Yunpeng Wen^1,*, Bingyang Ke², Junrong Ding³

Chalcogenide Letters, Vol.23, No.1, 2026, DOI:10.32604/cl.2026.076587 - 26 January 2026

Abstract This study reports an active learning (AL)-guided strategy to optimize the sulfurization–selenization processing conditions of Sb₂(S,Se)₃ thin-film photovoltaic absorbers for enhanced power conversion efficiency (PCE). By coupling Gaussian process modeling with iterative experimental feedback, we explored 20 targeted annealing conditions across the full compositional spectrum (x = 0–1) and identified an optimal S/(S + Se) ratio of 0.40 (x = 0.60), which yielded a band gap (Eg) of ~1.34 eV, close to the theoretical Shockley–Queisser optimum. The optimized process employed a controlled two-step 420°C anneal with sequential H₂Se→H₂S exposure, which produced large plate-like grains (300–500 nm)… More >

Abla Guechi¹, Djohra Dekhil², Abdelhak Nouri^2,*

Chalcogenide Letters, Vol.23, No.1, 2026, DOI:10.32604/cl.2026.076586 - 26 January 2026

Abstract This work uses numerical modeling in SCAPS-1D to examine the efficiency analysis of a solar cell based on SnS. The power conversion efficiency (PCE) is limited to 24.5% because of incomplete photon absorption in the absorber layer (SnS) and carrier recombination. To increase the absorption window, facilitate charge mobility, and suppress bulk recombination at the rear contact, the absorbent film was divided up into three sublayers with graded band gaps of 1.1 eV, 1.2 eV, and 1.3 eV. Furthermore, the sublayers’ linear gradient doping improved charge collection while simultaneously lowering recombination at the interface. A… More >

Junyan Tian¹, Qingyuan Zhang¹, Lili Wu^1,2,*, Xia Hao^1,2, Guanggen Zeng¹, Wenwu Wang¹, Jingquan Zhang^1,2

Chalcogenide Letters, Vol.23, No.1, 2026, DOI:10.32604/cl.2026.076362 - 26 January 2026

Abstract The incorporation of the Se element in CdTe solar cells is critical, while the low bandgap CdSe_xTe_1−x, formed by the interdiffusion of CdTe and CdSe during device preparation, can promote the carrier lifetime. Different window layers formed by CdSe w/o MZO or CdS have different Se distributions. This paper systematically evaluates the influence of four types of window layers (CdSe, CdS/CdSe, MZO/CdSe and MZO/CdS/CdSe) on the performance of CdTe solar cells, and focuses on the correlation between the window layers and the Se distribution characteristic, carrier recombination mechanism, and device efficiency. The results show that CdSe… More >

Dehui Li^1,#, Yiming Guo^1,#, Tao He¹, Binbin Zhang¹, Haixia Yu^2,*, Lingkun Meng^1,*

Chalcogenide Letters, Vol.23, No.1, 2026, DOI:10.32604/cl.2026.075922 - 26 January 2026

Abstract Quinary Cu₃FeInSnS₆ (CFITS) nanoplates were synthesized through a synergistic dual-cation substitution strategy using a hot-injection method, where oleylamine and 1-dodecanethiol served as coordinating ligands to guide two-dimensional growth. The nanocrystals were characterized by X-ray diffraction, transmission electron microscopy, X-ray photoelectron spectroscopy, and absorption spectroscopy. Structural analysis confirms that the CFITS nanoplates crystallize in a phase-pure cubic zinc-blende structure (space group F-43 m) without detectable secondary phases. Optical measurements reveal that the nanoplates exhibit broad and intense visible-light absorption with a direct bandgap of 1.51 ± 0.03 eV, suitable for photovoltaic applications. Under standard AM 1.5 G… More >

Xuecai Han, Yilin Tong, Jiaqi Bao, Kan Yu^*

Chalcogenide Letters, Vol.23, No.1, 2026, DOI:10.32604/cl.2026.075604 - 26 January 2026

Abstract Chalcogenide glasses in the Ge-Se-Te system possess wide infrared transparency and strong optical nonlinearity, yet the microscopic origin of their vibrational behavior remains unclear. Using ab initio calculations, we analyzed Raman-active modes in GeSe_xTe_4−x (x = 0–4) tetrahedra, edge-sharing tetrahedra, and ethane-like Ge₂Se_2xTe_6−2x (x = 0–3) clusters. For GeSe_xTe_4−x (x = 0–4) tetrahedra, the symmetric stretching vibrations exhibit two families: Ge-Se-dominated and Ge-Te-dominated modes, both showing monotonic redshifts as the number of same-type bonds increases. In edge-sharing tetrahedra, the Ge-Ch-Ge-Ch (Ch = Se or Te) four-membered-ring breathing frequency decreases with higher Te content, and a comparable softening is More >

