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Competitive oxidation behavior of Ni-based superalloy GH4738 at extreme temperature 被引量:3
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作者 Hui Xu Shufeng Yang +4 位作者 Enhui Wang Yunsong Liu Chunyu Guo xinmei hou Yanling Zhang 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CSCD 2024年第1期138-145,共8页
A high thrust-to-weight ratio poses challenges to the high-temperature performance of Ni-based superalloys. The oxidation behavior of GH4738 at extreme temperatures has been investigated by isothermal and non-isotherm... A high thrust-to-weight ratio poses challenges to the high-temperature performance of Ni-based superalloys. The oxidation behavior of GH4738 at extreme temperatures has been investigated by isothermal and non-isothermal experiments. As a result of the competitive diffusion of alloying elements, the oxide scale included an outermost porous oxide layer (OOL), an inner relatively dense oxide layer (IOL), and an internal oxide zone (IOZ), depending on the temperature and time. A high temperature led to the formation of large voids at the IOL/IOZ interface. At 1200℃, the continuity of the Cr-rich oxide layer in the IOL was destroyed, and thus, spallation occurred. Extension of oxidation time contributed to the size of Al-rich oxide particles with the increase in the IOZ. Based on this finding,the oxidation kinetics of GH4738 was discussed, and the corresponding oxidation behavior at 900-1100℃ was predicted. 展开更多
关键词 Ni-based superalloy GH4738 extreme temperature competitive oxidation oxidation mechanism oxidation kinetics
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Porous high-entropy rare-earth phosphate(REPO_(4),RE=La,Sm,Eu,Ce,Pr and Gd)ceramics with excellent thermal insulation performance via pore structure tailoring 被引量:1
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作者 Peixiong Zhang Enhui Wang +3 位作者 Jingjing Liu Tao Yang Hailong Wang xinmei hou 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2024年第7期1651-1658,共8页
Thermal insulation materials play an increasingly important role in protecting mechanical parts functioning at high temperatures.In this study,a new porous high-entropy(La_(1/6)Ce_(1/6)Pr_(1/6)Sm_(1/6)Eu_(1/6)Gd_(1/6)... Thermal insulation materials play an increasingly important role in protecting mechanical parts functioning at high temperatures.In this study,a new porous high-entropy(La_(1/6)Ce_(1/6)Pr_(1/6)Sm_(1/6)Eu_(1/6)Gd_(1/6))PO_(4)(HE(6RE_(1/6))PO_(4))ceramics was prepared by combining the high-entropy method with the pore-forming agent method and the effect of different starch contents(0–60vol%)on this ceramic properties was systematically investigated.The results show that the porous HE(6RE_(1/6))PO_(4)ceramics with 60vol%starch exhibit the lowest thermal conductivity of 0.061 W·m^(-1)·K^(-1)at room temperature and good pore structure stability with a linear shrinkage of approximately1.67%.Moreover,the effect of large regular spherical pores(>10μm)on its thermal insulation performance was discussed,and an optimal thermal conductivity prediction model was screened.The superior properties of the prepared porous HE(6RE_(1/6))PO_(4)ceramics allow them to be promising insulation materials in the future. 展开更多
关键词 porous high-entropy(La_(1/6)Ce_(1/6)Pr_(1/6)Sm_(1/6)Eu_(1/6)Gd_(1/6))PO_(4) ceramics high-entropy strategy pore-forming agent method thermal insulation material thermal conductivity
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Research Progress of Refractory High Entropy Alloys:A Review 被引量:5
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作者 Xiaochang Xie Neng Li +6 位作者 Wei Liu Shuai Huang Xiaoyong He Qiuying Yu Huaping Xiong Enhui Wang xinmei hou 《Chinese Journal of Mechanical Engineering》 SCIE EI CAS CSCD 2022年第6期1-22,共22页
Owing to superior comprehensive performance than conventional superalloys at high temperature,refractory high entropy alloy(RHEA)is becoming a promising candidate for the next generation high-temperature material.Here... Owing to superior comprehensive performance than conventional superalloys at high temperature,refractory high entropy alloy(RHEA)is becoming a promising candidate for the next generation high-temperature material.Herein,contemporary aspects of corresponding development of RHEAs are reviewed to discuss various factors affecting the organization structure and service performance.It mainly covers alloying system and strengthening mechanism,the preparation method,plastic deformation and the related mechanism,as well as microstructure control by heat treatment.Firstly,the alloy systems and strengthening mechanism are introduced.This is followed by different preparation methods and the comparison of strengths and shortcomings based on different RHEAs.Then,hot deformation behavior and plastic deformation under different loadings are analyzed.Based on this,the influence of heat treatment on microstructures prior to and after the deformation is further summarized.Finally,some important research areas to be carried out in future are pointed out.This review will give a deep understanding of the effects of different factors on the service performance and provide scientific guide in designing RHEAs with improved performance. 展开更多
