The band structure and carrier recombination mechanism of α/β-phase tellurium homojunction investigated by infrared photoluminescence

During the synthesis of tellurium (Te) crystals, the coexistence of multiple crystalline phases (α-Te, β-Te, and γ-Te) with diverse structures commonly occurs, leading to instability and complexity in the performance of Te-based optoelectronic devices. This study employs physical vapor deposition to synthesize Te crystals of various sizes and morphologies, followed by spatially and temperature-dependent evaluation using Raman mapping and infrared photoluminescence (PL) spectroscopy. Spatially resolved results reveal that the size and morphology of Te crystals significantly influence the energy and peak profiles of Raman and PL spectra. Statistical analysis of spatially random sampling indicates the PL peak energies of Te crystals follow a lognormal distribution in terms of their occurrence frequencies, reflecting the complex interplay of multiple factors during crystal growth. This results in the coexistence of α-Te and β-Te phases, forming α/β-Te heterophase homojunction (HPHJ). Meanwhile, temperature-dependent PL results, obtained for the range of 3–290 K, reveal multi-peak competitive behavior in the PL spectra, accompanied by S-shaped shifts in peak energy. These features can be rationally explained by an interface transition-recombination mechanism based on the I-type α/β-Te HPHJ model. It also confirms infrared PL spectroscopy is an effective method for identifying the crystalline phase composition of Te crystals.