204 papers found
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Enhancing Hydrogen Evolution Reaction via Synergistic Interaction between the [Mo3S13]2– Cluster Co-Catalyst and WSe2 Photocathode
Diffusion of Krypton and Xeon in Uranium Mononitride; a Density Functional Theory Study
Uranium–nitride chemistry: uranium–uranium electronic communication mediated by nitride bridges
Crystallinity-Modulated Co2–xVxO4 Nanoplates for Efficient Electrochemical Water Oxidation
Covalency in AnCl3 (An = Th–No)
Synthesis, structure, and reactivity of uranium(vi) nitrides
High Coordination Number Actinide-Noble Gas Complexes; a Computational Study
DFT + U study of U1-An O2- (An = Np, Pu, Am and Cm) {1 1 1}, {1 1 0} and {1 0 0} surfaces
Embedded Cluster Study of the Co-Adsorption of HCl and H2O on PuO2 Surfaces
Computational Study of the Substitution of Early Actinides and Ce into Zirconolite
Adsorption of U(VI) on Stoichiometric and Oxidised Mackinawite: a DFT Study
Synthesis of a “Masked” Terminal Zinc Sulfide and Its Reactivity with Brønsted and Lewis Acids
Computational Study of Plutonium–Americium Mixed Oxides (Pu0.92Am0.08O2–x); Water Adsorption on {111}, {110}, and {100} Surfaces
Computational study of HCl adsorption on stoichiometric and oxygen vacancy PuO2 {111}, {110} and {100} surfaces
Formation of Mn hydrides from bis(trimethylsilylmethyl) Mn(II): A DFT study
Quantum Chemical Topology and Natural Bond Orbital Analysis of M-O Covalency in M(OC6H5)4 (M = Ti, Zr, Hf, Ce, Th, Pa, U, Np)
Polarised Covalent Thorium(IV)- and Uranium(IV)-Silicon Bonds
The ditungsten decacarbonyl dianion
Formation of a U(VI)–Persulfide Complex during Environmentally Relevant Sulfidation of Iron (Oxyhydr)oxides
Back-bonding between an electron-poor, high-oxidation-state metal and poor π-acceptor ligand in a uranium(v)–dinitrogen complex
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