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Real Time Determination of the Electronic Structure of Unstable Reaction Intermediates during Au2O3 Reduction

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Real Time Determination of the Electronic Structure of Unstable Reaction Intermediates during Au2O3 Reduction

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Voltage-driven Reactivity of Liquid Ga and CuGa Nanoparticles for Electrocatalytic CO2 Reduction and Synthesis

Structures of the (Imidazole)(n)H+ ... Ar (n=1,2,3) complexes determined from IR spectroscopy and quantum chemical calculations

Genetic Algorithms for the Discovery of Homogeneous Catalysts

Machine-learning the electronic density of states: electronic properties without quantum mechanics

Operando identification of a side-on nickel superoxide intermediate and the mechanism of oxygen evolution on nickel oxyhydroxide

What do we talk about, when we talk about single-crystal termination-dependent selectivity of Cu electrocatalysts for CO2 reduction? A data-driven retrospective

New Cu (I) complexes as catalyst for "click" reaction: An experimental and computational study

Kinetic Network Modeling of the Catalytic Upgrading of Biomass's Acetate Fraction to Aromatics

Magnetic orderings and electronic structure of complex oxides from advanced Hubbard functionals

New methods for structure determination and speciation by NMR crystallography

Modeling non-covalent interactions in condensed phase

Emergent thermophoretic behavior in chemical reaction systems