关键词 Refractory high entropy alloy Preparation method Strengthening Plastic deformation Heat treatment
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Synthesis of CA_(6)/AlON composite with enhanced slag resistance 被引量:2
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作者 Yunsong Liu Enhui Wang +4 位作者 Linchao Xu Tao Yang Zhijun He Tongxiang Liang xinmei hou 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2023年第4期756-765,共10页
Different amounts of AlON have been introduced in calcium hexaaluminate(CA_(6)) using two approaches, that is, one-step and twostep methods, to improve the slag resistance of CA_(6). A one-step method can directly sin... Different amounts of AlON have been introduced in calcium hexaaluminate(CA_(6)) using two approaches, that is, one-step and twostep methods, to improve the slag resistance of CA_(6). A one-step method can directly sinter the mixtures combining Al_(2)O_(3), CaCO_(3), and Al in flowing nitrogen, in which AlON clusters are always formed because of the poor wettability of Al by Al_(2)O_(3), leading to the high porosity of CA_(6)/AlON composite. In a two-step method, CA_(6)and AlON are prepared separately and then mixed and sintered in flowing nitrogen. Compared with the sample prepared by the one-step method, CA_(6)and AlON in composite by the two-step method are more uniformly distributed,and the optimized amount of AlON added is 10wt%. The slag corrosion and penetration test shows that the CA_(6)/AlON composite using the two-step method exhibits superior slag corrosion protection. The promoted effect of AlON on slag penetration and corrosion resistance is also discussed. 展开更多
关键词 CA_(6)/AlON composite two-step method WETTABILITY slag resistance
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Effect of heat treatment temperature of the glaze lager on the structure and the formaldehyde removal performance of an interior wall tile
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作者 Ruqin Gao Yingrui Huang +4 位作者 Enhui Wang xinmei hou Lu Pan Guoting Li Bingtao Liu 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2022年第11期2079-2085,共7页
With the improvement of people’s living standards,a large number of petroleum products,daily necessities and decorations that can produce volatile organic compounds are used in decoration,which seriously affects the ... With the improvement of people’s living standards,a large number of petroleum products,daily necessities and decorations that can produce volatile organic compounds are used in decoration,which seriously affects the indoor air quality.Interior decoration materials have become a research hotspot in recent years.The purpose of this paper is to develop a kind of interior wall material with good indoor formaldehyde removal effect,easily using,and low cost.In this paper,combining different heat treatment temperatures of the glaze layer,tourmaline/diatomite-based interior wall tiles were prepared by ultrafine grinding,solid sintering,and low temperature calcination.The glaze layer under different heat treatment temperatures was characterized by thermogravimetric-differential thermal analysis,X-ray diffraction,and scanning electron microscope.The influences of heat treatment temperature on the microscopic morphology and structure of the glaze layer were analyzed.Taking formaldehyde as the target degradation product,the effects of tourmaline/diatomite-based interior wall tiles on the removal of formaldehyde under different heat treatment temperatures of the glaze layer were investigated.The results showed that with the increase in heat treatment temperature,the original pores of diatomite decreased,the specific surface area decreased,and the structure of tourmaline changed.At 850℃,the surface structure of the material was slightly damaged,the strength was increased,and the removal effect of formaldehyde was better.In a 1 m^(3) environmental chamber,the formaldehyde removal rate reached 73.6%in 300 min.When the temperature was increased to 950℃ and above,diatomite and the structure of tourmaline were destroyed,and the ability of the material to adsorb and degrade formaldehyde decreased. 展开更多
关键词 DIATOMITE tourmaline/diatomite-based interior wall tiles glaze layer heat treatment temperature FORMALDEHYDE adsorption and degradation
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Ultra-Stable and Durable Piezoelectric Nanogenerator with All-Weather Service Capability Based on N Doped 4H-SiC Nanohole Arrays
