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Review:Multiple Functionalities of Aqueous Zinc-Ion Batteries 被引量:1
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作者 Sheng Zhu Jiangfeng Ni 《Journal of Harbin Institute of Technology(New Series)》 CAS 2022年第6期101-110,共10页
Aqueous zinc-ion batteries are a kind of attractive power supply devices due to their high energy, environmental benignity, and intrinsic safety. In recent years, tremendous enthusiasm has been devoted to the function... Aqueous zinc-ion batteries are a kind of attractive power supply devices due to their high energy, environmental benignity, and intrinsic safety. In recent years, tremendous enthusiasm has been devoted to the functionalities of aqueous zinc-ion batteries, aiming to extend their potential applications in multiple dimensions and multiple scales. Here, the latest advances in the design, construction, and performance evaluation of aqueous zinc-ion batteries are summarized. The focus is on various functionalities such as flexibility, self-healing, self-charging, and miniaturization. We also highlight the materials and structures that have been engineered to realize these functionalities. Finally, we offer some general insights into the challenges and chances in such exciting field. 展开更多
关键词 zinc-ion battery multiple functionalities FLEXIBILITY SELF-HEALING self-charging integration
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Role of sorbent surface functionalities and microporosity in 2,2′,4,4′-tetrabromodiphenyl ether sorption onto biochars 被引量:6
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作者 Jia Xin Ruilong Liu +3 位作者 Hubo Fan Meilan Wang Miao Li Xiang Liu 《Journal of Environmental Sciences》 SCIE EI CAS CSCD 2013年第7期1368-1378,共11页
The study provides insight into the combined effect of sorbent surface functionalities and microporosity on2,2 ′,4,4 ′-tetrabromodiphenyl ether (BDE-47) sorption onto biochars. A series of biochars prepared underd... The study provides insight into the combined effect of sorbent surface functionalities and microporosity on2,2 ′,4,4 ′-tetrabromodiphenyl ether (BDE-47) sorption onto biochars. A series of biochars prepared underdifferent conditionswere used to test their sorption behaviorswith BDE-47. The extents of sorption behaviorswere parameterized in terms of the single-point adsorption equilibrium constant (Koc ) at three equilibrium concentration (C e ) levels (0.001Sw (solubility), 0.005Sw , and 0.05Sw )whichwasdetermined using the Freundlich model. To elucidate the concentration-dependentdominant mechanisms for BDE-47 sorption onto biochars, K ocwas correlatedwith four major parameters using multiple parameter linear analysis accompaniedwith significance testing. The results indicated that at low concentration (Ce = 0.001Sw ), the surface microporosity term,which represented a pore-filling mechanism, contributed significantly to this relationship,while as concentrationwas increased to higher levels, surface functionality related to surface adsorption began to take thedominant role,whichwas further confirmed by the results of Polanyi-based modeling. Given the above results, adual mode model based on Dubinin-Radushkevich andde Boer-Zwikker equationswas adopted to quantitatively assess the changes of significance of surface adsorption aswell as that of pore fillingwith sorption processdevelopment. In addition, UV spectra of four typical aromatic compoundswhich represented the key structural fragments of biochars before and after interactionswith BDE-47were analyzed todetermine the active functional groups and supply complementary evidence for thedominant interaction force for surface adsorption, based onwhich π-π electron-donor-acceptor interactionwas proposed to contribute greatly to surface adsorption. 展开更多
关键词 biochar polybrominateddiphenyl ethers (PBDEs) SORPTION surface functionality MICROPOROSITY
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Laser surface functionalization to achieve extreme surface wetting conditions and resultant surface functionalities 被引量:6
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作者 WANG Qing-hua WANG Hui-xin 《Journal of Central South University》 SCIE EI CAS CSCD 2022年第10期3217-3247,共31页
