Rare Earth Ce Research Articles

Effect of rare earth Ce addition on inclusions in offshore engineering steel containing arsenic

The present study investigates the impact of rare earth Ce addition and holding time on inclusions in offshore engineering steel containing arsenic. The analysis was conducted using scanning electron microscopy and energy spectrum (SEM-EDS), automatic statistics of inclusions, and thermodynamic analysis. The results indicate that prior to the addition of rare earth Ce, the typical inclusions in the steel were Al2O3, MnS and Al2O3-MnS, with an average size of approximately 2.51 μm and an irregular or stripe morphology. Upon the addition of rare earth Ce, the inclusions in the steel were transformed into Ce-S(-O), Ce-As(-O) and Ce-S-As(-O), with a smaller average size and a spherical or ellipsoidal morphology. The smallest average size of inclusions in the steel was observed when rare earth Ce was added and held for 5 min; this size was 33% smaller than that prior to the addition of Ce. The thermodynamic calculation revealed that the Ce-S(-O) inclusion is formed in molten steel, while the Ce-As(-O) inclusion is formed during the solidification stage. As element replaced parts of the S and O elements in the Ce-S(-O) inclusion and formed the Ce-S-As(-O) complex inclusion, characterized by a double-layered structure.

Rare earth regulatory defect engineering: A multifunctional nanoplatform for breast cancer therapy through PANoptosis

Photocatalytic therapy (PCT) is a minimally invasive technique that utilizes reactive oxygen species (ROS) to selectively and optically impair tumor cells. However, the limited efficacy of photocatalysts hinders their more comprehensive application. In this study, we successfully synthesized Ce and S-doped Bi2O3 (BOSC) nanosheets through topological synthesis. BOSC exhibits CAT-like and POD-like enzyme activities and can generate ROS and heat upon near-infrared light irradiation, thereby amplifying tumor oxidative stress. Introducing rare earth Ce element enhances light absorption, introduces oxygen vacancies, reduces bandgap, and facilitates charge separation. This Ce-doping also modifies the band position and Fermi level of BOSC, resulting in increased band bending at the solid–liquid interface, enabling a cascade reaction of ROS and enhancing ROS production. Additionally, BOSC demonstrates multiple enzyme activities by depleting GSH and catalyzing the production of ROS and O2 from endogenous H2O2, thereby exacerbating cellular oxidative damage. The synergistic effect of BOSC post-illumination induces panoptosis, thereby improving the therapeutic efficacy against tumors. This strategy, involving the modulation of band structure and band bending through ion doping to introduce oxygen defects into the photosensitizer, provides a viable approach to enhance tumor phototherapy.

Effect of Argon Flow Rate on Tribological Properties of Rare Earth Ce Doped MoS2 Based Composite Coatings by Magnetron Sputtering

Exploring the doping components of the coating is of great significance for improving the tribological properties of the MoS2-based coating. The optimization of magnetron sputtering process parameters can also improve the coating quality. In this paper, the effects of working gas flow rate on the microstructure in a vacuum chamber, nano-hardness, and tribological properties of Ce-Ti/MoS2 coatings were studied using DC and RF unbalanced co-sputtering technology. It is found that the coating structure was coarse and porous when the Ar flow rate was excessive (70 sccm), significantly affecting the mechanical properties; there are pit defects on the surface of the coating when the flow rate is just minor (30 sccm), and the coating easily falls off during the friction process. When the flow rate is 40~60 sccm, the coating grows uniformly, the hardness reaches 7.85 GPa at 50 sccm, and the wear rate is only 4.42 × 10−7 mm3 N−1 m−1 at 60 sccm. The coating doped with Ce and Ti is an approximate amorphous structure. Under appropriate gas flow rate conditions, the friction induces a transfer film with a layered structure, and the MoS2 (002) crystal plane orientation is arranged in parallel at the edge of the wear debris, effectively reducing the shear force during sliding and reducing wear. Based on rare earth doping, this study improves the tribological properties by optimizing the working gas parameters, which plays a reference role in preparing high-quality MoS2-based coatings.