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作者 Linlin Zhou Laipan Zhu +6 位作者 Tao Yang xinmei hou Zhengtao Du Sheng Cao Hailong Wang Kuo-Chih Chou Zhong Lin Wang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2022年第2期151-160,共10页
Ultra-stable piezoelectric nanogenerator(PENG)driven by environmental actuation sources with all-weather service capability is highly desirable.Here,the PENG based on N doped 4H-SiC nanohole arrays(NHAs)is proposed to... Ultra-stable piezoelectric nanogenerator(PENG)driven by environmental actuation sources with all-weather service capability is highly desirable.Here,the PENG based on N doped 4H-SiC nanohole arrays(NHAs)is proposed to harvest ambient energy under low/high temperature and relative humidity(RH)conditions.Finite element method simulation of N doped 4H-SiC NHAs in compression mode is developed to evaluate the relationship between nanohole diameter and piezoelectric performance.The density of short circuit current of the assembled PENG reaches 313 nA cm^(-2),which is 1.57 times the output of PENG based on N doped 4H-SiC nanowire arrays.The enhancement can be attributed to the existence of nanohole sidewalls in NHAs.All-weather service capability of the PENG is verified after being treated at-80/80℃and 0%/100%RH for 50 days.The PENG is promising to be widely used in practice worldwide to harvest biomechanical energy and mechanical energy. 展开更多
关键词 Piezoelectric nanogenerators N doped 4H-SiC nanohole arrays Environmental actuation sources All-weather service capability Enhanced short circuit current density
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A facile and green strategy for mass production of dispersive FeCo-rich phosphides@N,P-doped carbon electrocatalysts toward efficient and stable rechargeable Zn-air battery and water splitting
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作者 Bo Wang Qiao Liu +5 位作者 Ao Yuan Qing Shi Lan Jiang Weiyou Yang Tao Yang xinmei hou 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2024年第15期1-11,共11页
One key step for advancing the widespread practical application of rechargeable metal-air batteries and water electrolysis fundamentally relies on the development of cost-effective multifunctional electrocata-lysts to... One key step for advancing the widespread practical application of rechargeable metal-air batteries and water electrolysis fundamentally relies on the development of cost-effective multifunctional electrocata-lysts toward oxygen and hydrogen-involving reactions.The present work initiates a tofu-derived one-pot strategy for green,facile,and mass production of highly active and stable catalyst toward oxygen reduc-tion/evolution and hydrogen evolution reactions,through the preparation of Fe/Co cross-linked tofu gel and the subsequent pyrolysis.Despite the free use of additional N/P precursors or pore-forming agents,the as-prepared materials comprise highly dispersive FeCo-rich phosphides nanoparticles and porous N,P co-doped carbon network inherited from the tofu skeleton.The resultant catalysts exhibit remarkably enhanced trifunctional activities as compared to the Fe_(2)P and Co_(2)P counterparts,along with better long-term stabilities than the benchmark RuO_(2)and Pt/C catalysts.Accordingly,the as-assembled Zn-air battery delivers a large power density(174 mW cm^(-2))with excellent cycle stability(the gap of charge/discharge voltage@10 mA cm^(-2)increases by 0.01 V after 720 h of operation,vs.0.16 V of Pt/C-RuO_(2)based battery after 378 h).Furthermore,the as-constructed alkaline electrolyzer just requires a small voltage of 1.55 V@10 mA cm^(-2),which outperforms nearly all of those of biomass-derived electrocatalysts ever reported,and that of noble metal catalysts-based electrolyzers(1.72 V@10 mA cm^(-2)for Pt/C-RuO_(2)),underscoring their bright future toward commercial applications in green energy conversion devices. 展开更多
关键词 Soybean PHOSPHIDES ELECTROCATALYSIS Overall water splitting Zn-air battery
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PVDF/6H-SiC composite fiber films with enhanced piezoelectric performance by interfacial engineering for diversified applications
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作者 Linlin Zhou Tao Yang +7 位作者 Chunyu Guo Kang Wang Enhui Wang Laipan Zhu Hailong Wang Sheng Cao Kuo-Chih Chou xinmei hou 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2024年第3期238-245,共8页
