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Effect of Brisk Walking on Self-Care Agency or Care Dependency among Colorectal Cancer Patients with Permanent Stoma
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作者 Zhen Zhang Anabella G.Javier 《Journal of Clinical and Nursing Research》 2024年第5期68-82,共15页
Objective:The purpose of this study was to determine the effectiveness of brisk walking as an intervention for self-care agency and care dependency in patients with permanent colorectal cancer stoma.Method:This study ... Objective:The purpose of this study was to determine the effectiveness of brisk walking as an intervention for self-care agency and care dependency in patients with permanent colorectal cancer stoma.Method:This study adopted a quasi-experimental research design,specifically a non-equivalent control group pre-test and post-test design.Utilizing the Exercise of Self-Care Agency Scale(ESCA)and Care Dependency Scale(CDS),a survey was administered to 64 patients from a hospital in Shandong Province.The statistical methods used for analyzing data included frequency,mean,standard deviation(SD),independent t-test,P-value calculation,and dependent t-test.Result:After two months of a brisk walking exercise program,participants in the experimental group had a higher level of self-care agency than before the experiment(P<0.05),and their level of care dependency was significantly reduced(P<0.05).Participants in the control group also showed higher levels of self-care agency(P<0.05)and lower levels of care dependency(P<0.05)after two months compared to their levels before the two months.Conclusion:The brisk walking program had a positive impact on patients’self-care agency and reduced their care dependency. 展开更多
关键词 Permanent stoma Colorectal cancer Brisk walking Self-care agency Care dependency
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Escaping Dependency and Trade War:China and the US
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作者 Chen Ziye Li Bin 《China Economist》 2023年第1期36-44,共9页
Marxist political economy provides a perspective for grasping the root cause of the China-US trade war.The international relations of production,which stem from the international division of labor,shape the distributi... Marxist political economy provides a perspective for grasping the root cause of the China-US trade war.The international relations of production,which stem from the international division of labor,shape the distribution of international economic interests and the political status of countries.Traditionally,developing countries have been subjected to the“periphery”in the international division of labor.In the new global value chain,developing countries have remained in a subordinate position characterized by“technological-market”dependence.To achieve the goal of building a strong modern nation,China must escape the“technological-market”dependence.Yet China’s efforts and achievements in escaping dependent development are deemed as a threat to US vested interests in the international markets.To preserve the economic foundation of its hegemony,the US has resorted to a trade war to contain China’s development. 展开更多
关键词 dependency theory dependent development global value CHAINS “technological-market” dependence China-US TRADE WAR
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Reliability modeling of mutual DCFP considering failure physical dependency
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作者 CHEN Ying YANG Tianyu WANG Yanfang 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2023年第4期1063-1073,共11页
Degradation and overstress failures occur in many electronic systems in which the operation load and environmental conditions are complex.The dependency of them called dependent competing failure process(DCFP),has bee... Degradation and overstress failures occur in many electronic systems in which the operation load and environmental conditions are complex.The dependency of them called dependent competing failure process(DCFP),has been widely studied.Electronic system may experience mutual effects of degradation and shocks,they are considered to be interdependent.Both the degradation and the shock processes will decrease the limit of system and cause cumulative effect.Finally,the competition of hard and soft failure will cause the system failure.Based on the failure mechanism accumulation theory,this paper constructs the shock-degradation acceleration and the threshold descent model,and a system reliability model established by using these two models.The mutually DCFP effect of electronic system interaction has been decomposed into physical correlation of failure,including acceleration,accumulation and competition.As a case,a reliability of electronic system in aeronautical system has been analyzed with the proposed method.The method proposed is based on failure physical evaluation,and could provide important reference for quantitative evaluation and design improvement of the newly designed system in case of data deficiency. 展开更多