Thermodynamics of the Formation of Non-Metallic Inclusions during the Deoxidation of GCr15 Bearing Steel

The non-metallic inclusions in steel mainly come from the deoxidization process of molten steel. Based on the different deoxidization processes of GCr15 bearing steel produced by a domestic steel plant, the single deoxidization curves of Al, Si, and Mn and the compound deoxidization curves of Al-Si and Si-Mn under pure molten iron and GCr15 bearing steel production conditions were calculated with the FactSage 8.1 thermodynamic software. The results show that the deoxidization curves under the two conditions are quite different. At the same time, the Al-Ti deoxidation equilibrium curve under the condition of GCr15 bearing steel was calculated. It was found that when [Ti] < 0.0015% in the steel, the equilibrium deoxidation product was Al2O3, and no titanium oxide was generated. Finally, a thermodynamic calculation and analysis of the effect of rare-earth Ce content on the modification of inclusions in GCr15 bearing steel were carried out. The results showed that when T = 1873 K, the rare-earth Ce treatment of aluminum deoxidized the GCr15 bearing steel; when [Al] = 0.015%, Al2O3 inclusions increased with the increase in [Ce] content, and the evolution path was Al11O18Ce→CeAlO3→Ce2O3. When [Si] = 0.28%, [O] > 50 ppm, and CeCrO3 and [O] 0.012% appeared. CeS inclusions appeared in the steel, and the final equilibrium product was CeS + Ce2O3. When [Ce] < 0.012%, CeS was not produced in the steel, and only Ce2O3 existed.

ZnO-Based Materials: From Pauli’s Nonsense to a Key Enabling Technology

In this work, we aim to highlight the increasing interest in semiconductors, particularly ZnO. A revision of the evolution of the scientific production on three selected topics has been conducted. As an indicator of scientific production, the number of publications indexed in the Web of Science Data Base has been used. The search terms selected range from the general to the particular: semiconductors, oxide semiconductors, and ZnO. The period considered is from 1 January 1900 to 6 June 2023. The importance of doping processes in tailoring the properties of these materials, and the relevance of the most recently derived applications are also revised. Since many of the most recent applications that have been developed or are under development refer to optoelecronic properties, doping with rare earth elements has a central role. This was the reason behind choosing the system ZnO doped with Rare Earth elements (Eu, Gd, and Ce) and codoped with Ru to illustrate the materials’ tuning potential of doping processes. Morphology, crystal structure, and luminescent properties have been investigated. Upon doping, both the Near Band Edge and the Deep Level emissions show a remarkable difference due to the change in the relative weight of the components constituting these bands. The spectra in all cases extend over the whole visible range, with a main emission in the violet-blue region corresponding to the Near Band Edge, and a broad band extending from the blue-green to orange-red region associated with the presence of different defects.

Effect of cerium on the microstructure and anti-corrosion performance of Al-Zn coatings

With the increasing application scope of aluminum alloys in the marine field, exploring the surface anti-corrosion technologies of aluminum alloys is becoming more and more important. In current industries, thermal spraying is generally used to prepare AlZn coatings for surface protection. In this paper, AlZn coating and Al-Zn-Ce coating were prepared by flame spraying technology, and the effects of adding rare earth element Ce on the microstructure and corrosion resistance of AlZn coating were systematically studied by using OM, SEM, XPS, LCSM and electrochemical corrosion tests. The results show that the addition of Ce is conducive to promoting the mobility and solidification shrinkage of AlZn alloy melt, thereby increasing the density of the coating while decreasing porosity and roughness. Moreover, adding Ce improves the hardness and wear resistance of the AlZn coating. During immersion, adding a trace of Ce to the AlZn coating will affect the passivation process and the formation of the passivation film, endowing the coating with a strong passivation ability and thus improving the corrosion resistance of the coating.

Fabrication of rare earth(R[dbnd]Ce,Gd, Ho and Sm) doped CoCr2-x RxO4 pigments for capacitive and resistive humidity sensor applications

Rare earth (Ce, Gd, Ho & Sm) doped CoCr2O4 green pigments with an extremely porous nature powder were produced using a quick and affordable chemical synthesis procedure called solution combustion. X-ray diffraction analyses revealed the phase composition and average crystallite size. SEM images of the samples that had been annealed at 600°C revealed the existence of cuboids and soft agglomerations. Using an LCR metre to analyse the dielectric properties of as-synthesised samples, it is discovered that the small crystallite size exhibits a higher dielectric constant. The results were impressive when permittivity and electrical resistivity fluctuated with frequency under humid circumstances. By varying the relative humidity from 0 to 100%, electrical measurements were performed to investigate the rare earth pigments' capabilities for sensing humidity. Sample electrical resistance decreases over the entire humidity range. At room temperature, the resistive responses were measured at various relative humidity (RH) levels ranging from 0% to 98% and at various frequencies ranging from 20 Hz to 20 MHz. The rare earth-doped green pigments used in the humidity sensor have a linear response, high sensitivity, and low hysteresis. In addition, the sensor has 35 and 240 s reaction and recovery times, respectively. Our research indicates that this material could be employed as a capacitive and resistive humidity sensor. The results of this work open the door for the use of rare earth doped cobalt chromate pigments in applications for humidity sensing.