Piezoelectric silicon carbide(SiC)has been quite attractive due to its superior chemical and physical properties as well as wide potential applications.However,the inherent brittleness and unsatisfactory piezoelectric... Piezoelectric silicon carbide(SiC)has been quite attractive due to its superior chemical and physical properties as well as wide potential applications.However,the inherent brittleness and unsatisfactory piezoelectric response of piezoelectric semiconductors remain the major obstacles to their diversified applications.Here,flexible multifunctional PVDF/6H-SiC composite fiber films are fabricated and utilized to assemble both piezoelectric nanogenerators(PENGs)and stress/temperature/light sensors.The open cir-cuit voltage(V_(oc))and the density of short circuit current(I_(sc))of the PENG based on the PVDF/5 wt%6H-SiC composite fiber films reach 28.94 V and 0.24μA cm^(-2),showing a significant improvement of 240%and 300%compared with that based on the pure PVDF films.The effect of 6H-SiC nanoparticles(NPs)on inducing interfacial polarization and stress concentration in composite fiber films is proved by first-principles calculation and finite element analysis.The stress/temperature/light sensors based on the composite fiber film also show high sensitivity to the corresponding stimuli.This study shows that the PVDF/6H-SiC composite fiber film is a promising candidate for assembling high-performance energy harvesters and diverse sensors. 展开更多
关键词 6H-SIC PVDF Multifunctional composite fiber film Energy harvester Stress/temperature/light sensor
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Textured CsPbI_(3) nanorods composite fibers for stable high output piezoelectric energy harvester
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作者 Tao Yang Dengzhou Jia +8 位作者 Bing Xu Yongfei Hao Yanglong hou Kang Wang Enhui Wang Zhentao Du Sheng Cao Kuo-Chih Chou xinmei hou 《eScience》 2024年第5期150-159,共10页
The utilization of piezoelectric nanogenerator(PENG)based on halide perovskite materials has demonstrated significant promise for energy harvesting applications.However,the challenge of synthesizing halide perovskite ... The utilization of piezoelectric nanogenerator(PENG)based on halide perovskite materials has demonstrated significant promise for energy harvesting applications.However,the challenge of synthesizing halide perovskite materials with both high output performance and stability using a straightforward process persists as a substantial obstacle.Herein,we present the fabrication of CsPbI_(3) nanorods(NRs)exhibiting highly uniform orientation within polyvinylidene fluoride(PVDF)fibers through a simple texture engineering approach,marking the instance of enhancing PENG performance in this manner.The resultant composite fibers showcase a short-circuit current density(I_(sc))of 0.78μAcm^(-2) and an open-circuit voltage(V_(oc)) of 81V,representing a 2.5 fold increase compared to the previously reported highest value achieved without the electric poling process.This outstanding output performance is ascribed to the orientation of CsPbI_(3) NRs facilitated by texture engineering and dipole poling via the self-polarization effect.Additionally,the PENG exhibits exceptional thermal and water stability,rendering it suitable for deployment in diverse and challenging environmental conditions.Our findings underscore the significant potential of textured CsPbI_(3) NRs composite fibers for powering low-power consumer electronics,including commercial LEDs and electronic watches. 展开更多
关键词 Texture engineering CsPbI_(3) Piezoelectric nanogenerator SELF-POLARIZATION ELECTROSPINNING
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A machine learning-based crystal graph network and its application in development of functional materials
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作者 Gang Xu You Xue +2 位作者 Xiaoxiao Geng xinmei hou Jinwu Xu 《Materials Genome Engineering Advances》 2024年第3期107-116,共10页
An active area of MGI(Materials Genome Initiative)/MGE(Materials Genome Engineering)is to accelerate the development of new materials by means of active learning and“digital trial-error”using a prediction model of m... An active area of MGI(Materials Genome Initiative)/MGE(Materials Genome Engineering)is to accelerate the development of new materials by means of active learning and“digital trial-error”using a prediction model of material property.Machine learning methods have widely been employed for predicting crystalline materials properties with crystal graph neural networks(CGNN).The prediction accuracy of the state-of-the-art(SOTA)CGNN models based on big models and big data is generally higher.However,for the development of some classes of materials,the datasets obtained by experiments are usually lacking due to costly experiments and measurement costs.The lack of datasets will impact the accuracy of CGNN models and may result in overfitting during training models.This paper proposes a simplified crystal graph convolutional neural network(S-CGCNN)which possesses higher prediction accuracy while reducing the vast amount of train datasets and computation costs.The S-CGCNN model has successfully predicted properties of crystalline materials,such as piezoelectric materials and dielectric materials,and increased the prediction accuracy up to 12%-20%than existing SOTA CGNN models.Furthermore,the distribution map between properties and compositions of materials has been built to screen the latent space of candidate materials efficiently by principal component analysis. 展开更多
