D2-symmetric dirhodium(II) carboxylate catalysts that bear axially chiral binaphthothiophene δ-amino acid derivatives have been developed. Conformational control is supported through chalcogen-bondin
In this study, high-dispersed amorphous phosphated nickel (NiP) nanoparticles supported on the surface of reduced graphene oxide (rGO) were successfully prepared through a simple liquid-phase reductio
Several key properties of the water oxidation catalyst Rb8K2[{RuIV4O4(OH)2(H2O)4}(γ-SiW10O36)2] and its mechanism of water oxidation are given. The one-electron oxidized analogue [{RuVRuIV3O6(OH2)4}(γ
The application of modern machine learning to challenges in atomistic simulation is gaining attraction. We present new machine learning models that can predict the energy of the oxidative addition pro
Understanding the thermodynamics of paramagnetic transition metal hydride complexes, especially of the abundant 3d metals, is important in the design of electrocatalysts and organometallic catalysts.