关键词 electronic system dependent competing failure process(DCFP) failure physical dependency threshold descent model competition failure modes
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Combining stochastic density functional theory with deep potential molecular dynamics to study warm dense matter 被引量:1
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作者 Tao Chen Qianrui Liu +2 位作者 Yu Liu Liang Sun Mohan Chen 《Matter and Radiation at Extremes》 SCIE EI CSCD 2024年第1期44-57,共14页
In traditional finite-temperature Kohn–Sham density functional theory(KSDFT),the partial occupation of a large number of high-energy KS eigenstates restricts the use of first-principles molecular dynamics methods at ... In traditional finite-temperature Kohn–Sham density functional theory(KSDFT),the partial occupation of a large number of high-energy KS eigenstates restricts the use of first-principles molecular dynamics methods at extremely high temperatures.However,stochastic density functional theory(SDFT)can overcome this limitation.Recently,SDFT and the related mixed stochastic–deterministic density functional theory,based on a plane-wave basis set,have been implemented in the first-principles electronic structure software ABACUS[Q.Liu and M.Chen,Phys.Rev.B 106,125132(2022)].In this study,we combine SDFT with the Born–Oppenheimer molecular dynamics method to investigate systems with temperatures ranging from a few tens of eV to 1000 eV.Importantly,we train machine-learning-based interatomic models using the SDFT data and employ these deep potential models to simulate large-scale systems with long trajectories.Subsequently,we compute and analyze the structural properties,dynamic properties,and transport coefficients of warm dense matter. 展开更多
关键词 STOCHASTIC theory FUNCTIONAL
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Quality Control at Nomophobia and Dependency to Technological
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作者 Pearlyne Willie Wong Huay Woon You 《International Journal of Mental Health Promotion》 2023年第8期891-901,共11页
This study aims to investigate the phenomenon of technological gadget usage among pre-university students,which include the time spent using them,as well as their purpose and influence.A descriptive research design was... This study aims to investigate the phenomenon of technological gadget usage among pre-university students,which include the time spent using them,as well as their purpose and influence.A descriptive research design was adopted in this study.131 pre-university students were randomly selected to answer a structured questionnaire.They were informed two weeks earlier to keep track on their time spent on technological devices,before answering the questionnaire.Findings showed that 99.2%of the respondents owned at least two technological gadgets,and all respondents own a smartphone.The main two gadgets that respondents spend at least 4 h a day on are smartphones(65.6%)and computers/laptops(21.4%).This indicates that smartphones are commonly used and owned among the respondents.The majority of the respondents are moderately nomophobia and moderately dependent on smartphones(70.2%and 66.4%,respectively).Correlation analysis demonstrates that the total time spent on gadgets in a day has a significant positive correlation with gadget dependency and total number of gadgets owned.Meanwhile,logistic regression was conducted to estimate the probability of nomophobia and dependency using total time spent and total number of technological gadgets.From thefindings,it was demonstrated that when the total time spent on using technological gadgets increasing,there is greater probability that the respondents develop nomophobia and dependency.This indicates that nomophobia and dependency to technological gadgets can be used to predict lifestyle profiles.The use of technological gadgets can bring both benefit and harm to its user.In light of this,user has to remain rational in order to derive maximum benefit from it. 展开更多
关键词 Nomophobia dependency technological gadgets pre-university students quality control
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Assessment of Dependent Performance Shaping Factors in SPAR-H Based on Pearson Correlation Coefficient 被引量:1
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作者 Xiaoyan Su Shuwen Shang +2 位作者 Zhihui Xu Hong Qian Xiaolei Pan 《Computer Modeling in Engineering & Sciences》 SCIE EI 2024年第2期1813-1826,共14页