Effect of rare earth Ce on the microstructure and mechanical properties of cast Al–7Si alloys

Casting experiments were carried out on Al–7Si using different additions of rare earth Ce at a reaction temperature of 1200 K. Based on the ternary phase diagram of Al–Si–Ce, the effects of rare earth Ce on the α-Al grain refinement, the mechanism of the eutectic Si phase modification, as well as on the mechanical properties and fracture morphology of the alloy were investigated. The results show that the addition of rare earth Ce generates a Ce-containing phase inside the alloy, which becomes a heterogeneous core of eutectic Si and changes the nucleation conditions of eutectic Si. The mechanical properties of the alloy were optimal when the Ce addition was 0.2 wt.%, and the defect porosity and average pore area were minimized. Ce-containing phases were found at fracture cracks, and these Ce-containing phases were deviated and aggregated at grain boundaries, which induced defects to be generated, and microcracks were easily produced during plastic deformation, which ultimately led to the fracture of the alloy. According to the growth kinetic relationship, due to the difference of different atomic radii, the inter-atomic forces lead to different nucleation densities of grains. With the generation of Ce-containing phases at the interfaces, the eutectic Si changes its growth direction and grows towards a 70° angle to the original direction with a tighter atomic ordering sequence of the stacking, and more twinned Si is generated and gradually stacked up at the interfaces, which directly alters the morphology of the eutectic Si.

Effect of Ce on creep damage behavior of 316LN austenitic stainless steel at 700 °C

The effect of rare earth element Ce on creep damage behavior of 316LN austenitic stainless steel (316LN) at 700 °C was systematically investigated under stress ranging from 125 MPa to 200 MPa. The results show that the addition of 0.032 wt% Ce remarkably improves the rupture life of 316LN steel under various stress. Ce addition in 316LN steel decreases the nucleation stress, stabilizes stress concentrations at particles, and notably raises the cavity nucleation rate. Moreover, Ce addition suppresses cavity growth during creep, thus the cavity growth rate significantly decreases and the creep rupture ductility increases under high stress over 175 MPa. However, the anomalous growth rate was engendered in some cavities by Ce addition in 316LN steel under low stress below 150 MPa. Consequently, Ce addition in 316LN steel reduces the creep rupture ductility and changes the rupture mode from trans-granular dimple fracture under high stress to mixed fracture under low stress.

On the hydrogen storage properties of cast TiFe mechanically milled with an intermetallic LaNi5 and rare-earth elements La and Ce

This study provides detailed insight into the effects of adding an intermetallic LaNi5 and rare earth elements La and Ce on the hydrogen storage properties of cast TiFe alloy. To preserve the composite nature of the materials, the addition was done by short-duration ball milling. Morphological investigation revealed the presence of two distinct regions, viz., the primary matrix TiFe region and a secondary region mainly containing the additives. The relative abundance of La and Ni were close to 1/5 in both the regions indicating that LaNi5 did not decompose, and no La–Ni–Ti–Fe phase formed. In the La-added TiFe, diffraction peaks correspond to a high-temperature La phase, and in the Ce-added TiFe, peaks indicative of CeO2 rather than elemental Ce were observed. The milling process only induced microstrains in the LaNi5-added TiFe. Notably, hydrogenation was more complete and faster when the additive was Ce and completely reversible when the additive was LaNi5. However, the kinetics of the La-added TiFe were slow, and stable LaH3 was observed.

