High Lattice Distortion Research Articles

Excellent radiation resistance via enforced local non-directional He diffusion in a WTaCrV multicomponent alloy containing coherent ordered nanoprecipitates

We design and investigate a W15Ta15Cr35V35 (at.%) multicomponent alloy (MCA) with exceptional radiation resistance. The sintered WTaCrV alloy exhibits a body-centered cubic (BCC) matrix with dispersed coherent ordered nanoprecipitates. After ∼3-hour irradiation under 400 keV He+ at room temperature (RT) and 450 °C with a fluence of 2 × 1017 ions/cm2, the irradiation hardening values of the MCA are about a quarter of those of pure tungsten counterparts irradiated at identical conditions. Besides, helium bubbles generated in the irradiated matrix of the MCA are much smaller, compared with those in the pure tungsten and other tungsten-rich alloys previously reported. The exceptional radiation resistance of the present WTaCrV alloy can be mainly attributed to two synergistic mechanisms. First, the high lattice distortion of the solid solution matrix promotes the local non-directional diffusion of irradiation defects, effectively suppressing the aggregation of irradiation defects and helium atoms along specific orientations. This facilitates more uniform nucleation of helium bubbles in the alloy matrix. Second, carbon was introduced during fast hot pressing sintering as interstitial solute to form carbon-rich coherent ordered nanoprecipitates. The carbon-vacancy complexes generated in the nanoprecipitates inhibit the nucleation and aggregation of helium atoms at the vacancies during He+ irradiation. The above two mechanisms synergistically enhance the resistance against He+ irradiation. This work thus demonstrates a design strategy for high radiation resistance alloys by introducing well-tuned ordered coherent nanoprecipitates in multicomponent alloy systems.

Nanostructure and dislocation interactions in refractory complex concentrated alloy: From chemical short-range order to nanoscale B2 precipitates

Refractory complex concentrated alloys (RCCAs) have emerged as a promising class of structural materials, demonstrating exceptional mechanical performance in aggressive environments. However, the complex atomic environments, significant lattice distortion, and vast compositional space of RCCAs present challenges to understanding the mechanisms that govern structure-property relationships. In this study, we explore the dislocation mechanisms in three model quaternary RCCAs, namely Mo25Nb10Ta25W40 (at. %), Mo25Nb25Ta25W25, and Mo25Nb40Ta25W10 using large-scale atomistic simulations and machine learning based Spectral Neighbor Analysis Potential. Our atomistic simulations examine how the chemical composition and local ordering influence the mobility of both edge and screw dislocations, and how lattice distortion and diffuse anti-phase boundary energy (DAPBE) affect dislocation behaviors during nanostructural evolution. Notably, with the increase in Nb concentration in the model RCCAs, both DAPBE and lattice distortion are simultaneously enhanced as the chemical short-range order (CSRO) evolves into nanoscale B2 precipitates. This evolution results in high lattice distortion due to the lattice mismatch between B2 precipitates and the random matrix. Consequently, B2 nanoprecipitates provide a stronger pinning effect, hindering edge dislocation motion while promoting cross-slip of screw dislocations, leading to a reduced screw-to-edge ratio in slip resistance and mobility discrepancy. These findings offer valuable insights into dislocation behaviors and interactions with ordered precipitates, highlighting the importance of exploring non-equiatomic compositions and advancing beyond CSRO in RCCAs. This study has implications for optimizing alloy compositions and processing methods for superior performance in aggressive environments.

Influence of He injection amount on the microstructure of ion irradiated Cr0.8FeMnNi medium entropy alloy compared with 316L stainless steel

In recent years, medium and/or high-entropy alloys (M/HEAs) have attracted attention due to their excellent mechanical properties, positioning them as potential candidates for structural materials in advanced nuclear reactors. This study investigated the effect of He injection amount on the microstructural evolution in Cr0.8FeMnNi MEA and 316L stainless steel. Helium atoms were injected, followed by Fe2+ irradiation. Transmission electron microscopy was used to characterize the irradiation-induced defects. The primary irradiation-induced defects observed across all He injection amounts were black dots; no voids were seen under any irradiation conditions. In He-injected Cr0.8FeMnNi, the number density of black dots was significantly lower than in non-He-injected Cr0.8FeMnNi, while the average size of black dots increased with higher He injection rates. As the He injection amount increased, the binding energy of the self-interstitial atom (SIA) to the He-V complex decreased. This reduction facilitated the nucleation and growth of numerous SIA clusters within the matrix, consequently increasing the number density of black dots. The change in the number density of black dots in Cr0.8FeMnNi was much smaller than that observed in 316L. This could be ascribed to the enhanced self-healing process caused by the diversity of point defects and higher lattice distortion in Cr0.8FeMnNi.

