SBQT 2023

Density Functional Theory Investigation of the Contributions of π-π Stacking and Hydrogen Bonding to the Supramolecular Aggregation Interactions of Asphaltene Heterocycles

SBQT 2023

COMPUTATION-GUIDED APPROACHES FOR RAPID DETECTION OF NEW PSYCHOACTIVE SUBSTANCES: CATHINONE FAMILY

SBQT 2023

Structural, vibrational, and electronic properties of the [Ni(Phen)(C4H2O4)(H2O)3] coordination complex: Synthesis and DFT study

SBQT 2023

Influência de Substituintes na Redução de Barreiras Energéticas em Reações de Ativação do H2 por Pares de Lewis Frustrados

SBQT 2023

A DFT study of Pd(OAc)2 assisted C-(sp2)-H bond activation.