关键词 crystal graph neural network crystalline materials functional material machine learning
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Physical and mechanical properties of hot-press sintering ternary CM_2A_8(CaMg_2Al_(16)O_(27))and C_2M_2A_(14)(Ca_2Mg_2Al_(28)O_(46))ceramics 被引量:7
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作者 Bin LI Guangqi LI +3 位作者 Haiyang CHEN Junhong CHEN xinmei hou Yong LI 《Journal of Advanced Ceramics》 SCIE CSCD 2018年第3期229-236,共8页
The new ternary CM_2A_8(CaMg_2Al_(16)O_(27))and C_2M_2A_(14)(Ca_2Mg_2Al_(28)O_(46))pure and dense ceramics were first prepared by a hot-press sintering technique,and their physical and mechanical properties were inves... The new ternary CM_2A_8(CaMg_2Al_(16)O_(27))and C_2M_2A_(14)(Ca_2Mg_2Al_(28)O_(46))pure and dense ceramics were first prepared by a hot-press sintering technique,and their physical and mechanical properties were investigated.The purity of obtained CM_2A_8 and C_2M_2A_(14) ceramics reaches 98.1 wt%and 97.5 wt%,respectively.Their microstructure is dense with few observable pores,and their grain size is about a few dozen microns.For their physical properties,the average apparent porosity of CM_2A_8 and C_2M_2A_(14) ceramics is 0.18% and 0.13%,and their average bulk density is 3.66 g/cm^3 and 3.71 g/cm^3,respectively.The relative density of CM_2A_8 ceramic is 98.12%and that of C_2M_2A_(14)ceramic is 98.67%.The thermal expansivity(50–1400℃)of CM_2A_8 and C_2M_2A_(14) ceramics is 9.24×10^(–6)K^(–1) and 8.92×10^(–6)K^(–1),respectively.The thermal conductivity of CM_2A_8 and C_2M_2A_(14) ceramic is 21.32 W/(m·K)and 23.25 W/(m·K)at 25℃and 18.76 W/(m·K)and 19.42 W/(m·K)as temperature rises to 350℃,respectively.In addition,the mechanical properties are also achieved.For CM_2A_8 ceramic,the flexural strength is 248 MPa,the fracture toughness is 2.17 MPa·m^(1/2),and the Vickers hardness is 12.26 GPa.For C_2M_2A_(14) ceramic,the flexural strength is 262 MPa,the fracture toughness is 2.23 MPa·m^(1/2),and the Vickers hardness is 12.95 GPa. 展开更多
关键词 hot-press SINTERING CM2A8 C2M2A14 physical PROPERTIES mechanical PROPERTIES
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Xenotime-type high-entropy(Dy_(1/7)Ho_(1/7)Er_(1/7)Tm_(1/7)Yb_(1/7)Lu_(1/7)Y_(1/7))PO_(4):A promising thermal/environmental barrier coating material for SiCf/SiC ceramic matrix composites 被引量:4
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作者 Peixiong Zhang Xingjun Duan +5 位作者 Xiaochang Xie Donghai Ding Tao Yang xinmei hou Yunsong Zhao Enhui Wang 《Journal of Advanced Ceramics》 SCIE EI CAS CSCD 2023年第5期1033-1045,共13页
Rare-earth phosphates(REPO4)are regarded as one of the promising thermal/environmental barrier coating(T/EBC)materials for SiCf/SiC ceramic matrix composites(SiC-CMCs)owing to their excellent resistance to water vapor... Rare-earth phosphates(REPO4)are regarded as one of the promising thermal/environmental barrier coating(T/EBC)materials for SiCf/SiC ceramic matrix composites(SiC-CMCs)owing to their excellent resistance to water vapor and CaO–MgO–Al_(2)O_(3)–SiO_(2)(CMAS).Nevertheless,a relatively high thermal conductivity(κ)of the REPO_(4) becomes the bottleneck for their practical applications.In this work,novel xenotime-type high-entropy(Dy_(1/7)Ho_(1/7)Er_(1/7)Tm_(1/7)Yb_(1/7)Lu_(1/7)Y_(1/7))PO4(HE(7RE_(1/7))PO_(4))has been designed and synthesized for the first time to solve this issue.HE(7RE_(1/7))PO_(4) with a homogeneous rare-earth element distribution exhibits high thermal stability up to 1750℃and good chemical compatibility with SiO_(2) up to 1400℃.In addition,the thermal expansion coefficient(TEC)of HE(7RE_(1/7))PO_(4)(5.96×10^(−6)℃^(−1) from room temperature(RT)to 900℃)is close to that of the SiC-CMCs.What is more,the thermal conductivities of HE(7RE_(1/7))PO_(4)(from 4.38 W·m^(−1)·K^(−1) at 100℃to 2.25 W·m^(−1)·K^(−1) at 1300℃)are significantly decreased compared to those of single-component REPO4 with the minimum value ranging from 9.90 to 4.76 W·m^(−1)·K^(−1).These results suggest that HE(7RE_(1/7))PO_(4) has the potential to be applied as the T/EBC materials for the SiC-CMCs in the future. 展开更多
关键词 high-entropy ceramics(HECs) (Dy_(1/7)Ho_(1/7)Er_(1/7)Tm_(1/7)Yb_(1/7))PO_(4)((7RE_(1/7))PO_(4)) thermal/environmental barrier coatings(T/EBCs) thermal expansion coefficient(TEC) thermal conductivity(κ)
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In situ reduced MXene/AuNPs composite toward enhanced charging/discharging and specific capacitance 被引量:4
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作者 Zixiang ZHENG Wei WU +5 位作者 Tao YANG Enhui WANG Zhentao DU xinmei hou Tongxiang LIANG Hailong WANG 《Journal of Advanced Ceramics》 SCIE CAS CSCD 2021年第5期1061-1071,共11页