Wetting condition of micro/nanostructured surface has received tremendous attention due to the potential applications in commercial,industrial,and military areas.Surfaces with extreme wetting properties,e.g.,superhydr... Wetting condition of micro/nanostructured surface has received tremendous attention due to the potential applications in commercial,industrial,and military areas.Surfaces with extreme wetting properties,e.g.,superhydrophobic or superhydrophilic,are extensively employed due to their superior anti-icing,drag reduction,enhanced boiling heat transfer,self-cleaning,and anti-bacterial properties depending on solid-liquid interfacial interactions.Laser-based techniques have gained popularity in recent years to create micro/nano-structured surface owing to their high flexibility,system precision,and ease for automation.These techniques create laser induced periodic surface structures(LIPSS)or hierarchical structures on substrate material.However,micro/nanostructures alone cannot attain the desired wettability.Subsequent modification of surface chemistry is essentially needed to achieve target extreme wettability.This review paper aims to provide a comprehensive review for both laser texturing techniques and the following chemistry modification methods.Recent research progress and fundamental mechanisms of surface structure generation via different types of lasers and various chemistry modification methods are discussed.The complex combination between the laser texturing and surface chemistry modification methods to decide the final wetting condition is presented.More importantly,surface functionalities of these surfaces with extreme wetting properties are discussed.Lastly,prospects for future research are proposed and discussed. 展开更多
关键词 laser surface modification extreme wettability chemistry modification surface functionality
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M/C_(3)N_(4)/AC(M=Au,Pt,Ru)‐catalyzed acetylene coupling with ethylene dichloride:How effective are the bifunctionalities? 被引量:1
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作者 Qing Yu Shiyi Wang +3 位作者 Mengru Wang Xiaoling Mou Ronghe Lin Yunjie Ding 《Chinese Journal of Catalysis》 SCIE EI CAS CSCD 2022年第3期820-831,共12页
Acetylene coupling with ethylene dichloride,which uses both coal and oil resources,is attractive for sustainable PVC manufacturing.Herein,highly active and stable carbon nitride‐based catalysts were developed by a no... Acetylene coupling with ethylene dichloride,which uses both coal and oil resources,is attractive for sustainable PVC manufacturing.Herein,highly active and stable carbon nitride‐based catalysts were developed by a novel pre‐oxidation‐pyrolysis process,affording unprecedented dehydrochlorination activity with good durability.The best‐performing system was further modified with different precious metals(Au,Pt,and Ru)to promote the hydrochlorination chemistry between the in‐situ formed hydrogen chloride and acetylene co‐feed.The presence of metal centers intensifies the hydrochlorination activity but weakens the dehydrochlorination ability due to competitive adsorption between the two reactants at the metal sites.Superior coupling performance was achieved over C_(3)N_(4)/AC and single‐atom Au/C_(3)N_(4)/AC catalysts in cascade reactors.Our results strongly suggest that dehydrochlorination is an essential step in the coupling reaction,and the activation of acetylene and ethylene dichloride molecules requires different active sites that should be engineered in future work. 展开更多
关键词 Acetylene hydrochlorination Bi‐functional catalyst DEHYDROCHLORINATION Ethylene dichloride Vinyl chloride
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Assessment and distinction of commercial soy protein isolate product functionalities using viscosity characteristic curves 被引量:1
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作者 Jing Ting Xu He Liu +1 位作者 Jian Hua Ren Shun Tang Guo 《Chinese Chemical Letters》 SCIE CAS CSCD 2012年第9期1051-1054,共4页
To simplify the assessment method of soy protein isolate (SPI) functionalities, the viscosity and functionalities of commercial SPI products were studied. Viscosity value (y) increases With increasing concentrati... To simplify the assessment method of soy protein isolate (SPI) functionalities, the viscosity and functionalities of commercial SPI products were studied. Viscosity value (y) increases With increasing concentration (x) and exhibits a highly significant correlation with the exponential equation y = a. ebx. The b values of products are gradually enhanced from dispersion, emulsion and injected to gel type. Products with low b values (〈0.2), and high dispersivity were dispersion-type. Products having high b values (〉0.4) and gel springiness were gel-type. The other products with centered b value (0.2-0.4), high solubility and emulsifying capacity were emulsion-type. 展开更多
关键词 Soy protein isolate Functional properties Viscosity curve
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Field Application of the Mycorrhizal Fungus <i>Rhizophagus irregularis</i>Increases the Yield of Wheat Crop and Affects Soil Microbial Functionalities 被引量:1
