Optical and excited state properties of Au30(S-Adm)18 and Au38S2(S-Adm)20 nanoclusters: Accuracy from TD-DFT and TDDFT + TB approaches. - Acharya, Dinesh; Liang, Hao; Muñoz-Castro, Alvaro; Zhang, Chengkai; Han, Baoliang; Gupta, Rakesh Kumar; Wang, Zhi; Gao, Zhi-Yong; Azam, Mohammad; Sun, Di (Journal of Chemical Physics, 2025)