Ultrathin high-entropy layered double hydroxide electrocatalysts for enhancing oxygen evolution reaction

At the heart of the oxygen evolution reaction (OER), the properties of electrocatalysts play a crucial role in determining reaction efficiency. This underscores the need to design and develop highly effective OER electrocatalysts. The unique layer structure and electronic properties make layer double hydroxide (LDH) a promising candidate for driving OER electrocatalysis. Furthermore, high-entropy materials (HEMs) exhibit core effects such as high entropy, lattice distortion, sluggish diffusion, and cocktail effect, which can enhance active sites and optimize binding energy with intermediates. Combining the advantages of these two material categories, we propose the synthesis of high-entropy layered double hydroxides (HE-LDHs) through a straightforward MOF-mediated synthesis method to showcase exceptional electrocatalytic OER performance. Detailed mechanistic studies have shown that its outstanding performance stems from its ultrathin structure and the inherent activity of a high-entropy material that promotes charge transfer, mass transport, and the evolution of reaction intermediates.

Swift Au+9 ion irradiation-induced defects and alloy complexity effect on the mechanical hardness of NiCoCrFePd HEA and NiCoCrFe MEA

The outstanding radiation damage stability of an NiCoCrFePd high entropy alloy (HEA) as compared to conventional alloys poses the question for the mechanism of an ion–matter interaction. The positron annihilation lifetime spectroscopic and TEM (transmission electron microscopic) measurements are implemented to trace different kinds of defects produced by 120 MeV Au+9 ion irradiation and their evolution as a function of ion fluence. The variation of lifetimes and corresponding intensities with the ion fluence indicates the formation of dislocation-type defects at a lower ion fluence and vacancy clusters at a higher ion fluence caused by coalescence or agglomeration of dislocation defects. Formation of different types of defects in turn modulates the strain development inside the crystal. Additionally, the HR-TEM investigation of NiCoCrFePd HEA also exhibits the formation of dislocation and vacancy clusters with the average size of vacancy clusters increases from ∼2.9 ± 0.1 to ∼3.8 ± 0.1 nm with the increases in the ion fluence. Surprisingly, the average defect cluster size in NiCoCrFePd HEA is suppressed compared to NiCoCrFe MEA, thereby showing the enhanced radiation stability on Pd incorporation due to the high defect recombination caused by reduced thermal conductivity and high lattice distortion. Nano-indentation measurement shows that the radiation hardening behavior of the NiCoCrFePd HEA responded slowly owing to its damage suppression property as compared to the NiCoCrFe MEA. Additionally, softening behavior also appeared at an early fluence in NiCoCrFe MEA compared to the NiCoCrFePd HEA signifying its excellent resistance to defect accumulation.

Unraveling dislocation-based strengthening in refractory multi-principal element alloys

Refractory multi-principal element alloys (RMPEAs) draw great interest with their superior mechanical properties and extremely high melting points, yet the strengthening mechanism remains unclear. Here, we calculate the critical resolved shear stress (CRSS) for a single dislocation to move in RMPEAs consisting of 4 or 5 elements with or without short-range order (SRO) to represent strength by a machine learning-based interatomic potential. The increased CRSS is then attributed to high lattice distortion, elastic mismatch, and SRO strengthening, all of which originate from the solid solution strengthening theory. After detailed research of the CRSS across many RMPEAs systems with different composition ratios, we construct an XGBoost model to predict the CRSS from a few parameters and rank their importance. We find that lattice distortion strongly influences both dislocation types and reduces the screw-to-edge ratio in CRSS, while the elastic mismatch has a more significant impact on the screw dislocation than the edge one.

Achieving ultra-strong and ductile CoNi-based FCC multi-principal element alloys via alloying with refractory Mo and W

FCC single-phase multi-principal element alloys (MPEAs) often suffer from insufficient strength, which limits their wide applications. Here a CoNi-based FCC MPEA (Co44Ni44Mo9W3, at. %) was designed by alloying with refractory Mo and W. The Co44Ni44Mo9W3 alloy possesses an ultrahigh yield strength of ∼1050 MPa and good ductility of ∼30 % at ambient temperature. The excellent mechanical properties were correlated to its superior lattice friction stress and grain boundary strengthening compared to most reported FCC MPEAs and conventional alloys. By density-functional theory calculations, such extraordinary mechanical properties were further attributed to its high lattice distortion, low intrinsic stacking fault energy and high unstable stacking fault energy due to the addition of Mo and W. Transmission electron microscopy investigations revealed that the high strength-ductility combination arises from the synergistic effect of planar slip bands, stacking faults and deformation nano-twins.