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作者 Sanaa Wahbi Yves Prin +5 位作者 Tasnime Maghraoui Hervé Sanguin Jean Thioulouse Khalid Oufdou Mohamed Hafidi Robin Duponnois 《American Journal of Plant Sciences》 2015年第19期3205-3215,共11页
The aim of this study was to test the impact of Rhizophagus irregularis, an arbuscular mycorrhizal fungus (AMF), on durum wheat growth and soil microbial functionalities in a field inoculation trial conducted in Moroc... The aim of this study was to test the impact of Rhizophagus irregularis, an arbuscular mycorrhizal fungus (AMF), on durum wheat growth and soil microbial functionalities in a field inoculation trial conducted in Morocco. The results showed that i) the R. irregularis inoculum effectively improved wheat growth, ii) wheat growth promotion depended on the soil mycorrhizal infectivity and iii) functional abilities of soil microflora depended on AMF inoculation. This study confirms that field AMF inoculation can be proposed as an effective agronomic practice in wheat production and as a sustainable cultural practice to manage soil biofunctioning. To fully promote inoculation practices, a better knowledge of AMF ecology has to be acquired to better adapt AMF inoculation to environmental conditions, and thus warrant better yields and agricultural sustainability. 展开更多
关键词 ARBUSCULAR MYCORRHIZAL Fungi Field-Grown WHEAT MYCORRHIZAL FIELD Inoculation Nutrient Uptake Microbial Soil Functions
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Understanding the defect chemistry of oxide nanoparticles for creating new functionalities:A critical review 被引量:3
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作者 LI GuangShe LI LiPing ZHENG Jing 《Science China Chemistry》 SCIE EI CAS 2011年第6期876-886,共11页
This work presents a critical review on the studies of defect chemistry of oxide nanoparticles for creating new functionalities pertinent to energy applications including dilute-magnetic semiconductors,giant-dielectri... This work presents a critical review on the studies of defect chemistry of oxide nanoparticles for creating new functionalities pertinent to energy applications including dilute-magnetic semiconductors,giant-dielectrics,or white light generation.Emphasis is placed on the relationships between the internal structure and defective surfaces of oxide nanoparticles and their synergy in tailoring the materials properties.This review is arranged in a sequence:(1)structural fundamentals of bulk oxides,using TiO2 as a model simple oxide to highlight the importance of polymorphs in tuning the electronic structures;(2)structural features of simple oxide nanoparticles distinct from the bulk,which show that nanoparticles can be considered as a special solid under the compression as originated from the surface defect dipole-dipole interactions;and(3)new functions achieved through extending the defect chemistry concept to the assembled architectures or multi-component oxide nanoparticles,in which defect surfaces enable the localized electrons or intermediate levels to produce giant dielectric performance or tunable light generation.It is concluded that understandings of defect chemistry provide diverse possibilities to manipulate electrons in oxide nanoparticles for functionalities in energy-relevant applications. 展开更多
关键词 NANOPARTICLES defect chemistry SURFACES functionalities
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Microglia overexpressing brain-derived neurotrophic factor promote vascular repair and functional recovery in mice after spinal cord injury 被引量:2
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作者 Fanzhuo Zeng Yuxin Li +6 位作者 Xiaoyu Li Xinyang Gu Yue Cao Shuai Cheng He Tian Rongcheng Mei Xifan Mei 《Neural Regeneration Research》 2026年第1期365-376,共12页
Spinal cord injury represents a severe form of central nervous system trauma for which effective treatments remain limited.Microglia is the resident immune cells of the central nervous system,play a critical role in s... Spinal cord injury represents a severe form of central nervous system trauma for which effective treatments remain limited.Microglia is the resident immune cells of the central nervous system,play a critical role in spinal cord injury.Previous studies have shown that microglia can promote neuronal survival by phagocytosing dead cells and debris and by releasing neuroprotective and anti-inflammatory factors.However,excessive activation of microglia can lead to persistent inflammation and contribute to the formation of glial scars,which hinder axonal regeneration.Despite this,the precise role and mechanisms of microglia during the acute phase of spinal cord injury remain controversial and