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Machine learning accelerated catalysts design for CO reduction:An interpretability and transferability analysis
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作者 Yuhang Wang Yaqin Zhang +4 位作者 Ninggui Ma Jun Zhao Yu Xiong Shuang Luo Jun Fan 《Journal of Materials Science & Technology》 2025年第10期14-23,共10页
Developing machine learning frameworks with predictive power,interpretability,and transferability is crucial,yet it faces challenges in the field of electrocatalysis.To achieve this,we employed rigorous feature engine... Developing machine learning frameworks with predictive power,interpretability,and transferability is crucial,yet it faces challenges in the field of electrocatalysis.To achieve this,we employed rigorous feature engineering to establish a finely tuned gradient boosting regressor(GBR)model,which adeptly captures the physical complexity from feature space to target variables.We demonstrated that environmental electron effects and atomic number significantly govern the success of the mapping process via global and local explanations.The finely tuned GBR model exhibits exceptional robustness in predicting CO adsorption energies(R_(ave)^(2)=0.937,RMSE=0.153 eV).Moreover,the model demonstrated remarkable transfer learning ability,showing excellent predictive power for OH,NO,and N_(2) adsorption.Importantly,the GBR model exhibits exceptional predictive capability across an extensive search space,thereby demonstrating profound adaptability and versatility.Our research framework significantly enhances the interpretability and transferability of machine learning in electrocatalysis,offering vital insights for further advancements. 展开更多
关键词 Machine learning First-principles calculation INTERPRETABILITY transferability CO reduction
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Enhancing Adversarial Example Transferability via Regularized Constrained Feature Layer
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作者 Xiaoyin Yi Long Chen +2 位作者 Jiacheng Huang Ning Yu Qian Huang 《Computers, Materials & Continua》 2025年第4期157-175,共19页
Transfer-based Adversarial Attacks(TAAs)can deceive a victim model even without prior knowledge.This is achieved by leveraging the property of adversarial examples.That is,when generated from a surrogate model,they re... Transfer-based Adversarial Attacks(TAAs)can deceive a victim model even without prior knowledge.This is achieved by leveraging the property of adversarial examples.That is,when generated from a surrogate model,they retain their features if applied to other models due to their good transferability.However,adversarial examples often exhibit overfitting,as they are tailored to exploit the particular architecture and feature representation of source models.Consequently,when attempting black-box transfer attacks on different target models,their effectiveness is decreased.To solve this problem,this study proposes an approach based on a Regularized Constrained Feature Layer(RCFL).The proposed method first uses regularization constraints to attenuate the initial examples of low-frequency components.Perturbations are then added to a pre-specified layer of the source model using the back-propagation technique,in order to modify the original adversarial examples.Afterward,a regularized loss function is used to enhance the black-box transferability between different target models.The proposed method is finally tested on the ImageNet,CIFAR-100,and Stanford Car datasets with various target models,The obtained results demonstrate that it achieves a significantly higher transfer-based adversarial attack success rate compared with baseline techniques. 展开更多
关键词 Adversarial examples black-box transferability regularized constrained transfer-based adversarial attacks
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Simulation-to-reality transferability framework for operating-parameter forecasting in nuclear reactors using domain adaptation
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作者 Wei-Qing Lin Xi-Ren Miao +4 位作者 Jing Chen Ming-Xin Ye Yong Xu Hao Jiang Yan-Zhen Lu 《Nuclear Science and Techniques》 2025年第5期177-191,共15页