Evolutions of microstructural defects in high-entropy carbide ceramics under ion irradiations at room temperature

This work studied and compared the evolutions of irradiation-induced microstructural defects in five high-entropy carbide ceramics (HECCs) at room temperature to reveal the irradiation resistances of HECCs and corresponding underlying mechanisms. The five HECCs exhibit high phase stabilities and no amorphization is observed up to 40 dpa. In-situ 800 keV Kr ion irradiation reveals similar evolutions of irradiation-induced defects. The densities of dislocation loops show non-monotonic variations, which reach the maximum at ∼ 2 dpa and then decrease due to the interactions with each other. In contrast, the sizes of dislocation loops increase monotonically with dose. (NbTaZrW)C exhibits the lowest defect densities and highest defect sizes, which is probably due to the high lattice distortion and its induced high defect recombination efficiencies. Based on the characterization results, it is deduced that the species of constituent elements play more important role in the defect behaviors than the number of constituent elements.

Enhanced Thermal Stability and Broad Temperature Range in High-Entropy (La0.2Ce0.2Nd0.2Sm0.2Eu0.2)NbO4 Ceramics.

Next-generation high-temperature applications increasingly rely heavily on advanced thermistor materials with enhanced thermal stability and electrical performance. However, thus far, the great challenge of realizing high thermal stability and precision in a wide temperature range has become a key bottleneck restricting the high-temperature application. Here, we propose a high-entropy strategy to design novel high-temperature thermistor ceramics (La0.2Ce0.2Nd0.2Sm0.2Eu0.2)NbO4. Differences in atomic size, mass, and electronegativity in this high-entropy system cause high lattice distortion, substantial grain boundaries, and high dislocation density. These enhance the charge carrier transport and reduce the grain boundary resistance, thus synergistically broadening the temperature range. Our samples maintain high precision and thermal stability over a wide temperature range from room temperature to 1523 K (ΔT = 1250 K) with an aging value as low as 0.42% after 1000 h at 1173 K, showing breakthrough progress in high-temperature thermistor ceramics. This study establishes an effective approach to enhancing the performance of high-temperature thermistor materials through high-entropy strategies.

First-principles calculation of lattice distortion, electronic structure, and bonding properties of GeTe-based and PbSe-based high-entropy chalcogenides

The massive amount of wasted heat energy from industry has pushed the development of thermoelectric (TE) materials that directly convert heat into electricity to a new level of concern. Recently, multicomponent alloys such as GeTe-based and PbSe-based high-entropy (HE) chalcogenides have attracted a great deal of attention due to their potential application as TE materials. The nature of the interatomic bonding, lattice distortion (LD), and the electronic structure in this class of materials is not fully understood. Herein, we report a comprehensive computational investigation of nine GeTe-based HE alloys with eight metallic elements (Ag, Pb, Sb, Bi, Cu, Cd, Mn, and Sn) with large supercells of 1080 atoms each; seven PbSe-based HE solid solutions: Pb0.99−ySb0.012SnySe1−2xTexSx (x = 0.1, 0.2, 0.25, 0.3, 0.35, 0.4, 0.45, with y = 0) with supercells of 1000 atoms each; and five Pb0.99−ySb0.012SnySe1−2xTexSx (y = 0.05, 0.1, 0.15, 0.2, 0.25 with x = 0.25) solid solutions with supercells of 1000 atoms each. All these HE models are theoretically investigated for the first time. The electronic structure, interatomic bonding, charge transfer, and lattice distortion (LD) are investigated by first-principles calculations based on density functional theory. Multicomponent HE alloys can cause a significant LD, which affects their mechanical, thermal, and TE properties. The calculations for the GeTe-based HE chalcogenides showed that they are semiconductors with a narrow bandgap, except for m8, which has a semi-metallic characteristic, and this makes them good candidates for TE applications. For most of these models, the Fermi level shifts upward and locates deeply in the conduction bands, resulting in the enhancement of the electrical conductivity (σ). The bonding properties showed that most bonds in m5 are more dispersed, indicating highest LD and lower lattice thermal conductivity. For PbSe-based HE solid solutions, the LD calculations showed that the models Pb0.99Sb0.012Se0.5Te0.25S0.25 and Pb0.89Sb0.012Sn0.1Se0.5Te0.25S0.25 have the higher LD, and thus a lower lattice thermal conductivity. Such investigations are in high demand since it enables us to design new HE chalcogenides for TE applications. We use the novel concept of total bond order density as a single quantum mechanical metric to characterize the internal cohesion of these HE alloys and correlate with calculated properties, especially the mechanical properties. This work provides a solid database for HE chalcogenides and a road map for many potential applications. Moreover, the computational procedure we developed can be used to design new HE chalcogenides for specific TE applications.