poorly understood.To elucidate the role of microglia in spinal cord injury,we employed the colony-stimulating factor 1 receptor inhibitor PLX5622 to deplete microglia.We observed that sustained depletion of microglia resulted in an expansion of the lesion area,downregulation of brain-derived neurotrophic factor,and impaired functional recovery after spinal cord injury.Next,we generated a transgenic mouse line with conditional overexpression of brain-derived neurotrophic factor specifically in microglia.We found that brain-derived neurotrophic factor overexpression in microglia increased angiogenesis and blood flow following spinal cord injury and facilitated the recovery of hindlimb motor function.Additionally,brain-derived neurotrophic factor overexpression in microglia reduced inflammation and neuronal apoptosis during the acute phase of spinal cord injury.Furthermore,through using specific transgenic mouse lines,TMEM119,and the colony-stimulating factor 1 receptor inhibitor PLX73086,we demonstrated that the neuroprotective effects were predominantly due to brain-derived neurotrophic factor overexpression in microglia rather than macrophages.In conclusion,our findings suggest the critical role of microglia in the formation of protective glial scars.Depleting microglia is detrimental to recovery of spinal cord injury,whereas targeting brain-derived neurotrophic factor overexpression in microglia represents a promising and novel therapeutic strategy to enhance motor function recovery in patients with spinal cord injury. 展开更多
关键词 ANGIOGENESIS apoptosis brain-derived neurotrophic factor colony stimulating factor 1 receptor inflammation MICROGLIA motor function spinal cord injury vascular endothelial growth factor
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The Analysis of Gauss Radial Basis Functions and Its Application in Locating Olivine on the Moon
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作者 SONG Shicang SONG Xiaoyuan SONG Shuhan 《应用数学》 北大核心 2026年第1期173-181,共9页
Gauss radial basis functions(GRBF)are frequently employed in data fitting and machine learning.Their linear independence property can theoretically guarantee the avoidance of data redundancy.In this paper,one of the m... Gauss radial basis functions(GRBF)are frequently employed in data fitting and machine learning.Their linear independence property can theoretically guarantee the avoidance of data redundancy.In this paper,one of the main contributions is proving this property using linear algebra instead of profound knowledge.This makes it easy to read and understand this fundamental fact.The proof of linear independence of a set of Gauss functions relies on the constructing method for one-dimensional space and on the deducing method for higher dimensions.Additionally,under the condition of preserving the same moments between the original function and interpolating function,both the interpolating existence and uniqueness are proven for GRBF in one-dimensional space.The final work demonstrates the application of the GRBF method to locate lunar olivine.By combining preprocessed data using GRBF with the removing envelope curve method,a program is created to find the position of lunar olivine based on spectrum data,and the numerical experiment shows that it is an effective scheme. 展开更多
关键词 Gauss function Radial basis function Machine learning Lunar olivine locating Data fitting
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Some Reciprocity Formulas for Generalized Dedekind-Rademacher Sums
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作者 HE Yuan SHI Yongguo 《数学进展》 北大核心 2026年第1期85-102,共18页
In this paper,we study the generalized Dedekind Rademacher sums considered by Hall,Wilson and Zagier.We establish a new formula for the products of two Bernoulli functions by using Parseval's formula,Hurwitz's... In this paper,we study the generalized Dedekind Rademacher sums considered by Hall,Wilson and Zagier.We establish a new formula for the products of two Bernoulli functions by using Parseval's formula,Hurwitz's formula and Lerch's functional equation.As applications of the result,some well-known reciprocity formulas are deduced as special cases. 展开更多
关键词 Bernoulli function Dedekind sum Hurwitz and Lerch zeta function reciprocity formula
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Early intelligent active assistance in walking for hemiplegic patients under suspension protection: a randomized controlled trial
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作者 Ma Shanxin Zheng Jianling +5 位作者 Cheng Jian Lin Xi Li Qiuyuan Wang Li Zeng Yangkang Song Luping 《中国组织工程研究》 北大核心 2026年第12期3075-3082,共8页