Artificial intelligence has potential for forecasting reactor conditions in the nuclear industry.Owing to economic and security concerns,a common method is to train data generated by simulators.However,achieving a sat... Artificial intelligence has potential for forecasting reactor conditions in the nuclear industry.Owing to economic and security concerns,a common method is to train data generated by simulators.However,achieving a satisfactory performance in practical applications is difficult because simulators imperfectly emulate reality.To bridge this gap,we propose a novel framework called simulation-to-reality domain adaptation(SRDA)for forecasting the operating parameters of nuclear reactors.The SRDA model employs a transformer-based feature extractor to capture dynamic characteristics and temporal dependencies.A parameter predictor with an improved logarithmic loss function is specifically designed to adapt to varying reactor powers.To fuse prior reactor knowledge from simulations with reality,the domain discriminator utilizes an adversarial strategy to ensure the learning of deep domain-invariant features,and the multiple kernel maximum mean discrepancy minimizes their discrepancies.Experiments on neutron fluxes and temperatures from a pressurized water reactor illustrate that the SRDA model surpasses various advanced methods in terms of predictive performance.This study is the first to use domain adaptation for real-world reactor prediction and presents a feasible solution for enhancing the transferability and generalizability of simulated data. 展开更多
关键词 Nuclear power plant(NPP) Pressurized water reactor(PWR) Domain adaptation Knowledge transfer TRANSFORMER Forecasting
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Study on the Transferability of Camellia sinensis EST-SSRs in Theaceae Plant
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作者 程小毛 陈自兰 王华 《Agricultural Science & Technology》 CAS 2011年第2期198-200,216,共4页
[Objective] The research aimed to study the transferability of Camellia sinensis EST-SSRs in Theaceae plant.[Method] Seven pairs of EST-SSRs primers which derived from Camellia sinensis EST sequence were used to ampli... [Objective] The research aimed to study the transferability of Camellia sinensis EST-SSRs in Theaceae plant.[Method] Seven pairs of EST-SSRs primers which derived from Camellia sinensis EST sequence were used to amplify the nineteen materials of Theaceae plant.[Result] Five pairs in the seven pairs of EST-SSRs primers could effectively amplify the nineteen tested varieties,and the transferability rate was 71.43%.The amplification rate of Camellia retiacalate FengShanCha,Camellia japouica CaiXia and Camellia retiacalate JuBan was the highest.The amplification rate of Camellia synaptica Sealy and Adinandra sagonica var.wallichiana(oc)Ming was the lowest.Moreover,four pairs in the five pairs of primers which could effectively amplify showed the rich polymorphism whose difference was obvious in the tested materials.[Conclusion] SSR primers which were developed from Camellia sinensis genome had the higher transferability in the different genus and species of Theaceae plant,could be used in the comparative genome research and analysis mark research of Theaceae plant. 展开更多
关键词 Camellia sinensis EST-SSR transferability Theaceae plant
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Development and Characterization of Microsatellite Markers in Brassica rapa ssp.chinensis and Transferability Among Related Species 被引量:4
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作者 CUI Xiu-min DONG Yu-xiu +3 位作者 HOU Xi-lin CHENG-Yan ZHANG Jing-yi JIN Min-feng 《Agricultural Sciences in China》 CAS CSCD 2008年第1期19-31,共13页
Simple sequence repeat (SSR) or microsatellite marker is a valuable tool for several purposes, such as mapping, fingerprinting, and breeding. In the present study, an intersimple sequence repeat (ISSR)-PCR techniq... Simple sequence repeat (SSR) or microsatellite marker is a valuable tool for several purposes, such as mapping, fingerprinting, and breeding. In the present study, an intersimple sequence repeat (ISSR)-PCR technique was applied for developing SSR markers in non-heading Chinese cabbage (Brassica rapa). A total of 190 SSRs were obtained. Among these, AG or CT (54.7%) was the most frequent repeat, followed by AC or GT (31.6%) of the microsatellites. The average number of the SSRs length array was 16 and 10 times, respectively. Based on the determined SSR sequences, 143 SSR primer pairs were designed to evaluate their transferabilities among the related species of Brassica. The number of alleles produced per marker averaged 2.91, and the polymorphism information content (PIC) value ranged from 0 to 0.863 with an average of 0.540. Monomorphism was observed in 16 primer pairs. The transferability percentage in CC genome was higher than in BB genome. More loci occurred in the BBCC genome. This result supported the hypothesis that BB genome was divergent from A and C genomes, and AA and CC genomes were relatively close. The polymorphic primers can be exploited for further evolution, fingerprinting, and variety identification. 展开更多
关键词 Brassica rapa inter-simple sequence repeats (ISSR) microsatellite marker POLYMORPHISM transferability
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Transferability of Sorghum Genic Microsatellite Markers to Peanut 被引量:3
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作者 Siddanna B. Savadi Bashasab Fakrudin +1 位作者 H. L. Nadaf M. V. C. Gowda 《American Journal of Plant Sciences》 2012年第9期1169-1180,共12页
