publicações selecionadas Estudo das propriedades de agregados supramoleculares contendo metais de transição Chiral Cation Doping for Modulating Structural Symmetry of 2D Perovskites First-principles Insights into the Role of Edges in the Binding Mechanisms of Au4 Clusters on MoSe2 Nanoflakes Estudo ab initio da Evolução da Formação de Monocamadas de Dicalcogenetos de Metais de Transição Tailoring Excitonic and Optoelectronic Properties of Transition Metal Dichalcogenide Bilayers Ab initio insights into the stabilization and binding mechanisms of MoS 2 nanoflakes supported on graphene Pressure-Induced Stabilization of Sodium Halide Perovskites Ab initio investigation of the interface between Mo10S24 nanoflakes and the Au(111) Unveiling the Adsorption Properties of 3d, 4d, and 5d Metal Adatoms on the MoS2 Monolayer: A DFT-D3 Investigation Crystal structure determination and DFT analysis of doxorubicin hydrochloride for controlled-release drug formulations Estudo de primeiros princípios de calcogenetos