Temperature Field Simulation and Experimental Confirmation of Laser Cladding High-Entropy Alloy Coating on Cr12MoV

In order to meet the mechanical property of the die steel, this study used laser cladding to prepare a high-entropy alloy coating on Cr12MoV. A finite element method using a double ellipsoidal heat source model is proposed to simulate the evolution of the temperature field in laser cladding. The simulation results showed that with the increase in the power, the peak temperature of the molten pool increased from 2005.5 °C to 2357.4 °C, and the depth of the molten pool increased from 1.60 mm to 2.04 mm. The coating with the laser power of 1600 W had a good macroscopic quality and high lattice distortion (2.43 × 10−2). Due to the increase in laser energy density, the size of equiaxed crystals gradually increased from 1400 W to 1700 W. Under the comprehensive effect of the solution and fine grain strengthening, the coating with the power of 1600 W had a higher average microhardness (600 HV), which is 150% higher than that of the substrate. The experiment results further confirmed the accuracy of the simulation.

Revealing proton-coupled exchange mechanism in aqueous ion-exchange synthesis of nickel-rich layered cathodes for lithium-ion batteries

Ion exchange is a promising synthetic method for alleviating severe cation mixing in traditional layered oxide materials for lithium-ion batteries, leading to enhanced structural stability. However, the underlying mechanisms of ion exchange are still not fully understood. Such a fundamental study of the ion-exchange mechanism is needed for achieving the controllable synthesis of layered oxides with a stable structure. Herein, we thoroughly unearth the underlying mechanism that triggers the ion exchange of Ni-rich materials in aqueous solutions by examining time-resolved structural evolution combined with theoretical calculations. Our results reveal that the reaction pathway of ion exchange can be divided into two steps: protonation and lithiation. The proton is the key to achieving charge balance in the ion exchange process, as revealed by X-ray adsorption spectroscopy and inductive coupled plasma analysis. In addition, the intermediate product shows high lattice distortion during ion exchange, but it ends up with a most stable product with high lattice energy. Such apparent discrepancies in lattice energy between materials before and after ion exchange emphasize the importance of synthetic design in structural stability. This work provides new insights into the ion-exchange synthesis of Ni-rich oxide materials, which advances the development of cathode materials for high-performance lithium-ion batteries.

Impact of vacancy defects on the thermal conductivity of BaAgBi: a comprehensive study using molecular dynamics simulations with neural network potentials.

The presence of vacancy defects significantly impacts thermal properties of materials. In this research, we delve into the effects of vacancy defects on the thermal conductivity of ternary alloy BaAgBi, employing molecular dynamics simulations coupled with a deep neural network potential (NNP). Initially, we validate the precision of our NNP by comparing their predictions for energy, atomic forces, phonon dispersion curves, phonon density of states, and vacancy formation energy with density functional theory calculations, ensuring a high degree of accuracy. Our findings reveal that the reduction in thermal conductivity due to vacancies aligns with the Debye-Callaway model, with variations depending on the type of vacancy. Specifically, Ba vacancies result in the most notable decrement in thermal conductivity, attributable to their low phonon participation ratio and high lattice distortion, both factors that enhance phonon scattering. Besides, we find that the high energy barrier (∼1.66 eV) indicates that Ba vacancies hardly migrate at 300 K. This study helps us understand how vacancies affect thermal conductivity in BaAgBi and how different vacancy types affect it.