Currently development of new marker types has shifted from anonymous DNA fragments to gene-based markers. Simple Sequence Repeats (SSRs) are useful DNA markers in plant genetic research including in peanut. However, d... Currently development of new marker types has shifted from anonymous DNA fragments to gene-based markers. Simple Sequence Repeats (SSRs) are useful DNA markers in plant genetic research including in peanut. However, de novo development of SSRs is expensive and time consuming. Gene-based DNA markers are transferable among related species owing to the conserved nature of genes. In this study transferability of sorghum EST-SSR (SbEST-SSR) markers to peanut was prospected. A set of 411 SbEST-SSR primer pairs were used to amplify peanut genomic DNA extracted from cultivated peanut where 39% of them successfully amplified. A comparison of amplification patterns between sorghum and peanut showed similar banding pattern with majority of transferable SbEST-SSRs. Among these transferable SSR markers, 14% have detected polymorphism among 4 resistant and 4 susceptible peanut lines for rust and late leaf spot diseases. These transferable markers will benefit peanut genome research by not only providing additional DNA markers for population genetic analyses, but also allowing comparative mapping to be possible between peanut and sorghum—a possible monocot-dicot comparison. 展开更多
关键词 ARACHIS Hypogea transferability EST-SSR POLYMORPHISM
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Characterization of 14 anonymous nuclear loci in Pinus thunbergii and their cross-species transferability
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作者 Suharyanto Mine Nose Susumu Shiraishi 《Journal of Forestry Research》 SCIE CAS CSCD 2012年第1期161-163,共3页
We characterized 14 anonymous nuclear loci from Pinus thunbergii Parl., an important pine species native to Japan. One hundred and twenty-six single nucleotide polymorphisms (SNPs) were identified from these loci, g... We characterized 14 anonymous nuclear loci from Pinus thunbergii Parl., an important pine species native to Japan. One hundred and twenty-six single nucleotide polymorphisms (SNPs) were identified from these loci, giving a frequency of 1 SNP per 51 bp. Nucleotide di- versity (0) ranged from 1.06 × 10^-3 to 11.87 × 10^-3, with all average of 4.99 × 10^-3. Only one locus (mK45) deviated significantly from the Hardy-Weinberg equilibrium. Thirteen of 14 loci were applicable in other pine species. These loci will be useful for nucleotide variation studies and will provide material for SNP-based marker development in P. thun- bergii and related species. 展开更多
关键词 anonymous nuclear loci Pinus thunbergii SNP SCAR cross-species transferability
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Spatial and temporal transferability of Degree-Day Model and Simplified Energy Balance Model:a case study
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作者 HuiLin Li 《Research in Cold and Arid Regions》 CSCD 2020年第2期95-103,共9页
Glacier mass balance, the difference between accumulation and ablation at the glacier surface, is the direct reflection of the local climate regime. Under global warming, the simulation of glacier mass balance at the ... Glacier mass balance, the difference between accumulation and ablation at the glacier surface, is the direct reflection of the local climate regime. Under global warming, the simulation of glacier mass balance at the regional scale has attracted increasing interests. This study selects Urumqi Glacier No. 1 as the testbed for examining the transferability in space and time of two commonly used glacier mass balance simulation models: i.e., the Degree-Day Model(DDM) and the simplified Energy Balance Model(s EBM). Four experiments were carried out for assessing both models’ temporal and spatial transferability. The results show that the spatial transferability of both the DDM and s EBM is strong, whereas the temporal transferability of the DDM is relatively weak. For all four experiments, the overall simulation effect of the s EBM is better than that of the DDM. At the zone around Equilibrium Line Altitude(ELA), the DDM performed better than the s EBM.Also, the accuracy of parameters, including the lapse rate of air temperature and vertical gradient of precipitation at the glacier surface, is of great significance for improving the spatial transferability of both models. 展开更多
关键词 DEGREE-DAY MODEL Simplified ENERGY Balance MODEL temporal and spatical transferability URUMQI GLACIER No.1
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Enhancing the Adversarial Transferability with Channel Decomposition