In this work,gold nanoparticles(AuNPs)decorated Ti_(3)C_(2)T_(x) nanosheets(MXene/AuNPs composite)are fabricated through a self-reduction reaction of Ti_(3)C_(2)T_(x) nanosheets with HAuCl_(4) aqueous solution.The obt... In this work,gold nanoparticles(AuNPs)decorated Ti_(3)C_(2)T_(x) nanosheets(MXene/AuNPs composite)are fabricated through a self-reduction reaction of Ti_(3)C_(2)T_(x) nanosheets with HAuCl_(4) aqueous solution.The obtained composite is characterized as AuNPs with the diameter of about 23 nm uniformly dispersing on nanosheets without aggregation.The composite(MXene decorated on 4.8 wt% AuNPs)is further employed to construct supercapacitor for the first time with a higher specific capacitance of 278 F·g^(-1) at 5 mV·s^(-1) than that of pure Ti_(3)C_(2)T_(x) and 95% of cyclic stability after 10,000 cycles.Furthermore,MXene/AuNPs composite symmetric supercapacitor with filter paper as separator and H_(2)SO_(4) as electrolyte,is assembled.The supercapacitor exhibits a high volumetric energy density of 8.82 Wh·L^(-1) at a power density of 264.6 W·L^(-1) and ultrafast-charging/discharging performance.It exhibits as a promising candidate applied in integrated and flexible supercapacitors. 展开更多
关键词 SUPERCAPACITORS MXene gold nanoparticles(AuNPs) self-reduction COMPOSITE
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Maximizing the mechanical performance of Ti_(3)AlC_(2)-based MAX phases with aid of machine learning 被引量:4
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作者 Xingjun DUAN Zhi FANG +5 位作者 Tao YANG Chunyu GUO Zhongkang HAN Debalaya SARKER xinmei hou Enhui WANG 《Journal of Advanced Ceramics》 SCIE EI CAS CSCD 2022年第8期1307-1318,共12页
Mechanical properties consisting of the bulk modulus,shear modulus,Young’s modulus,Poisson’s ratio,etc.,are key factors in determining the practical applications of MAX phases.These mechanical properties are mainly ... Mechanical properties consisting of the bulk modulus,shear modulus,Young’s modulus,Poisson’s ratio,etc.,are key factors in determining the practical applications of MAX phases.These mechanical properties are mainly dependent on the strength of M–X and M–A bonds.In this study,a novel strategy based on the crystal graph convolution neural network(CGCNN)model has been successfully employed to tune these mechanical properties of Ti_(3)AlC_(2)-based MAX phases via the A-site substitution(Ti_(3)(Al1-xAx)C_(2)).The structure–property correlation between the A-site substitution and mechanical properties of Ti_(3)(Al1-xAx)C_(2)is established.The results show that the thermodynamic stability of Ti_(3)(Al1-xAx)C_(2)is enhanced with substitutions A=Ga,Si,Sn,Ge,Te,As,or Sb.The stiffness of Ti_(3)AlC_(2)increases with the substitution concentration of Si or As increasing,and the higher thermal shock resistance is closely associated with the substitution of Sn or Te.In addition,the plasticity of Ti_(3)AlC_(2)can be greatly improved when As,Sn,or Ge is used as a substitution.The findings and understandings demonstrated herein can provide universal guidance for the individual synthesis of high-performance MAX phases for various applications. 展开更多
关键词 Ti_(3)(Al1−xAx)C_(2) crystal graph convolution neural network(CGCNN)model stability mechanical properties
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Synthesis of Al_(4)SiC_(4) powders via carbothermic reduction: Reaction and grain growth mechanisms 被引量:4
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作者 Xinming XING Junhong CHEN +3 位作者 Guoping BEI Bin LI Kuo-Chih Chou xinmei hou 《Journal of Advanced Ceramics》 SCIE CAS CSCD 2017年第4期351-359,共9页
Highly pure Al_(4)SiC_(4) powders were prepared by carbothermic reduction at 2173 K using Al_(2)O_(3),SiO_(2),and graphite as raw materials.The obtained Al_(4)SiC_(4) powders owned hexagonal plate-like grains with a d... Highly pure Al_(4)SiC_(4) powders were prepared by carbothermic reduction at 2173 K using Al_(2)O_(3),SiO_(2),and graphite as raw materials.The obtained Al_(4)SiC_(4) powders owned hexagonal plate-like grains with a diameter of about 200-300μm and a thickness of about 2-6μm.Based on the experimental results,the reaction of Al_(4)SiC_(4) formation and grain evolution mechanisms were determined from thermodynamic and first-principles calculations.The results indicated that the synthesis of Al_(4)SiC_(4) by the carbothermic reduction consisted of two parts,i.e.,solid-solid reactions initially followed by complex gas-solid and gas-gas reactions.The grain growth mechanism of Al_(4)SiC_(4) featured a two-dimensional nucleation and growth mechanism.The gas phases formed during the sintering process favored the preferential grain growth of(0010)and(110)planes resulting in formation of hexagonal plate-like Al_(4)SiC_(4) grains. 展开更多