BACKGROUND:Hemiplegia,a prevalent stroke-related condition,is often studied for motor dysfunction;however,spasticity remains under-researched.Abnormal muscle tone significantly hinders hemiplegic patients’walking rec... BACKGROUND:Hemiplegia,a prevalent stroke-related condition,is often studied for motor dysfunction;however,spasticity remains under-researched.Abnormal muscle tone significantly hinders hemiplegic patients’walking recovery.OBJECTIVE:To determine whether early suspension-protected training with a personal assistant machine for stroke patients enhances walking ability and prevents muscle spasms.METHODS:Thirty-two early-stage stroke patients from Shenzhen University General Hospital and the China Rehabilitation Research Center were randomly assigned to the experimental group(n=16)and the control group(n=16).Both groups underwent 4 weeks of gait training under the suspension protection system for 30 minutes daily,5 days a week.The experimental group used the personal assistant machine during training.Three-dimensional gait analysis(using the Cortex motion capture system),Brunnstrom staging,Fugl-Meyer Assessment for lower limb motor function,Fugl-Meyer balance function,and the modified Ashworth Scale were evaluated within 1 week before the intervention and after 4 weeks of intervention.RESULTS AND CONCLUSION:After the 4-week intervention,all outcome measures showed significant changes in each group.The experimental group had a small but significant increase in the modified Ashworth Scale score(P<0.05,d=|0.15|),while the control group had a large significant increase(P<0.05,d=|1.48|).The experimental group demonstrated greater improvements in walking speed(16.5 to 38.44 cm/s,P<0.05,d=|4.01|),step frequency(46.44 to 64.94 steps/min,P<0.05,d=|2.32|),stride length(15.50 to 29.81 cm,P<0.05,d=|3.44|),and peak hip and knee flexion(d=|1.82|to|2.17|).After treatment,the experimental group showed significantly greater improvements than the control group in walking speed(38.44 vs.26.63 cm/s,P<0.05,d=|2.75|),stride length,peak hip and knee flexion(d=|1.31|to|1.45|),step frequency(64.94 vs.59.38 steps/min,P<0.05,d=|0.85|),and a reduced support phase(bilateral:24.31%vs.28.38%,P<0.05,d=|0.88|;non-paretic:66.19%vs.70.13%,P<0.05,d=|0.94|).For early hemiplegia,personal assistant machine-assisted gait training under the suspension protection system helps establish a correct gait pattern,prevents muscle spasms,and improves motor function. 展开更多
关键词 hemiplegia stroke suspension protection system personal assistant machine intelligent walking aid early rehabilitation active training walking function NEUROPLASTICITY gait analysis motor function recovery rehabilitation training balance ability
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A review of nanodiamond-based photocatalysts for solar energy conversion
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作者 Zhang Wan Cheng Xiangxiang +5 位作者 Guo Kesheng Zhang Hansong Li Lanxiao Zhao Yongbing Zhu Jiaqi Wang Yongjie 《新型炭材料(中英文)》 北大核心 2026年第1期18-43,共26页
Photocatalysis is an important technology for using solar energy to produce hydrogen,convert CO_(2) to synthetic fuels,and decrease persistent pollutant.However,conventional photocatalysts have limitations,including p... Photocatalysis is an important technology for using solar energy to produce hydrogen,convert CO_(2) to synthetic fuels,and decrease persistent pollutant.However,conventional photocatalysts have limitations,including poor spectral absorption,inefficient charge separation,and structural instability under operational stress,which demand innovative durable materials with tailored electronic properties.Nanodiamond(ND)has recently been recognized as a suitable material because of its exceptional chemical stability,superior charge carrier mobility,and possible surface functionalization.While its intrinsic wide bandgap limits its response to visible-light,different methods have been demonstrated to activate its catalytic potential.Here,several emerging strategies for improving the catalytic performance of ND-based photocatalytic systems are summarized,including surface functionalization,plasmonic hybridization,heteroatom doping,and heterostructure design.And the structure-activity relationship and design principle are proposed to improve the light harvesting,charge transport,and redox kinetics for constructing high efficiency ND-based photocatalysts used in the renewable energy and environmental industries. 展开更多
关键词 PHOTOCATALYSIS NANODIAMOND Solar fuel conversions FUNCTIONALIZATION DOPING HETEROSTRUCTURE
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Theoretical insights into the hydrogen peroxide oxidation and reduction reactions on low-index Pt surfaces