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作者 Bin Lin Fei Gao +7 位作者 Wenli Zeng Jixin Chen Cong Zhang Qinsheng Zhu Yong Zhou Desheng Zheng Qian Qiu Shan Yang 《Computer Systems Science & Engineering》 SCIE EI 2023年第9期3075-3085,共11页
The current adversarial attacks against deep learning models have achieved incredible success in the white-box scenario.However,they often exhibit weak transferability in the black-box scenario,especially when attacki... The current adversarial attacks against deep learning models have achieved incredible success in the white-box scenario.However,they often exhibit weak transferability in the black-box scenario,especially when attacking those with defense mechanisms.In this work,we propose a new transfer-based blackbox attack called the channel decomposition attack method(CDAM).It can attack multiple black-box models by enhancing the transferability of the adversarial examples.On the one hand,it tunes the gradient and stabilizes the update direction by decomposing the channels of the input example and calculating the aggregate gradient.On the other hand,it helps to escape from local optima by initializing the data point with random noise.Besides,it could combine with other transfer-based attacks flexibly.Extensive experiments on the standard ImageNet dataset show that our method could significantly improve the transferability of adversarial attacks.Compared with the state-of-the-art method,our approach improves the average success rate from 88.2%to 96.6%when attacking three adversarially trained black-box models,demonstrating the remaining shortcomings of existing deep learning models. 展开更多
关键词 Adversarial attack transferability black-box models deep learning
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Transferability and application of microsatellites(SSRs)from Juniperus communis L.to Juniperus procera Hochst.Ex endl.
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作者 Demissew Sertse Oliver Gailing +1 位作者 Nicolas-George Eliades Reiner Finkeldey 《Open Journal of Genetics》 2013年第2期115-126,共12页
Transferability of five nuclear microsatellite markers (Jc-16, Jc-31, Jc-32, Jc-35 and Jc-37) that were originally developed for J. communis was tested to J. procera. Jc-31 & Jc-37 showed successful amplifications... Transferability of five nuclear microsatellite markers (Jc-16, Jc-31, Jc-32, Jc-35 and Jc-37) that were originally developed for J. communis was tested to J. procera. Jc-31 & Jc-37 showed successful amplifications and polymorphism in J. procera. Jc-35 which had been reported as polymorphic in J. communis was monomorphic in J. procera while the primer pair for Jc-32 failed to record any amplification. The remaining one primer pair (Jc-16) showed double loci ampli-fication in both J. procera and the control J. communis suggesting further examination of the primer pair and its binding sites. Genetic variation of six Ethiopian J. procera populations: Chilimo, Goba, Menagesha-Suba, Wef-Washa, Yabelo and Ziquala was assessed based on the two polymorphic loci (Jc-31 & Jc-37) in 20 - 24 individuals of each population. From these two loci, a total of 41 alleles could be retrieved. Two populations that are located south east of the Great Rift Valley together harboured 75% of private alleles signifying their deviant geo-ecological zones and suggesting special consideration for conservation. Chilimo, which is at the western margin of Juniper habitat in Ethiopian central highlands scored the highest fixation (FIS = 0.584) entailing lower immigrant genes and hence higher inbreeding. The AMOVA revealed that 97% of the variation resided within the?population while still among population variation was significant 展开更多
关键词 Ethiopia Juniperus communis Microsatellites transferability
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Boosting leaf trait estimation from reflectance spectra by elucidating the transferability of PLSR models
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作者 Jiatong Wang Xiaoqiang Liu +15 位作者 Xiaotian Qi Xiaoyong Wu Yilin Long Yuhao Feng Qi Dong Jiabo Yan Liwen Huang Yue Luo Mengqi Cao Kai Xu Changming Zhao Yang Wang Tianyu Hu Jin Wu Lingli Liu Yanjun Su 《Plant Phenomics》 2025年第2期275-286,共12页
Leaf spectroscopy,combined with partial least squares regression(PLSR),is recognized as an efficient and precise tool for measuring plant leaf traits.However,the feasibility of developing a generalizable model remains... Leaf spectroscopy,combined with partial least squares regression(PLSR),is recognized as an efficient and precise tool for measuring plant leaf traits.However,the feasibility of developing a generalizable model remains unclear,primarily due to limited understanding of PLSR model transferability.Here,we collected six key leaf traits along with paired leaf reflectance spectra from 1967 samples of 349 tree species in eight forest sites across China.Using this dataset,we explored the transferability of PLSR models,factors