With the improvement of equipment reliability,human factors have become the most uncertain part in the system.The standardized Plant Analysis of Risk-Human Reliability Analysis(SPAR-H)method is a reliable method in th... With the improvement of equipment reliability,human factors have become the most uncertain part in the system.The standardized Plant Analysis of Risk-Human Reliability Analysis(SPAR-H)method is a reliable method in the field of human reliability analysis(HRA)to evaluate human reliability and assess risk in large complex systems.However,the classical SPAR-H method does not consider the dependencies among performance shaping factors(PSFs),whichmay cause overestimation or underestimation of the risk of the actual situation.To address this issue,this paper proposes a new method to deal with the dependencies among PSFs in SPAR-H based on the Pearson correlation coefficient.First,the dependence between every two PSFs is measured by the Pearson correlation coefficient.Second,the weights of the PSFs are obtained by considering the total dependence degree.Finally,PSFs’multipliers are modified based on the weights of corresponding PSFs,and then used in the calculating of human error probability(HEP).A case study is used to illustrate the procedure and effectiveness of the proposed method. 展开更多
关键词 Reliability evaluation human reliability analysis SPAR-H performance shaping factors dependENCE pearson correlation analysis
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Read-Write Dependency Aware Register Allocation
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作者 Sheng Xiao Yong Chen +1 位作者 Jing He Xi Yang 《Computer Systems Science & Engineering》 SCIE EI 2023年第9期3527-3540,共14页
Read-write dependency is an important factor restricting software efficiency.Timing Speculative(TS)is a processing architecture aiming to improve energy efficiency of microprocessors.Timing error rate,influenced by th... Read-write dependency is an important factor restricting software efficiency.Timing Speculative(TS)is a processing architecture aiming to improve energy efficiency of microprocessors.Timing error rate,influenced by the read-write dependency,bottlenecks the voltage down-scaling and so the energy efficiency of TS processors.We proposed a method called Read-Write Dependency Aware Register Allocation.It is based on the Read-Write Dependency aware Interference Graph(RWDIG)conception.Registers are reallocated to loosen the read-write dependencies,so resulting in a reduction of timing errors.The traditional no operation(Nop)padding method is also redesigned to increase the distance value to above 2.We analyzed the dependencies of registers and maximized the average distance value of read and write dependencies.Experimental results showed that we can reduce all read-write dependency by Nop padding,as well as the overhead timing errors.An energy saving of approximately 7%was achieved. 展开更多
关键词 Read-write dependency timing speculative energy efficiency
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Analyzing Ethereum Smart Contract Vulnerabilities at Scale Based on Inter-Contract Dependency
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作者 Qiuyun Lyu Chenhao Ma +3 位作者 Yanzhao Shen Shaopeng Jiao Yipeng Sun Liqin Hu 《Computer Modeling in Engineering & Sciences》 SCIE EI 2023年第5期1625-1647,共23页
Smart contracts running on public blockchains are permissionless and decentralized,attracting both developers and malicious participants.Ethereum,the world’s largest decentralized application platform on which more t... Smart contracts running on public blockchains are permissionless and decentralized,attracting both developers and malicious participants.Ethereum,the world’s largest decentralized application platform on which more than 40 million smart contracts are running,is frequently challenged by smart contract vulnerabilities.What’s worse,since the homogeneity of a wide range of smart contracts and the increase in inter-contract dependencies,a vulnerability in a certain smart contract could affect a large number of other contracts in Ethereum.However,little is known about how vulnerable contracts affect other on-chain contracts and which contracts can be affected.Thus,we first present the contract dependency graph(CDG)to perform a vulnerability analysis for Ethereum smart contracts,where CDG characterizes inter-contract dependencies formed by DELEGATECALL-type internal transaction in Ethereum.Then,three generic definitions of security violations against CDG are given for finding respective potential victim contracts affected by different types of vulnerable contracts.Further,we construct the CDG with 195,247 smart contracts active in the latest blocks of the Ethereum and verify the above security violations against CDG by detecting three representative known vulnerabilities.Compared to previous large-scale vulnerability analysis,our analysis scheme marks potential victim contracts that can be affected by different types of vulnerable contracts,and identify their possible risks based on the type of security violation actually occurring.The analysis results show that the proportion of potential victim contracts reaches 14.7%,far more than that of corresponding vulnerable contracts(less than 0.02%)in CDG. 展开更多
关键词 Smart contract vulnerability smart contract homogeneity contract dependency graph automated analysis