Wenwen Zhang^*, Changgui Lei

Chalcogenide Letters, Vol.22, No.12, pp. 1031-1045, 2025, DOI:10.15251/CL.2025.2212.1031 - 08 December 2025

Abstract The development of quick, accurate, and field-deployable detection techniques is required due to the growing environmental pollution caused by heavy metals, especially lead (Pb) and cadmium (Cd). In this work, bismuth silver sulfide (AgBiS₂) nanoparticles are synthesized using a simple hydrothermal method aided by biomolecules, and they are used as a new modifier forPb(II) and Cd(II) simultaneous electrochemical detection using screen-printed electrodes (SPEs). After thorough material characterisation, pure, highly crystalline, quasi-spherical AgBiS₂ nanoparticles produced with an average diameter of around 20 nm. The AgBiS₂/SPE sensor demonstrated a threefold decrease in charge transfer resistance, indicating a considerable improvement More >

M. Tariq^1,2,*, R. Ahmed^1,2, S. A. Tahir¹, B. U. Haq³, F. K. Butt⁴, M. W. Majeed¹, A. Hussain¹

Chalcogenide Letters, Vol.22, No.12, pp. 1067-1079, 2025, DOI:10.15251/CL.2025.2212.1067 - 11 December 2025

Abstract The two-dimensional IV-monochalcogenides, such as lead sulfide (PbS), lead selenide (PbSe), and lead telluride (PbTe), represent a promising class of materials known for their remarkable optoelectronic properties. The calculated binding energies for the puckered phase were –4.25 eV for PbS, –4.20 eV for PbSe, and –3.02 eV for PbTe, indicating strong stability in PbS and PbSe compared to PbTe. The electronic analysis showed that PbS exhibited a band gap of 1.01 eV, while PbSe had a slightly lower band gap of 0.70 eV. Under applied pressure, both materials demonstrated an increase in band gap, rising More >

Hameed H. Ahmed¹, Thaer A. Mezher^2,*, Marwan R. Rashid³

Chalcogenide Letters, Vol.22, No.12, pp. 1055-1066, 2025, DOI:10.15251/CL.2025.2212.1055 - 10 December 2025

Abstract Laser ablation in liquids (LAL), a hygienic and effective method for creating high-purity nanomaterials, was used in this study to create cadmium sulfide (CdS) and silver oxide (Ag₂O) nanoparticles. The sputtering process was used to deposit the produced nanomaterials on porous silicon (PSi) substrates, and a number of assays were used to examine the samples’ structural, optical, and electrical characteristics. The CdS sample had a hexagonal crystal structure, according to X-ray diffraction (XRD) data, whereas the AgO sample had a cubic structure. The diameters of the nanoparticles in the two samples ranged from 22.64 nm for… More >

N. Masood¹, A. M. Toufiq^2,*, S. Magam^3,4, S. M. W. Ali², M. T. Qureshi^3,*

Chalcogenide Letters, Vol.22, No.12, pp. 1047-1053, 2025, DOI:10.15251/CL.2025.2212.1047 - 08 December 2025

Abstract Self-assembled highly hierarchical novel SnS₂ microflowers having acute edge nanopetals have been fabricated using a facile template-free hydrothermal growth technique utilizing Tin (II) chloride dihydrate (SnCl₂·2H₂O) and Sodium sulfide nonahydrate (Na₂S·9H₂O) as reaction reagents. Morphological analysis exhibits the flower-type SnS₂ microarchitectures ranging from 4 to 7 μm. The vibrational mode measured at A_1g = 314 cm⁻¹ confirms the existence of hexagonal phase SnS₂ using Raman spectroscopy. The electrochemical results suggest the promise of as-synthesized SnS₂ structures as a cathodic material in lithium-sulfur batteries. More >

S. N. Garibova^1,2, M. E. Aliyev³, U. I. Ashurova⁴, L. C. Suleymanova⁴, A. M. Kerimova¹, S. A. Rzayeva¹, S. O. Guseynova¹, H. I. Novruzova¹, R. Z. Amirov¹, F. Sarcan⁵

Chalcogenide Letters, Vol.22, No.12, pp. 999-1008, 2025, DOI:10.15251/CL.2025.2212.999 - 03 December 2025

Abstract In this work, the electronic behavior of the chalcogenide semiconductor Ge₂Sb₂Te₅ was examined using a first-principles computational approach. The study was carried out within the density functional theory framework, where the spin-polarized generalized gradient approximation was applied through the Atomistix ToolKit software. A double-zeta polarized basis set formed the foundation of the calculations, while exchange–correlation interactions were treated using the Perdew–Burke–Ernzerhof functional. Sampling of the Brillouin zone was performed according to the Monkhorst–Pack method with a 2 × 2 × 2 k-point grid, ensuring accuracy through special-point integration. Atomic configuration optimization, also conducted in Atomistix ToolKit,… More >