Theoretical study of charge transfer properties of hole-transporting material quinoxalinebasedin perovskite solar cells

A theoretical study was done to investigate the charge transport properties of quinoxaline derivativesusing density functional theory. The electron transfer mechanism from the ground state to the first singletexcited state was investigated by electron and hole analysis. The results show that TQ۵ has ideal hole-electrondistribution indices

کلیدواژه ها:

small organic molecules ، DFT ، hole transport materials