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作者 WANG Qi CHEN Lifang +1 位作者 DING Ruimin YIN Xi 《燃料化学学报(中英文)》 北大核心 2026年第1期35-45,共11页
Hydrogen peroxide(H_(2)O_(2))oxidation and reduction reactions(HPOR/HPRR)are pivotal in various innovative electrochemical energy conversion devices.A comprehensive understanding of these mechanisms is critical for ca... Hydrogen peroxide(H_(2)O_(2))oxidation and reduction reactions(HPOR/HPRR)are pivotal in various innovative electrochemical energy conversion devices.A comprehensive understanding of these mechanisms is critical for catalyst design and performance improvement in these applications.In this work,we systematically investigate the HPOR/HPRR mechanisms on low-index Pt surfaces,specifically Pt(111),Pt(100)and Pt(110),through density functional theory(DFT)calculations combined with the computational hydrogen electrode(CHE)model.For HPOR,all the low-index Pt surfaces exhibit a unified potential-determining step(PDS)involving the electrochemical oxidation of hydroperoxyl intermediates(HOO*).The binding free energy of HOO*(Δ_(GHOO*))emerges as an activity descriptor,with Pt(110)exhibiting the highest HPOR activity.The HPRR mechanism follows a chem-electrochemical(C-EC)pathway.The rate-determining step(RDS)of HPRR is either the cleavage of the HO-OH bond(chemical)or the reduction of HO(electrochemical),depending on their respective activation energies.These activation energies are functions of the HO*binding free energy,Δ_(GHO*),establishingΔ_(GHO*)as the descriptor for HPRR activity prediction.Pt(111)and Pt(100)are identified as the most active HPRR catalysts among the studied metal surfaces,although they still experience a significant overpotential.The scaling relationship betweenΔ_(GHOO*)andΔ_(GHO*)reveals a thermodynamic coupling of HPOR and HPRR,explaining their occurrence on Pt surfaces.These findings provide important insights and activity descriptors for both HPOR and HPRR,providing valuable guidance for the design of electrocatalysts in H_(2)O_(2)-related energy applications and fuel cells. 展开更多
关键词 HPOR HPRR Pt low-index surfaces density functional theory
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Post-synthetic modification strategy to construct Co-MOF composites for boosting oxygen evolution reaction activity
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作者 ZHENG Haifeng GUO Xingzhe +5 位作者 WEI Yunwei WANG Xinfang QI Huimin YAN Yuting ZHANG Jie LI Bingwen 《无机化学学报》 北大核心 2026年第1期193-202,共10页
The poor electrical conductivity of metal-organic frameworks(MOFs)limits their electrocatalytic performance in the oxygen evolution reaction(OER).In this study,a Py@Co-MOF composite material based on pyrene(Py)molecul... The poor electrical conductivity of metal-organic frameworks(MOFs)limits their electrocatalytic performance in the oxygen evolution reaction(OER).In this study,a Py@Co-MOF composite material based on pyrene(Py)molecules and{[Co2(BINDI)(DMA)_(2)]·DMA}_(n)(Co-MOF,H4BINDI=N,N'-bis(5-isophthalic acid)naphthalenediimide,DMA=N,N-dimethylacetamide)was synthesized via a one-pot method,leveragingπ-πinteractions between pyrene and Co-MOF to modulate electrical conductivity.Results demonstrate that the Py@Co-MOF catalyst exhibited significantly enhanced OER performance compared to pure Co-MOF or pyrene-based electrodes,achieving an overpotential of 246 mV at a current density of 10 mA·cm^(-2) along with excellent stability.Density functional theory(DFT)calculations reveal that the formation of O*in the second step is the rate-determining step(RDS)during the OER process on Co-MOF,with an energy barrier of 0.85 eV due to the weak adsorption affinity of the OH*intermediate for Co sites.CCDC:2419276. 展开更多
关键词 PYRENE metal-organic frameworks composite catalyst oxygen evolution reaction density functional theory
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A review of the surface activation and modification of biochars
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作者 Zhang Yihan Chen Longyi 《新型炭材料(中英文)》 北大核心 2026年第1期67-90,共24页
Biomass-derived carbon materials are favored for their abundance and sustainability,and ease of preparation and modification.By surface activation and modification they can have a good electrical conductivity,excellen... Biomass-derived carbon materials are favored for their abundance and sustainability,and ease of preparation and modification.By surface activation and modification they can have a good electrical conductivity,excellent catalytic activity,a remarkable adsorption capacity,and different interfacial physicochemical functionalities.Surface-modified biochars have found wide applications in energy storage,environmental remediation,and catalysis.However,achieving precise and controllable modification of their active sites remains a challenge.Recent advances and future prospects for controlling their surface morphology,defect engineering,and surface coating strategies,with particular attention to their means of fabrication,are reviewed. 展开更多