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Percolation transitions in edge-coupled interdependent networks with directed dependency links
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作者 高彦丽 于海波 +2 位作者 周杰 周银座 陈世明 《Chinese Physics B》 SCIE EI CAS CSCD 2023年第9期586-595,共10页
We propose a model of edge-coupled interdependent networks with directed dependency links(EINDDLs)and develop the theoretical analysis framework of this model based on the self-consistent probabilities method.The phas... We propose a model of edge-coupled interdependent networks with directed dependency links(EINDDLs)and develop the theoretical analysis framework of this model based on the self-consistent probabilities method.The phase transition behaviors and parameter thresholds of this model under random attacks are analyzed theoretically on both random regular(RR)networks and Erd¨os-Renyi(ER)networks,and computer simulations are performed to verify the results.In this EINDDL model,a fractionβof connectivity links within network B depends on network A and a fraction(1-β)of connectivity links within network A depends on network B.It is found that randomly removing a fraction(1-p)of connectivity links in network A at the initial state,network A exhibits different types of phase transitions(first order,second order and hybrid).Network B is rarely affected by cascading failure whenβis small,and network B will gradually converge from the first-order to the second-order phase transition asβincreases.We present the critical values ofβfor the phase change process of networks A and B,and give the critical values of p andβfor network B at the critical point of collapse.Furthermore,a cascading prevention strategy is proposed.The findings are of great significance for understanding the robustness of EINDDLs. 展开更多
关键词 edge-coupled interdependent networks with directed dependency links percolation transitions cascading failures robustness analysis
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An Improved CREAM Model Based on DS Evidence Theory and DEMATEL
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作者 Zhihui Xu Shuwen Shang +3 位作者 Yuntong Pu Xiaoyan Su Hong Qian Xiaolei Pan 《Computer Modeling in Engineering & Sciences》 SCIE EI 2024年第3期2597-2617,共21页
Cognitive Reliability and Error Analysis Method(CREAM)is widely used in human reliability analysis(HRA).It defines nine common performance conditions(CPCs),which represent the factors thatmay affect human reliability ... Cognitive Reliability and Error Analysis Method(CREAM)is widely used in human reliability analysis(HRA).It defines nine common performance conditions(CPCs),which represent the factors thatmay affect human reliability and are used to modify the cognitive failure probability(CFP).However,the levels of CPCs are usually determined by domain experts,whichmay be subjective and uncertain.What’smore,the classicCREAMassumes that the CPCs are independent,which is unrealistic.Ignoring the dependence among CPCs will result in repeated calculations of the influence of the CPCs on CFP and lead to unreasonable reliability evaluation.To address the issue of uncertain information modeling and processing,this paper introduces evidence theory to evaluate the CPC levels in specific scenarios.To address the issue of dependence modeling,the Decision-Making Trial and Evaluation Laboratory(DEMATEL)method is used to process the dependence among CPCs and calculate the relative weights of each CPC,thus modifying the multiplier of the CPCs.The detailed process of the proposed method is illustrated in this paper and the CFP estimated by the proposed method is more reasonable. 展开更多
关键词 Human reliability analysis CREAM uncertainty modeling dependENCE Dempster-Shafer evidence theory DEMATEL
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Direct atomic-level insight into oxygen reduction reaction on size-dependent Pt-based electrocatalysts from density functional theory calculations
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作者 Fangren Qian Lishan Peng +2 位作者 Yujuan Zhuang Lei Liu Qingjun Chen 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2023年第9期140-146,共7页
Developing novel oxygen reduction reaction(ORR)catalysts with high activity is urgent for proton exchange membrane fuel cells.Herein,we investigated a group of size-dependent Pt-based catalysts as promising ORR cataly... Developing novel oxygen reduction reaction(ORR)catalysts with high activity is urgent for proton exchange membrane fuel cells.Herein,we investigated a group of size-dependent Pt-based catalysts as promising ORR catalysts by density functional theory calculations,ranging from single-atom,nanocluster to bulk Pt catalysts.The results showed that the ORR overpotential of these Pt-based catalysts increased when its size enlarged to the nanoparticle scale or reduced to the single-atom scale,and the Pt_(38)cluster had the lowest ORR overpotential(0.46 V)compared with that of Pt_(111)(0.57 V)and single atom Pt(0.7 V).Moreover,we established a volcano curve relationship between the ORR overpotential and binding energy of O*(ΔE_(O*),confirming the intermediate species anchored on Pt38cluster with suitable binding energy located at top of volcano curve.The interaction between intermediate species and Pt-based catalysts were also investigated by the charge distribution and projected density of state and which further confirmed the results of volcano curve. 展开更多