affecting model transferability,and the feasibility of developing generalizable PLSR models for leaf trait prediction.Overall,PLSR models trained at a specific study site demonstrate limited transferability to other study sites.Dissimilarities in plant evolutionary history and environmental conditions between study sites are the primary factors influencing the transferability of PLSR models.Incorporating training data from diverse evolutionary histories and environmental conditions can improve the transferability of PLSR models,achieving accuracy equivalent to that of site-specific models.Our findings provide guidelines for the use of spectroscopy in leaf trait prediction and underscore the urgent need for collaborative efforts to build an open database of leaf traits and reflectance spectra,thereby promoting the development of universal PLSR models for plant leaf trait prediction. 展开更多
关键词 Leaf traits Leaf reflectance spectra Partial least-squares regression(PLSR) transferability Evolutionary history
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International transferability of macro-level safety performance functions: a case study of the United States and Italy
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作者 Jaeyoung Lee Mohamed Abdel-Aty +2 位作者 Maria Rosaria de Blasiis Xuesong Wang Ilaria Mattei 《Transportation Safety and Environment》 EI 2019年第1期68-78,共11页
Safety performance functions(SPFs),or crash-prediction models,have played an important role in identifying the factors contributing to crashes,predicting crash counts and identifying hotspots.Since a great deal of tim... Safety performance functions(SPFs),or crash-prediction models,have played an important role in identifying the factors contributing to crashes,predicting crash counts and identifying hotspots.Since a great deal of time and effort is needed to estimate an SPF,previous studies have sought to determine the transferability of particular SPFs;that is,the extent to which they can be applied to data from other regions.Although many efforts have been made to examine micro-level SPF transferability,few studies have focused on macro-level SPF transferability.There has been little transferability analysis of macro-level SPFs in the international context,especially between western countries.This study therefore evaluates the transferability of SPFs for several states in the USA(Illinois,Florida and Colorado)and for Italy.The SPFs were developed using data from counties in the United States and provincias in Italy,and the results revealed multiple common significant variables between the two countries.Transferability indexes were then calculated between the SPFs.These showed that the Italy SPFs for total crashes and bicycle crashes were transferable to US data after calibration factors were applied,whereas the US SPFs for total and bicycle crashes,with the exception of the Colorado SPF,could not be transferred to the Italian data.On the other hand,none of the pedestrian SPFs developed was transferable to other countries.This paper provides insights into the applicability of macro-level SPFs between the USA and Italy,and shows a good potential for international SPF transferability.Nevertheless,further investigation is needed of SPF transferability between a wider range of countries. 展开更多
关键词 safety performance function(SPF) crash prediction model negative binomial model transferability transferability index international transferability macro-level safety macroscopic safety
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Meta-amino substituted naphthalimides exhibit large charge transfer and strong N-H vibrations enabling use as ratiometric fluorescent probe 被引量:1
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作者 Fengzhi Wang Ke Hu +5 位作者 Jinquan Chen Zhubin Hu Haitao Sun Tony D.James Yufang Xu Xuhong Qian 《Chinese Chemical Letters》 2026年第1期427-433,共7页
Fluorescent probes based on intramolecular charge transfer(ICT) have obvious advantages for accurate quantitative analysis.To obtain high-performance ratiometric probes requires distinct photophysical properties durin... Fluorescent probes based on intramolecular charge transfer(ICT) have obvious advantages for accurate quantitative analysis.To obtain high-performance ratiometric probes requires distinct photophysical properties during recognition reaction process,which is closely related to their ICT characteristics.1,8-Naphthalimide is known as a typical fluorophore with desirable ICT property when functionalized with an electron-donating moiety at the para-position of the naphthalene chromophore.Although the photophysical properties of para-substituted 1,8-naphthalimide have been well studied,its meta-substituted counterpart has not been fully evaluated since the meta-position is conventionally thought to be weakly conjugated.Herein,combined