关键词 Activation and modification Carbon material interface Surface functionalization Metal nanoparticle deposition Surface defect
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Theoretical study on the thermally activated delayed fluorescence,and efficiency roll‑off characteristics of a series of blue and blue‑green Ir(Ⅲ)complexes
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作者 QIN Zhengkun BAO Lixin +4 位作者 ZHANG Yunkai CUI Lin WANG Jinyu WANG Yuhao SONG Mingxing 《无机化学学报》 北大核心 2026年第2期365-374,共10页
A series of blue and blue‑green Ir(Ⅲ)complexes has been investigated theoretically to explore their electronic structures,photophysical properties,efficiency roll‑off effect,and thermal activation delayed fluorescenc... A series of blue and blue‑green Ir(Ⅲ)complexes has been investigated theoretically to explore their electronic structures,photophysical properties,efficiency roll‑off effect,and thermal activation delayed fluorescence(TADF)properties.All calculations were performed using density functional theory(DFT)and time‑dependent density functional theory(TDDFT).Calculations for electronic structures,frontier molecular orbital characteristics(which determine the efficiency roll‑off effect of the complexes),and photophysical properties were conducted using the Gaussian 09 software package.The calculation of spin‑orbit coupling matrix elements<T|HSOC|S>,which determine the TADF properties of the complexes,was performed using the ORCA software package.The calculation results show that the auxiliary ligand tetraphenylimidodiphosphinate(tpip),a strong electron‑withdrawing group,can mitigate the efficiency roll‑off effect of the complex.Furthermore,TADF is observed in one of the designed complexes,(F_(3)Phppy)_(2)Ir(tpip),where F_(3)Phppy=2‑[4‑(2,4,6‑trifluorophenyl)phenyl]pyridine. 展开更多
关键词 organic light‑emitting diodes Ir(Ⅲ)complex time‑dependent density functional theory thermal activation delayed fluorescence property efficiency roll‑off effect
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Are emerging electroconductive biomaterials for spinal cord injury repair the future?
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作者 Aleksandra Serafin Maurice N.Collins 《Neural Regeneration Research》 2026年第3期1140-1141,共2页
Spinal cord injury(SCI)is a debilitating ailment that leads to the loss of motor and sensory functions,often leaving the patient paralyzed below the injury site(Chen et al.,2013).Globally around 250,000-300,000 people... Spinal cord injury(SCI)is a debilitating ailment that leads to the loss of motor and sensory functions,often leaving the patient paralyzed below the injury site(Chen et al.,2013).Globally around 250,000-300,000 people are diagnosed with SCI annually(Singh et al.,2014),and while this number appears quite low,the effect that an SCI has on the patient’s quality of life is drastic,due to the current difficulties to comprehensively treat this illness.The cost of patient care can also be quite costly,amounting to an estimated$1.69 billion in healthcare costs in the USA alone(Mahabaleshwarkar and Khanna,2014). 展开更多
关键词 spinal cord injury PARALYSIS electroconductive biomaterials healthcare costs sensory functions motor functions repair spinal cord injury sci
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Using mixed kernel support vector machine to improve the predictive accuracy of genome selection
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作者 Jinbu Wang Wencheng Zong +6 位作者 Liangyu Shi Mianyan Li Jia Li Deming Ren Fuping Zhao Lixian Wang Ligang Wang 《Journal of Integrative Agriculture》 2026年第2期775-787,共13页
The advantages of genome selection(GS) in animal and plant breeding are self-evident.Traditional parametric models have disadvantage in better fit the increasingly large sequencing data and capture complex effects acc... The advantages of genome selection(GS) in animal and plant breeding are self-evident.Traditional parametric models have disadvantage in better fit the increasingly large sequencing data and capture complex effects accurately.Machine learning models have demonstrated remarkable potential in addressing these challenges.In this study,we introduced the concept of mixed kernel functions to explore the performance of support vector machine regression(SVR) in GS.Six single kernel functions(SVR_L,SVR_C,SVR_G,SVR_P,SVR_S,SVR_L) and four mixed kernel