Tuning the Selectivity of Liquid Products of CO₂RR by Cu–Ag Alloying

Geometries, Stabilities, and Growth Patterns of the Bimetal Mo₂-doped Si_n (n = 9−16) Clusters: A Density Functional Investigation

A theoretical investigation on electronic properties and stability of IrSix (x=1–6) clusters

A computational investigation of the Ni-doped Sin(n=1−8) clusters by a density functional method

Probing Ligand-Binding Modes and Binding Mechanisms of Benzoxazole-Based Amide Inhibitors with Soluble Epoxide Hydrolase by Molecular Docking and Molecular Dynamics Simulation

The medium-sized charged YbSi±n (n=7–13) clusters: A relativistic computational investigation