experimental and theoretical studies are performed which consistently indicate that stronger charge transfer(CT) is exhibited by the meta-amino substituted 1,8-naphthalimide(m-NH_(2)) compared to the para-amino substituted one(p-NH_(2)).The ratiometric response of fluorescence with significant changes in wavelength and intensity upon acetylation(m-NAc and p-NAc) can be attributed to the larger ICT and stronger-NH_(2) vibrations.This observation is further demonstrated by deuterium oxide experiments,viscosity experiments and quantum chemical calculations.The practical application of meta-amino-1,8-naphthalimide ICT-based probes is also confirmed.This research is expected to bring an in-depth understanding of π-conjugated systems with ICT characteristics,and facilitates the design of sensitive ICT fluorescent probes with meta-amino substitution. 展开更多
关键词 Meta-substituted NAPHTHALIMIDE Theoretical insights Charge transfer Vibration
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To identify Chinese university patents'transferability:Indicators from the perspective of bibliometrics 被引量:2
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作者 Handong Zhang Rui Li +1 位作者 Binhua Fu Qunying Wu 《Data Science and Informetrics》 2022年第1期26-41,共16页
It is of great significance to study the indicators of university patents’transferability for improving the efficiency of the University Technology Transfer Office and promoting university patent transfer.Based on th... It is of great significance to study the indicators of university patents’transferability for improving the efficiency of the University Technology Transfer Office and promoting university patent transfer.Based on the in-depth analysis of the existing research,this paper finds that patent quality is the inherent decisive factor of patent transferability.Combining with the evaluation indexes of patent quality and the bibliometrics characteristics of university patents,9 indicators are proposed to indicate the transferability of university patents.Based on the patent transfer data of 35 Chinese universities,this paper analyzes and verifies the potential indicators of patent transfer using the binary logistic regression method.The results show that the number of inventors and the number of non-patent document citations positively predict the transferability of university patents,while the examination duration negatively predicts transferability.The effects of other indicators on transferability need to be discussed considering the actual situation and specific technology fields. 展开更多
关键词 University patent transfer Patent quality transferability characteristics Patent citation
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Parameter transferability across spatial resolutions in urban hydrological modelling:a case study in Beijing,China
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作者 Xiaoshu HOU Lei CHEN +2 位作者 Xiang LIU Miao LI Zhenyao SHEN 《Frontiers of Earth Science》 SCIE CAS CSCD 2019年第1期18-32,共15页
This study examined the influence of spatial resolution on model parameterization,output,and the parameter transferability between different resolutions using the Storm Water Management Model.High-resolution models,in... This study examined the influence of spatial resolution on model parameterization,output,and the parameter transferability between different resolutions using the Storm Water Management Model.High-resolution models,in which most subcatchrnents were homogeneous,and high-resolution-based low-resolution models (in 3 scenarios)were constructed for a highly urbanized catchment in Beijing.The results indicated that the parameterization and simulation results were affected by both spatial resolution and rainfall characteristics.The simulated peak inflow and total runoff volume were sensitive to the spatial resolution,but did not show a consistent tendency.High-resolution models performed very well for both calibration and validation events in terms of three indexes:1)the Nash-Sutcliffe efficiency, 2)the peak flow error,and 3)the volume error;indication of the advantage of using these models.The parameters obtained from high-resolution models could be directly used in the low-resolution models and performed well in the simulation of heavy rain and torrential rain and in the study area where sub-area routing is insignificant.Alternatively,sub-area routing should be considered and estimated approximately.The successful scale conversion from high spatial resolution to low spatial resolution is of great significance for the hydrological simulation of ungauged large areas. 展开更多
关键词 SWMM high RESOLUTION low RESOLUTION RAINFALL characteristics PARAMETER transferability
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Improving Transferability Reversible Adversarial Examples Based on Flipping Transformation