functions(SVR_GS,SVR_GP,SVR_LS,SVR_LP) were used to predict genome breeding values.The prediction accuracy,mean squared error(MSE) and mean absolute error(MAE) were used as evaluation indicators to compare with two traditional parametric models(GBLUP,BayesB) and two popular machine learning models(RF,KcRR).The results indicate that in most cases,the performance of the mixed kernel function model significantly outperforms that of GBLUP,BayesB and single kernel function.For instance,for T1 in the pig dataset,the predictive accuracy of SVR_GS is improved by 10% compared to GBLUP,and by approximately 4.4 and 18.6% compared to SVR_G and SVR_S respectively.For E1 in the wheat dataset,SVR_GS achieves 13.3% higher prediction accuracy than GBLUP.Among single kernel functions,the Laplacian and Gaussian kernel functions yield similar results,with the Gaussian kernel function performing better.The mixed kernel function notably reduces the MSE and MAE when compared to all single kernel functions.Furthermore,regarding runtime,SVR_GS and SVR_GP mixed kernel functions run approximately three times faster than GBLUP in the pig dataset,with only a slight increase in runtime compared to the single kernel function model.In summary,the mixed kernel function model of SVR demonstrates speed and accuracy competitiveness,and the model such as SVR_GS has important application potential for GS. 展开更多
关键词 genome selection machine learning support vector machine kernel function mixed kernel function
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Artificial intelligence in functional gastrointestinal disorders:From precision diagnosis to preventive healthcare
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作者 Yi-Nan Yan Jing-Qi Zeng Xia Ding 《Artificial Intelligence in Gastroenterology》 2026年第1期20-35,共16页
Functional gastrointestinal disorders(FGIDs),including irritable bowel syndrome(IBS),functional dyspepsia(FD),and gastroesophageal reflux disease(GERD),present persistent diagnostic and therapeutic challenges due to s... Functional gastrointestinal disorders(FGIDs),including irritable bowel syndrome(IBS),functional dyspepsia(FD),and gastroesophageal reflux disease(GERD),present persistent diagnostic and therapeutic challenges due to symptom heterogeneity and the absence of reliable biomarkers.Artificial intelligence(AI)enables the integration of multimodal data to enhance FGID management through precision diagnostics and preventive healthcare.This minireview summarizes recent advancements in AI applications for FGIDs,highlighting progress in diagnostic accuracy,subtype classification,personalized interventions,and preventive strategies inspired by the traditional Chinese medicine concept of“treating the undiseased”.Machine learning and deep learning algorithms have demonstrated value in improving IBS diagnosis,refining FD neuro-gastrointestinal subtyping,and screening for GERD-related complications.Moreover,AI supports dietary,psychological,and integrative medicine-based interventions to improve patient adherence and quality of life.Nonetheless,key challenges remain,including data heterogeneity,limited model interpretability,and the need for robust clinical validation.Future directions emphasize interdisciplinary collaboration,the development of multimodal and explainable AI models,and the creation of patientcentered platforms to facilitate a shift from reactive treatment to proactive prevention.This review provides a systematic framework to guide the clinical application and theoretical innovation of AI in FGIDs. 展开更多
关键词 Artificial intelligence Functional gastrointestinal disorders Irritable bowel syndrome Functional dyspepsia Gastroesophageal reflux disease
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Extra-pineal melatonin in perisynaptic Schwann cell–muscle fiber cross talk at the regenerating neuromuscular junction
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作者 Samuele Negro Cesare Montecucco Michela Rigoni 《Neural Regeneration Research》 2026年第1期300-301,共2页
The neuromuscular junction and its proregenerative niche:The mammalian peripheral nervous system,unlike the central nervous system,has preserved throughout evolution the ability to regenerate and fully restore functio... The neuromuscular junction and its proregenerative niche:The mammalian peripheral nervous system,unlike the central nervous system,has preserved throughout evolution the ability to regenerate and fully restore function.Key factors for effective nerve regeneration include a supportive neuronal environment and a coordinated tissue response(Brosius Lutz and Barres,2014). 展开更多
关键词 FUNCTION SYSTEM COORDINATED
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