Generalized Energy-Based Fragmentation Approach for the Electronic Emission Spectra of Large Systems - Du, Jiahui; Liao, Kang; Ma, Jing; Li, Wei; Li, Shuhua (Journal of chemical theory and computation, 2022)
Keywords: Algorithms; Chromophores; Classification; Clustering; Cyclodextrins; Cytosine - chemistry; Density functional theory; Emission analysis; Emission spectra; Energy; Fluorescence; Fragmentation; Optimization; Phosphorescence; Quantum chemistry; Quantum Theory; Spectroscopy and Excited States; Subsystems; System effectiveness; Tracking; Vibration; Vibrational spectra