Elinvar-Like Effect Induced by High Lattice Distortion in Zr 6 Ta 2 O 17 Ceramics

Super strength and toughness, excellent deformation resistance, and high-temperature service performance are the key factors to determine the practical application of new thermal barrier coatings (TBCs). The limited mobility of dislocations and the internal inherent defects in ceramics will inevitably lead to the decline of strength–plasticity and the reduction of service performance. Introducing preexisting twin boundaries and stacking faults (SFs) or preparing ceramic materials with high configuration entropy has demonstrated to be an effective strategy for enhancing the mechanical properties of ceramics. However, due to the positive thermal expansion coefficient of most ceramics and the remarkable increase of structural disorder at elevated temperature, the problem of elastic softening has become a bottleneck restricting the high-temperature service life of new TBCs. In this paper, the deformation behavior of high configuration entropy Zr 6 Ta 2 O 17 ceramics at 25 to 1,200 °C was in situ monitored via digital image correlation technique and three-point bending test platform in high-temperature environment. A remarkable Elinvar-like effect appears in the Zr 6 Ta 2 O 17 ceramic. More interestingly, mechanical deformation dominates the severe lattice distortion (deformation twins, SFs) and the disorder–order transition of chemical order at the atomic scale, while temperature can further enhance the degree of lattice distortion and ordering of Zr 6 Ta 2 O 17 ceramics. Furthermore, the atomic fluctuations at high temperature promotes the comprehensive improvement of mechanical properties in the Zr 6 Ta 2 O 17 ceramics.

A high-entropy FeCoMnCuNi diselenide self-standing electrode with outstanding water-electrolysis performance in alkaline medium

A self-standing high-entropy FeCoMnCuNiSe2 electrode exhibited superior HER activity and OWS performance due to high entropy, lattice distortion and tip-enhancement effects.

Composition, structure, and wear resistance of (TiZrNbMoTa)CxN1-x high entropy alloy carbonitride coatings prepared by reactive radio-frequency magnetron sputtering

HEN has high hardness and good toughness but a high coefficient of friction and poor wear resistance. In this study, a high hardness, toughness, and wear-resistant HECxN1-x coating was prepared by reactive radio-frequency magnetron sputtering (RFMS) technology. The phase composition, microstructure, mechanical properties, and tribological properties of the HEN and HECxN1-x coatings were investigated. The results show that all coatings have single-phase rock salt structures. The double anion lattice structure of the HECxN1-x coating produces a high lattice distortion effect and grain refinement effect, which realizes the strengthening and hardening of the coating. When the [C]/([C] + [N]) ratio is 0.3, the hardness of the HECxN1-x coating reaches the maximum value of 41.7GPa, and when the [C]/([C] + [N]) ratio is 0.4, the coating toughness reaches the maximum value of 0.91GPa, which are 48 % and 203 % higher than HEN. The self-lubricating effect of supersaturated precipitated amorphous carbon makes the HECxN1-x coating achieve excellent tribological properties. Among them, HEC0.5N0.5 coating has the best tribological properties, its coefficient of friction (COF) is 0.391, which is 148 % lower than that of HEN coating, and the wear rate is reduced to 1/15 of HEN coating, which is one order of magnitude reduction. Introducing the C element based on HEN can effectively solve the problems of high friction coefficient and poor wear resistance of high entropy nitride ceramic coatings.

Additively manufactured high entropy alloy with high wear resistance for biomedical implant

Titanium and its alloys play a vital role as implant materials in orthopedic and dental surgery. However, its poor wear resistance limits its application in the medical field. High entropy alloy (HEA) has high wear resistance due to the combined action of high entropy, lattice distortion, and cocktail effects. In this work, TiFeCrCoNi HEA is prepared by Laser powder bed fusion (LPBF) under the protection of high pure Ar gas. The results show the TiFeCrCoNi HEA has mainly FCC phase and a small amount of Hexagonal and Laves phases. Its microhardness is up to 776.3 ± 21.4 H V and is 2.8 times that of pure Ti. Meanwhile, the HEA has a low friction coefficient of 0.1–0.15, which is attributed to high hardness precipitates and grain refinement. The main wear mechanism of the HEA is oxidation wear, adhesive wear, and abrasive wear. In addition, the TiFeCrCoNi HEA also demonstrates good biocompatibility.