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作者 Youqing Fang Jingwen Jia +1 位作者 Yuhai Yang Wanli Lyu 《国际计算机前沿大会会议论文集》 EI 2023年第1期417-432,共16页
Adding subtle perturbations to an image can cause the classification model to misclassify,and such images are called adversarial examples.Adversar-ial examples threaten the safe use of deep neural networks,but when com... Adding subtle perturbations to an image can cause the classification model to misclassify,and such images are called adversarial examples.Adversar-ial examples threaten the safe use of deep neural networks,but when combined with reversible data hiding(RDH)technology,they can protect images from being correctly identified by unauthorized models and recover the image lossless under authorized models.Based on this,the reversible adversarial example(RAE)is ris-ing.However,existing RAE technology focuses on feasibility,attack success rate and image quality,but ignores transferability and time complexity.In this paper,we optimize the data hiding structure and combine data augmentation technology,whichflips the input image in probability to avoid overfitting phenomenon on the dataset.On the premise of maintaining a high success rate of white-box attacks and the image’s visual quality,the proposed method improves the transferability of reversible adversarial examples by approximately 16%and reduces the com-putational cost by approximately 43%compared to the state-of-the-art method.In addition,the appropriateflip probability can be selected for different application scenarios. 展开更多
关键词 reversible adversarial example black-box attack transferability COMPLEXITY
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Electron transfer chemistry triggered by silicon-doped carbon catalysts derived from natural minerals for the degradation of organic pollutants
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作者 Wan-Yin Gao Xiao-Qiang Cao +7 位作者 Li-Fei Hou Hao-Yun Lu Zhao-Jing Zhu Wen-Jia Kong Yang Zhang Yi-Zhen Zhang Ya-Nan Shang Xing Xu 《Chinese Chemical Letters》 2026年第1期557-562,共6页
In this study,we meticulously designed a layered carbon-based catalytic material to induce the degradation of a series of organic pollutants by activating peroxymonosulfate(PMS) in the PMS-based advanced oxidation pro... In this study,we meticulously designed a layered carbon-based catalytic material to induce the degradation of a series of organic pollutants by activating peroxymonosulfate(PMS) in the PMS-based advanced oxidation processes(AOPs).Results indicated that the silicon and oxygen elements from the montmorillonite were incorporated into the catalyst matrix to form the Si-O-C structure.It was notable that the layered carbonaceous material with Si-O-C structure exhibited an outstanding catalytic effect on the synthesized layered catalytic material array,achieving over 90 % removal rate of most pollutants within 60 min.It was notable that the layered carbonaceous material with Si-O-C structure exhibited an outstanding catalytic effect on the synthesized layered catalytic material array.The salt bridge system confirmed that pollutants can provide electrons to the Si-O-C/PMS system,and we verified that the electron transfer process(ETP) mechanism was the main pathway for the degradation of pollutants in the Si-O-C/PMS system via the open-circuit potential analysis.In combination with the structural properties of different pollutants,we discovered that electron-donating pollutants can supply more electrons to the Si-O-C/PMS system,thereby enhancing the ETP process.The findings of this study are anticipated to advance the development and practical application of layered carbonaceous materials-based catalysts and support the design and implementation of nanoconfined catalysts in the field of AOPs. 展开更多
关键词 PEROXYMONOSULFATE Electron transfer process Antibiotics Organic pollutants Fenton-like reaction MONTMORILLONITE
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Photocatalyzed hydrogen transfer enabled three-component radical cascade reactions:Direct access to thioesters from primary alcohols,elemental sulfur and alkenes
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作者 Tingting Zhang Jing Zhang 《Chinese Chemical Letters》 2026年第1期253-258,共6页
The development of catalytic multicomponent reactions for constructing complex organic scaffolds from readily accessible commodity chemicals is a key pursuit in contemporary synthetic chemistry.Current methods for syn... The development of catalytic multicomponent reactions for constructing complex organic scaffolds from readily accessible commodity chemicals is a key pursuit in contemporary synthetic chemistry.Current methods for synthesizing thioesters primarily rely on the acylation of thiols,which produces substantial waste and requires malodorous,unstable sulfur sources.In this work,we introduce a photocatalyzed hydrogen transfer strategy that enables a three-component synthesis of thioesters using abundant primary alcohols,easily available alkenes and elemental sulfur under mild conditions.This protocol demonstrates broad applicability and high chemo-and regioselectivity for both primary alcohols and alkenes,highlighting the advantage and potential of photo-mediated hydrogen transfer in facilitating multicomponent reactions using primary alcohol and elemental sulfur feedstocks. 展开更多