关键词 Al_(4)SiC_(4) carbothermic reduction hexagonal plate-like growth mechanism
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Facile fabrication of three-dimensional interconnected nanoporous N-TiO_2 for efficient photoelectrochemical water splitting 被引量:4
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作者 Yingzhi Chen Aoxiang Li +3 位作者 Qun Li xinmei hou Lu-Ning Wang Zheng-Hong Huang 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2018年第6期955-960,共6页
Three-dimensional (3D) interconnected porous architectures are expected to perform well in photoelectrochemical (PEC) water splitting due to their high specific surface area as well as favourable porous properties... Three-dimensional (3D) interconnected porous architectures are expected to perform well in photoelectrochemical (PEC) water splitting due to their high specific surface area as well as favourable porous properties and interconnections. In this work, we demonstrated the facile fabrication of 3D interconnected nanoporous N-doped TiO2 (N-TiO2 network) by annealing the anodized 3D interconnected nanoporous TiO2 (TiO2 network) in ammonia atmosphere. The obtained N-TiO2 network exhibited broadened light absorption, and abundant, interconnected pores for improving charge separation, which was supported by the reduced charge transfer resistance. With these merits, a remarkably high photocurrent density at 1.23 V vs. reversible hydrogen electrode (RHE) was realized for the N-TiO2 network without any co-catalysts or sacrificial reagents, and the photostability can be assured after long term illumination. In view of its simplicity and efficiency, this structure promises for perspective PEC applications. 展开更多
关键词 3D interconnected nanoporous N-TiO2 N-TiO2 nanotube arrays Anodization Photoelectrochemical water splitting
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Construction of layered h-BN/TiO2 hetero-structure and probing of the synergetic photocatalytic effect 被引量:3
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作者 Qun Li xinmei hou +5 位作者 Zhi Fang Tao Yang Junhong Chen Xiangzhi Cui Tongxiang Liang Jianlin Shi 《Science China Materials》 SCIE EI CSCD 2020年第2期276-287,共12页
A novel layered hexagonal boron nitride/titanium dioxide(h-BN/TiO2) composite photocatalyst has been constructed by anchoring TiO2 nanoflakes on the surface of hBN flakes via a solvothermal method. The morphology and ... A novel layered hexagonal boron nitride/titanium dioxide(h-BN/TiO2) composite photocatalyst has been constructed by anchoring TiO2 nanoflakes on the surface of hBN flakes via a solvothermal method. The morphology and dispersion of TiO2 can be tuned by controlling the amount of flake h-BN. Benefiting from the unique hetero-structure, the photocatalytic performance of the obtained composite toward rhodamine B(Rh B) degradation is greatly enhanced, among which 12 wt% h-BN/TiO2 composites show 3.5 and 6.9 times higher degradation rate than the synthesized TiO2 and commercial TiO2(P25), respectively, and an excellent cycling stability has also been obtained. Moreover, the first-principles calculation reveals the synergetic catalytic effect between TiO2 and h-BN flake, which is found to be responsible for the significantly enhanced photocatalytic performance of h-BN/TiO2 composites. 展开更多
关键词 layered nanostructure h-BN flake TiO2 nanoflake photocatalytic activity dye degradation
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Effect of Sn doping concentration on the oxidation of Al-containing MAX phase(Ti_(3)AlC_(2))combining simulation with experiment 被引量:2
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作者 Chunyu Guo Enhui Wang +3 位作者 Yunsong Liu Yapeng Zheng Tao Yang xinmei hou 《Fundamental Research》 CAS 2022年第1期114-122,共9页
Sn doping is usually adopted to prepare Ti_(3)AlC_(2)in mass production because it can reduce the synthesis temperature while increasing the phase purity.However,excessive Sn doping usually deteriorates the oxidation ... Sn doping is usually adopted to prepare Ti_(3)AlC_(2)in mass production because it can reduce the synthesis temperature while increasing the phase purity.However,excessive Sn doping usually deteriorates the oxidation resistance of Ti_(3)AlC_(2).Therefore,an appropriate Sn doping concentration is a vital issue.In this work,the effect of Sn doping concentration on the oxidation behavior of Ti_(3)AlC_(2)was systematically investigated by combining theoretical calculations and experimental methods.Density function theory calculations suggest that the oxygen adsorption mechanisms for the(001)surface of Ti_(3)AlC_(2)with and without Sn doping are similar,and Ti-O bonds are always preferentially formed.The molecular dynamics simulation further indicates that Al atoms have a faster diffusion rate during the oxidation process.Therefore,a continuous Al_(2)O_(3)layer can form rapidly at high temperature.Nevertheless,when the Sn doping concentration exceeds 10 mol%,the continuity of the Al_(2)O_(3)layer is destroyed,thereby impairing the oxidation resistance of Ti_(3)AlC_(2).Furthermore,oxidation experiments verify the above results.The oxidation mechanisms of Ti3AlC2 with different Sn doping concentrations are also proposed. 展开更多