(Invited) Application of Synchrotron X-Ray Topography Techniques to the Analysis of Defect Microstructures in Bulk GaN Substrates and Epilayers for Power Devices

Wide bandgap semiconductor gallium nitride (GaN), along with silicon carbide (SiC) are replacing silicon materials in the applications for power electronic devices. While SiC-based power technologies are based on bulk SiC substrates, GaN-based power technologies have until recently been based on GaN layers grown on foreign substrates such as sapphire, SiC and Si substrates. To achieve the full potential of GaN power devices, devices on bulk GaN substrates are desirable. In this review, the use of synchrotron X-ray topography techniques to evaluate defects and strain in bulk GaN substrates for vertical device development is presented. Ray tracing simulations is shown to effectively identify the Burgers vectors of all dislocations on X-ray topographs from GaN materials. Ammonothermal-grown GaN substrate wafers show the best quality among all the wafers. These wafers, which are free of basal plane dislocations (BPDs), have low curvature and threading mixed dislocations (TMDs) dominant among the TDs. However, certain ammonothermal substrates contain growth sectors with different impurity concentrations that are likely inherited from prior seed expansion growth runs. Patterned hydride vapor phase epitaxy (HVPE) GaN reveal a starkly heterogeneous distribution of dislocations with large areas containing low threading dislocation densities in between a grid of strain centers with higher threading dislocation densities and BPDs. These substrates also contain growth sector boundaries separating core regions growing in <11-22> directions and surrounding regions growing along [0001]. HVPE GaN substrates are characterized by high lattice distortion and dislocation densities of the order of 105-106 cm-2, which is much higher than 103-104 cm-2 of ammonothermal samples and dislocation-free areas in the patterned HVPE samples. Epitaxial growth and other processes involving heat treatment (including annealing) does not nucleate new defects but can result in interactions of dislocations (threading screw dislocations(TSDs)/threading mixed dislocations (TMDs)/threading edge dislocations (TEDs)) with point defects leading to changes in dislocation configurations. Mg-ion implantation for p-type doping does not change the distribution of dislocation but introduces lattice damage. By Rocking curve Analysis by Dynamical Simulation (RADS) analysis of X-ray rocking curves, the depth profile of strain can be obtained and correlated with doping profile. During annealing the implanted samples to heal lattice damage and activate the Mg ions, proper capping is necessary to limit loss of matter and introduction of additional lattice distortion. However, high pressure annealing has been shown to eliminate the need for capping. The effect on microstructure from other selectively area doping techniques such as etch and regrowth, diffusion and neutron transmutation will also be discussed.

Chemical complexity-changed deformation behavior of NiTi-based B2 low- to high-entropy intermetallic compounds: Atomistic simulations

Owing to the high chemical complexity and severe lattice distortion but still long-range ordered structure, the deformation behavior and defect activities of high-entropy intermetallic compounds are worth investigations. Hence in this study, the mechanical properties of NiTi-based low- to high-entropy intermetallic compounds were measured from different orientations at different temperatures simply by using nanoindentations, and compared with the structural evolution and defect activities suggested by molecular dynamics simulations. The deformation of the low-entropy intermetallic compound proceeded with regular martensitic transformation, followed by the heterogeneous nucleation of dislocations at the martensite/austenite interface and the subsequent long-distance gliding accompanied with sharp stress drops. With increasing temperature, a more intense shearing events and marked strength reduction were observed. In comparison, with the introduction of constitutional complexity, the martensitic transition was suppressed. Instead, the early homogeneous nucleation at a relatively small activation volume (acquired from indenting displacement bursts) and small-range activities of abundant defects mediated the smooth stress-strain response and uniform plastic deformation of the high-entropy intermetallic compound. At an elevated temperature, a similar deformation mechanism and the same level of strength were retained in the chemically complex alloy.

High-entropy (CoCrFeMnNi)3O4 catalysts for propane catalytic destruction: Effect of the precipitation agent

Efficient catalytic destruction of light alkane with ultra-stable and highly symmetric structure is still an intractable issue. High entropy oxides (HEOs) with high chemical disorder and lattice distortion and superior stability have shown great potential in heterogeneous thermocatalysis. Herein, spinel-type HEOs are synthesized via a scalable co-precipitation method with different precipitants (NaOH, Na2CO3, and NaHCO3) and firstly adopted in catalytic destruction of propane. Results demonstrate that the HEO-NaOH possesses the best activity, achieving 90% of propane conversion at 325 °C with an apparent activation energy of 56 kJ mol−1. Compared with other two HEOs, the HEO-NaOH has larger quantities of surface oxygen vacancies and easily forms several reactive oxygen species (OOH−, O2−, and OH−, etc.), which significantly contribute to improve the catalytic performance. Moreover, the excellent water resistance of HEOs is verified due to their high conformational entropy and structural stability. Reaction mechanism reveals that OOH− and O2− are the key species in the oxidation of C3H8, which break C-H and C-C bonds in sequence, and are then converted to oxygenated compounds via oxygen oxidation before the final mineralization. The present work provides new insights into the fabrication of efficient catalysts for light alkane destruction as well as other thermocatalytic applications.