Tuning Optical Absorption and Emission of Sub-Nanometer Gold-Caged Metal Systems M@Au14 by Substitutional Doping
Gao, Bulusu and Zeng have recently reported a new series of isoelectronic, sub-nanometer gold-caged metal systems M@Au14 which have large energy gaps than icosahedral W@Au12 and Au32 and tetrahedral Au20. In this communication, we propose a "tuning" scheme, substitutional-doping, to achieve the tunable optical excitation and emission of M@Au14 over a broad wavelength region. For example, the optical absorption gaps of isoelectronic M@Au14 could be tuned from the near infrared to green by substituting the metal M with group IIIB, IVB, and VB constituents in the periodic table. Our results provide basic guidelines for further experimental studies on the spectral properties of M@Au14 as well as for the development of M@Au14-based tunable optoelectronic devices.