关键词 MAX phase Sn doping Density function theory Molecular dynamics Oxidation resistance
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Mild fabrication of SiC/C nanosheets with prolonged cycling stability as supercapacitor 被引量:1
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作者 Shuang Liu Enhui Wang +4 位作者 Shichun Liu Chunyu Guo Hailong Wang Tao Yang xinmei hou 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2022年第15期178-186,共9页
A facile and mild route to synthesize C-coated SiC nanosheets(SiC/C NSs)via wet-chemical etching in hydrofluoric acid(HF)at 60°C for 48 h using carbon aluminum silicate(Al_(4)SiC_(4))as raw materials is reported ... A facile and mild route to synthesize C-coated SiC nanosheets(SiC/C NSs)via wet-chemical etching in hydrofluoric acid(HF)at 60°C for 48 h using carbon aluminum silicate(Al_(4)SiC_(4))as raw materials is reported for the first time.HF molecule leads to the breaking of C-Al bonds in Al_(4)SiC_(4),which eventually results in the formation of two-dimensional SiC nanosheets.A carbon layer with a thickness of approximately 1.5 nm is formed on the surface of SiC nanosheets due to the excess carbon.The prepared SiC/C NSs possess a smooth and rectangular sheet with a mean 150 nm in width,500 nm in length and10 nm in thickness,respectively.The crystallographic characterization indicates that 3C-SiC and 2H-SiC coexist and the parallel plane relationship of 3C/2H-SiC heterojunction is(111)_(3C-SiC)//(001)_(2H-SiC).Due to the formed 3C-SiC/2H-SiC heterojunction and graphitic carbon,the fabricated electrode based on SiC/C NSs exhibits prolonged cycling stability and high specific areal capacitance as a promising supercapacitor candidate.It remains 91.2%retention even after 20,000 cycles and 734μF/cm^(2)at a scan rate of 10 m V/s. 展开更多
关键词 SiC/C nanosheets Al_(4)SiC_(4) Etching SUPERCAPACITORS Stability
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Spin-Modulated Oxygen Electrocatalysis 被引量:3
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作者 Zhi Fang Wanting Zhao +4 位作者 Tong Shen Daping Qiu Yucheng Lv xinmei hou Yanglong hou 《Precision Chemistry》 2023年第7期395-417,共23页
The electrocatalysis reactions involving oxygen,such as oxygen evolution reaction(OER)and oxygen reduction reaction(ORR),play a critical role in energy storage/conversion applications,e.g.,fuel cells,metal-air batteri... The electrocatalysis reactions involving oxygen,such as oxygen evolution reaction(OER)and oxygen reduction reaction(ORR),play a critical role in energy storage/conversion applications,e.g.,fuel cells,metal-air batteries,and electrochemical water splitting.The high kinetic energy barrier of the OER/ORR is highly associated with the spin state interconversion between singlet OH^(−)/H_(2)O and triplet O_(2),which is influenced by the spin state and magnetism of catalysts.This Review summarizes recent progress and advances in understanding spin/magnetism-related effects in oxygen electrocatalysis to develop spin theory.It is demonstrated that the spin states(low,intermediate,and high spin)of magnetic transition metal catalysts(TMCs)can directly affect the reaction barriers of OER/ORR by tailoring the bonding of oxygen intermediates with TMCs.Besides,the spin states of TMCs can build a spin-selective channel to filter the electron spins required for the single/triplet interconversion of O species during OER/ORR.In this Review,we introduced many approaches to modulating spin state,for instance,altering the crystal field,oxidation state of active-site ions,and the morphology of TMCs.What’s more,a magnetic field can drive the spin flip of magnetic ions to achieve the spin alignment(↑↑)(i.e.,facilitating spin polarization),which will strengthen the spin selectivity for accelerating the filtration and transfer of the spins with the same direction for the generation and conversion of triplet ↑O=O↑.Importantly,the origin of magnetic field enhancement on OER/ORR are deeply discussed,which provides a great vision for the magnetism-assisted catalysis.Finally,the challenges and perspectives for future development of spin/magnetism catalysis are presented.This Review is expected to highlight the significance of spin/magnetism theory in breaking the bottleneck of electrocatalysis field and promote the development of high-efficientcy electrocatalysts for practical applications. 展开更多
关键词 Oxygen electrocatalysis Magnetic transition metal catalyst Spin modulation Magnetic field Spin polarization Spin selectivity
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