recent developments in computational actinide chemistry.
@en
P356
P1476
Recent developments in computational actinide chemistry.
@en
P356
10.1039/B204253N
P577
2003-01-01T00:00:00Z