Magnetic ordering in Ce substituted zirconite-YCrO4 nanostructures: focus on tunable energy bandgap and local-atomic environment

This study presents a comprehensive investigation of the structural, magnetic, electronic, and optical spectroscopic properties of tetragonal Zirconite Y1−x Ce x CrO4 polycrystals that were synthesized at various temperature ranges. The YCrO4 phase in its pristine state demonstrates ferromagnetic (FM) ordering, characterized by a Curie temperature, T C ∼ 9.3 K. Nevertheless, the introduction of magnetic Ce3+ in place of Y3+ ions results in a reduction of the T C and the appearance of a weak antiferromagnetic (AFM) behaviour, as indicated by the presence of a negative Curie–Weiss temperature (−10 K ≲ θ CW ≲ −30 K). It is observed that the introduction of moderate levels of Ce substitution leads to a significant increase in thermal irreversibility in the magnetization difference between field-cooled and zero-field-cooled states ΔM (M FC − M ZFC). This phenomenon indicates the substantial influence of magneto-crystalline anisotropy that exists within the system. Field-dependent magnetization data exhibits higher saturation magnetization values (M S ≳ (2.7 to 4.4) × 103 emu mole−1) and higher magneto-crystalline anisotropy (K 1 ∼ 2.18 to 3.41 J m−3) for the dilute dispersion of Ce (x ≤ 0.05). Local atomic environment probed by the electron spin resonance clearly indicates the presence of hyperfine splitting of Cr5+ spectra having a single d-electron () with orbital configuration bearing the possible doublet: On the other hand, the rare-earth Ce3+ spectra show hyperfine-doublets as and Finally, the energy band-gap (E g = 2.14 to 2.38 eV, for x ∼ 0 to 0.1) determined from the diffuse reflectance spectroscopy reveals the emergence of intermediate localized states upon substitution of Ce3+.

Rare earth-doped Ni/MgAl2O4 catalysts prepared via a one-step sol–gel method for steam reforming of volatile organic solvents at low temperatures

To develop efficient steam reforming catalysts that are widely applicable to various volatile organic solvents under low temperatures, rare earth (La, Ce or Pr)-doped Ni/MgAl2O4 were prepared via a novel one-step sol–gel method. Through various characterizations and DFT calculations, it demonstrated that the rare earths not only improved the catalyst structure, but also promoted the dispersion, electron density and d-band center of Ni. Consequently, all the rare earth-doped Ni/MgAl2O4 catalysts exhibited higher catalytic activity in steam reforming of different volatile organic solvents than the Ni/MgAl2O4 in 500–550 °C. Thereinto, the 10Ni-2La/MgAl2O4 performed the best, achieving a conversion efficiency of 97.3% at 550 °C for the mixture of toluene, acetone, tetrahydrofuran, and n-hexane. The outstanding performance of Ni-La/MgAl2O4 catalyst arises from the structural compatibility between low-spin La atom and Ni cluster, which enables La to modify Ni dispersion and electronic structure more significantly than Ce or Pr.

Rare earth doped bismuth molybdate nanoplatelets for boosting electrochemical performance: Facile synthesis and device fabrication

The poor rate performance with minimal specific capacitance (Csp) of bismuth molybdate restricts its viable application in high-end supercapacitors (SCs). Herein, bismuth molybdate nanocomposites have been investigated in both pristine and hybrid forms by microwave combustion method to tackle the problem. The prepared pristine and rare earth-doped bismuth molybdate nanocomposites have been investigated by different analytical techniques. In a three-electrode cell configuration, 5% Ce-doped bismuth molybdate nanocomposite electrode showed a Csp of 889.86 F g−1 at 1 mA cm−2 and superior rate performance. Furthermore in a two-electrode cell configuration, a symmetric SC device has been fabricated using pristine and rare earth (Ce and La)-doped bismuth molybdate nanocomposites. The 5% Ce-doped bismuth molybdate symmetric device output a higher Csp of 1092.18 F g−1 at 5 mV s−1 with an energy density of 24.71 Wh kg−1, surpassing the pristine and La-doped bismuth molybdate symmetric devices. These results propose that the doping strategy has the potential to improve the energy-storing capability of bismuth molybdates.

