Time-Dependent Density Functional Theory Studies of Optical and Electronic Properties of the [M25(MPA)18]- (M = Au, Ag, MPA = SCH2CH2COOH) Clusters

The electronic absorption and emission spectra of the [M25(MPA)18]- (M = Au, Ag; MPA = SCH2CH2COOH) clusters have been calculated for energies below 5 eV at the time-dependent density functional...