关键词 PHOTOCATALYSIS Hydrogen atom transfer Primary alcohol THIOESTER Elemental sulfur
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Alloying-driven 3d orbital charge transfer for enhanced polysulfide adsorption and conversion in room temperature sodium-sulfur batteries
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作者 Miao Huang Jiakai Zhang +5 位作者 Shaobo Jia Yihui Jiang Hao Zhang Shengqiang Zhang Jinxiang Diao Xiaojie Liu 《Journal of Energy Chemistry》 2026年第1期229-242,I0006,共15页
The severe shuttle effect and sluggish reaction kinetics in room-temperature sodium-sulfur(RT Na-S)batteries have been major bottlenecks hindering their practical application.To overcome these challenges,a straightfor... The severe shuttle effect and sluggish reaction kinetics in room-temperature sodium-sulfur(RT Na-S)batteries have been major bottlenecks hindering their practical application.To overcome these challenges,a straightforward reduction approach was employed to design three bimetallic alloy nanoparticles(FeNi,FeCo,and NiCo)supported on multistage porous carbon substrates.Experimental and theoretical calculations reveal that the charge transfer within the alloy catalyst influences the position of its d-band center and its degree of hybridization with sodium polysulfides(NaPSs).An increased charge transfer leads to a shift of the alloy’s d-band center closer to the Fermi energy level,thereby enhancing its adsorption and catalytic capabilities.Among the three alloy compositions,the FeNi alloy exhibits the highest charge transfer.Consequently,the FeNi alloy demonstrates the superior electrochemical performance,achieving a high reversible specific capacity of 848.2 mA h g^(−1),with an average capacity degradation rate of only 0.037%per cycle over 1000 cycles at 1.2 C.The S/FeNi/NC cathode exhibits a low electrolyte-to-sulfur(E/S)ratio of 6.6µL mg^(−1),while maintaining a high reversible specific capacity of 568.1 mA h g^(−1).This offers valuable insights for the application of alloy catalysts in the S/FeNi/NC cathode of RT Na-S batteries. 展开更多
关键词 RT Na-S batteries Alloys catalyst Charge transfer ADSORPTION ELECTROCATALYSIS
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Marine Cirrus Properties from Satellite Remote Sensing over the South China Sea:Spatiotemporal Variations and a Case Study
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作者 Haorui WENG Yong HAN +2 位作者 Li DONG Qicheng ZHOU Yurong ZHANG 《Advances in Atmospheric Sciences》 2026年第1期191-212,共22页
Cirrus clouds play a crucial role in the energy balance of the Earth-atmosphere system.We investigated the spatiotemporal variations of cirrus over the South China Sea(SCS)using satellite data(MOD08,MYD08,CALIPSO)and ... Cirrus clouds play a crucial role in the energy balance of the Earth-atmosphere system.We investigated the spatiotemporal variations of cirrus over the South China Sea(SCS)using satellite data(MOD08,MYD08,CALIPSO)and reanalysis data(MERRA-2)from March 2007 to February 2015(eight years).The horizontal distribution reveals lower cirrus fraction values in the northern SCS and higher values in the southern region,with minima observed in March and April and maxima sequentially occurring in August(northern SCS,NSCS),September(middle SCS,MSCS),and December(southern SCS,SSCS).Vertically,the cirrus fraction peaks in summer and reaches its lowest levels in spring.Opaque cirrus dominates during summer in the NSCS and MSCS,comprising 53.6%and 55.9%,respectively,while the SSCS exhibits a higher frequency of opaque cirrus relative to other cloud types.Subvisible cirrus clouds have the lowest frequency year-round,whereas thin cirrus is most prominent in winter in the NSCS(46.3%)and in spring in the MSCS(45.3%).A case study from September 2021 further explores the influence of ice crystal habits on brightness temperature(BT)over the SCS.Simulations utilizing five ice crystal shapes from the ARTS DDA(Atmospheric Radiative Transfer Simulator Discrete Dipole Approximation)database and the RTTOV 12.4 radiative transfer model reveal that the 8-column-aggregate shape best represents BT in the NSCS and SSCS,while the large-block-aggregate shape performs better in the SSCS. 展开更多
关键词 CIRRUS spatiotemporal variations satellite observation radiative transfer South China Sea
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