Uptake the rare earth elements Nd, Ce, and La by a commercial diatomite: kinetics, equilibrium, thermodynamic and adsorption mechanism

This study addresses the application and evaluation of diatomite as a low-cost, natural, abundant, and highly efficient adsorbent of Nd3+, Ce3+, and La3+ rare earth elements (REEs). The results revealed that the diatomite was porous and cylindrical, with a specific surface area of 150 m2/g. The diatomite displayed a point of zero charge equal to 1.8, maintaining its surface negatively charged at pH values higher than 1.8, which was beneficial for cationic REEs uptake. At pH 1, all three REEs had their lowest uptake values; at pHs 2–6, the REEs removal efficiency practically did not change. The uptaken percentage increased in the order of La3+ (50%), Ce3+ (77%), and Nd3+ (92%), influenced by the electronegativity of the ions. The Avrami-fractional order (AFO) and Liu isotherm model better fit the kinetic and equilibrium process (qmax = La3+ (22.8 mg g−1), Ce3+ (56.2 mg g−1), and Nd3+ (100.9 mg g−1)). Since the diatomite is highly porous, pore filling/pore-surface diffusion was the main mechanism for REEs adsorption, as well as ion exchange and chelation. The reusability tests revealed that the diatomite could be reused 8 times without losing performance. This research shows that diatomite is an efficient strategy for designing effective, low-cost, sustainable adsorbents to recover REEs from synthetic and real effluents.

Rare earths and other elements content in hen eggs sold in Italy: comparison among main types of farming methods and consumer's health risk assessment.

Recently, in Italy, consumers are choosing hen eggs from farming systems with higher ethical value, due to their perception of a related higher quality and safety. The purposes of this study were to evaluate the existence of differences in elemental content in Italian eggs from organic, barn, and caged hen farming methods and to determine the related potential consumer exposure risk to inorganic contaminants due to the consumption of eggs. One hundred seventy-six egg samples were collected and analyzed using Q-ICP-MS to investigate the content of 14 elements (Pb, As, Hg, Cd, Tl, Fe, Zn, Mn, Cu, Se, Co, Ni, V, and Cr) and 13 rare earth elements (La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm, and Yb). The scenarios of exposure to rare earth and other elements from eggs were estimated for three age groups of consumers. The daily intake values were always lower than the respective safety reference values. In conclusion, Italian hen eggs contain low levels of rare earth and other elements, and therefore, their consumption does not represent a risk of exposure. Finally, no significant differences in contaminants between conventional and organic farming methods were found.

Study on the Influences of Adding Rare Earth Ce on the Precipitation Behaviors of TiN Inclusions in 20CrMnTi.

The morphologies and sizes of TiN inclusions in gear steel 20CrMnTi have a significant impact on its service performance. This paper selects rare earth Ce to modify TiN inclusions in 20CrMnTi. The inclusions are analyzed by SEM (scanning electron microscope), EBSD (electron back-scattered diffraction), EDS (energy disperse spectroscopy), and OTS statistical software, and Thermo-Calc software is used to calculate the inclusion formations. The inclusions of MgAlO4-Ce and CeAlO3 can be formed when rare earth Ce is added into 20CrMnTi, which becomes TiN nucleation core after precipitation. Without the addition of rare earth Ce, square TiN inclusions ranging from 2 to 5 μm account for 60% of the total inclusions in 20CrMnTi. After adding rare earth Ce, the TiN inclusions in 20CrMnTiCe account for 36.7% of the total inclusions. Due to the new phase formations of MgAlO4-TiN and CeAlO3-TiN with sizes less than 2 μm, the titanium-containing inclusions are refined. Fatigue tests are conducted on the steels before and after the addition of Ce. The average fatigue lives of 20CrMnTi do not reach 107 times, and the deviations between the maximum and minimum fatigue lives are great. Large-sized TiN are the main inclusions that affect the fatigue performance of 20CrMnTi. The average fatigue lives of 20CrMnTiCe exceed 107 times, and the deviations of the fatigue lives are smaller than those of 20CrMnTi.

Effect of the rare earth element Ce on the microstructure, properties and thermal stability of Cu-5Fe alloy

The effect of the rare earth element Ce on the morphology evolution, mechanical properties, and thermal stability of the Fe phase in the Cu-5Fe alloy was investigated. Experimental results demonstrate that adding Ce to the Cu-5Fe alloy significantly improves its comprehensive properties, with the tensile strength of the Cu-5Fe-0.1Ce alloy reaching 534 MPa and the electrical conductivity reaching 71% IACS after aging at 350 °C for 1 h. Compared to the Cu-5Fe alloy, the tensile strength experienced an increment of 93 MPa, while the electrical conductivity decreased only by about 2% IACS. The addition of Ce promotes the precipitation of the primary Fe phase, refines the Fe phase, and increases the density of Fe fibers, resulting in excellent mechanical properties. In addition, the thermal stability and grooving kinetics of Fe fibers were assessed. The primary mechanism of Fe fiber structural instability is the thermally-induced grooving at a triple junction where the grain boundary meets the Cu/Fe phase interface. The Fe phase is more likely to form thermally induced grooves and fractures during the aging process due to its high grain boundary energy. Adding Ce to the alloy slows down the expansion of grooves, playing a role in improving the thermal stability of the alloy.

