0000000000400693
AUTHOR
S. Velgosh
Optical, infrared and electron-microscopy studies of metallic clusters in layered crystals
Abstract An influence of ( Cd i ) n metallic clusters on the optical absorption and phonon spectra of CdI 2 crystals was studied. Metallic clusters of spherical shape were formed during the growth of non-stoichiometric crystals. Radii of clusters are in range from 10 to 500 nm according to scanning electron microscopy (SEM) data. The density of clusters was estimated from fractal dimension calculations. The fractal dimension of ( Cd i ) n clusters has been found to be varied from 1.488 to 1.793. In the framework of Mie theory the spectral and size dependencies of extinction coefficients were calculated. From the experimentally obtained spectra it is evident that the metallic clusters are re…
Long-term evolution of luminescent properties in CdI2 crystals
Fresh and aged melt-grown or gas-phase grown CdI2 crystals are studied by means of low-temperature photoluminescence spectroscopy. Noticeable transformations of emission spectra are observed after long-term aging. The formation of nanostructures containing cadmium oxide and cadmium hydroxide as well as the changes in local surrounding of iodine atoms and the possible growth of polytypic modifications of CdI2 are taken into account when considering the diversity of optical spectra.
Cadmium clusters in CdI2layered crystals: the influence on the optical properties
The influence of overstoichiometric Cd i atoms on the optical properties of cadmium iodide layered crystals has been investigated. The results of optical absorption, luminescence, and luminescence excitation studies of CdI 2 crystals with controlled deviation from stoichiometric composition allow observing correlations between the Cd i concentration and features in absorption and emission spectra up to concentrations of 10 18 cm -3 . At higher concentrations the overstoichiometric cadmium atoms form clusters, which were observed using scanning electron microscopy. The extinction spectra of (CdI i ) n clusters are calculated in the frame of Mie theory and are found to correlate with the opti…
BiI3 nanoclusters in melt-grown CdI2 crystals studied by optical absorption spectroscopy
Optical absorption spectroscopy of CdI2–BiI3 layered crystals has been performed in the temperature range of 77–300 K. The main absorption, observed in these crystals at 2.59 eV is related to quantum confined exciton absorption of bimolecular BiI3 cluster. Low energy absorption peaks at 2.38 eV, 2.06 eV and 1.94 eV can be tentatively assigned to larger clusters composed of 4, 6 or more BiI3 molecules. In ultra-thin samples of CdI2–BiI3 several bands at 2.84 eV, 3.03 eV and 3.27 eV were observed which are ascribed to higher excited states of the excitons in bimolecular BiI3 cluster.
Low-temperature luminescence of CdI2 under synchrotron radiation
Synchrotron radiation is applied to study visible and UV luminescence spectra and their excitation spectra of undoped as well as In and Sb doped cadmium iodide crystals at 10 K. The origin of principal luminescence bands and the role of impurities in the formation of emission centers are discussed. The luminescence properties have been explained based on the electronic structure of CdI2 crystals.
First-principles simulations of the electronic density of states for superionic Ag2CdI4 crystals
Abstract Energy band dispersion calculations have been performed for Ag 2 CdI 4 superionic within a framework of local density approximation (Perdew–Zunger parameterization) exploiting the first-principles CASTEP computer code. The ab-initio electronic structure simulations were performed for both ( I 4 and I 42 m ) types of e -Ag 2 CdI 4 crystalline structures. Principal optical functions as well as the density of electronic states in the spectral range of inter-band optical transitions (2.5 eV–20 eV) were determined. Theoretically calculated absorption coefficients derived from the obtained band structure are compared with appropriate experimental data.