Effect of Ce3+ on structural, morphological, dc electrical resistivity and magnetic studies of Co nano ferrites

The sol-gel auto-combustion method produced rare earth Ce3+ substituted Cobalt ferrite nanomaterials, CoFe2-xCexO4 (x = 0.0, 0.04, 0.08, and 0.12). An X-ray diffractometer, a Field effect scanning electron microscope, a Fourier transform infrared spectrometer, a DC electrical resistivity, and a vibrating sample magnetometer were used to investigate them. The structural, dc resistivity and magnetic properties were examined using standard techniques. XRD analysis revealed a cubic spinel structure in a single phase without any impurity phase for all the prepared samples. With increasing Ce3+ content, a decrease in crystallite size was observed according to Scherrer's formula. Grain size and surface morphology determined from FESEM analysis were 20 to 30 nm. The samples' cubic spinel ferrite properties may be seen in the FTIR data, which show two distinct absorption bands related to the octahedral site at 400 cm-1 and the tetrahedral site at 600 cm-1. FTIR also confirms the presence of Ce3+ in the crystal structure. As the Ce3+ content increases, the DC resistivity decreases, confirming the material's semiconducting nature and temperature increase in all the synthesized samples. The magnetic behaviour strongly influences the substitution of Ce3+ ions. The samples' paramagnetic properties are enhanced by saturation magnetization. The size of the particles affects their coercivity. For the use of nano cobalt ferrite particles in high-density recording media, the MS and HC can be modified.

Effect of micro/nano La2O3 addition on the sintering and properties of mullite synthesized

AbstractThe aim of this work is to prepare interlocking prismatic mullite from low‐cost associated rare‐earth kaolin. High‐performance mullite was synthesized by reaction sintering using calcined associated rare‐earth kaolin and α‐Al2O3 as raw materials and micro‐ and nano‐La2O3 as additives. The mineralogical, morphological, and chemical characteristics of calcined associated rare earth kaolin were analyzed, and the effects of the addition of micro‐ and nano‐La2O3 and sintering temperature on the phase transformation, sintering process, microstructure, and mechanical properties of mullite were studied. The results show that the associated rare earth elements Ce, Th, and Y in calcined kaolin are mainly light rare earth elements, which are mainly endowed in the interlayer structure of K‐bearing clay minerals. The addition of La2O3 can promote the growth of secondary mullite grains and accelerate the secondary mullitization process. The relative densities of mullite samples adding 4 wt.% micro/nano La2O3 and sintered at 1500°C for 4 h were 92.72% and 93.4%, and the micro Vickers hardnesses were 11.32 and 12.35 GPa, respectively. The mullite sample with 2 wt.% nano‐La2O3 had the most interlaced prismatic grains, resulting in the highest flexural strength of 157.8 MPa.

Computational predictions of CeO2 using HSE03: An ab initio investigation

In this paper, the structural, electronic, optical, and mechanical properties of the hexagonal Ceria CeO2 have been studied with hybrid functionals. The rare-earth oxide compound exhibits a [Formula: see text] indirect bandgap, with a bandgap energy of 2.706 eV. The electronic bandstructure has been described in detail in terms of orbital states. The rare-earth Ce f orbital contributes to the conduction band and transitional Ce d, O s electron orbitals to the valence bands. Our optical spectra also fully explain the structural and electronic properties of the material. (i.e. atomic-bonding, density or capacity inside Cerium oxide system, and the excitation of electrons to transfer from valence O 2p to conduction Ce f orbitals, leading to orbital hybridizations, etc.). Finally, our elastic coefficients verify the mechanical stability of our Ceria system. Our bandgap energy found is in excellent agreement with the experimental data. A high optical absorption coefficient of up to [Formula: see text] cm[Formula: see text] is found, indicating a good material absorption within the ultraviolet C (UVC) range. The findings of this work would be beneficial to both theoretical and experimental research works to explore the potential applications of CeO2 in optoelectronics devices.