关键词 Density functional theory(DFT) calculations Pt-based electrocatalysts Oxygen reduction reaction
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Theoretical characterization of the temperature-dependent saturation magnetization of magnetic metallic materials
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作者 吴金龙 董攀 +6 位作者 贺屹 马艳丽 李梓源 姚沁远 邱俊 麻建坐 李卫国 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第7期577-585,共9页
Based on the force-heat equivalence energy density principle,a theoretical model for magnetic metallic materials is developed,which characterizes the temperature-dependent magnetic anisotropy energy by considering the... Based on the force-heat equivalence energy density principle,a theoretical model for magnetic metallic materials is developed,which characterizes the temperature-dependent magnetic anisotropy energy by considering the equivalent relationship between magnetic anisotropy energy and heat energy;then the relationship between the magnetic anisotropy constant and saturation magnetization is considered.Finally,we formulate a temperature-dependent model for saturation magnetization,revealing the inherent relationship between temperature and saturation magnetization.Our model predicts the saturation magnetization for nine different magnetic metallic materials at different temperatures,exhibiting satisfactory agreement with experimental data.Additionally,the experimental data used as reference points are at or near room temperature.Compared to other phenomenological theoretical models,this model is considerably more accessible than the data required at 0 K.The index included in our model is set to a constant value,which is equal to 10/3 for materials other than Fe,Co,and Ni.For transition metals(Fe,Co,and Ni in this paper),the index is 6 in the range of 0 K to 0.65T_(cr)(T_(cr) is the critical temperature),and 3 in the range of 0.65T_(cr) to T_(cr),unlike other models where the adjustable parameters vary according to each material.In addition,our model provides a new way to design and evaluate magnetic metallic materials with superior magnetic properties over a wide range of temperatures. 展开更多
关键词 magnetic metallic materials temperature dependent saturation magnetization MODELING
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Nonuniform Dependence on the Initial Data for Solutions of Conservation Laws
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作者 John M.Holmes Barbara Lee Keyfitz 《Communications on Applied Mathematics and Computation》 EI 2024年第1期489-500,共12页
In this paper,we study systems of conservation laws in one space dimension.We prove that for classical solutions in Sobolev spaces H^(s),with s>3/2,the data-to-solution map is not uniformly continuous.Our results a... In this paper,we study systems of conservation laws in one space dimension.We prove that for classical solutions in Sobolev spaces H^(s),with s>3/2,the data-to-solution map is not uniformly continuous.Our results apply to all nonlinear scalar conservation laws and to nonlinear hyperbolic systems of two equations. 展开更多
关键词 Conservation laws Data-to-solution map Nonuniform dependence
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BCCLR:A Skeleton-Based Action Recognition with Graph Convolutional Network Combining Behavior Dependence and Context Clues
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作者 Yunhe Wang Yuxin Xia Shuai Liu 《Computers, Materials & Continua》 SCIE EI 2024年第3期4489-4507,共19页
In recent years,skeleton-based action recognition has made great achievements in Computer Vision.A graph convolutional network(GCN)is effective for action recognition,modelling the human skeleton as a spatio-temporal ... In recent years,skeleton-based action recognition has made great achievements in Computer Vision.A graph convolutional network(GCN)is effective for action recognition,modelling the human skeleton as a spatio-temporal graph.Most GCNs define the graph topology by physical relations of the human joints.However,this predefined graph ignores the spatial relationship between non-adjacent joint pairs in special actions and the behavior dependence between joint pairs,resulting in a low recognition rate for specific actions with implicit correlation between joint pairs.In addition,existing methods ignore the trend correlation between adjacent frames within an action and context clues,leading to erroneous action recognition with similar poses.Therefore,this study proposes a learnable GCN based on behavior dependence,which considers implicit joint correlation by constructing a dynamic learnable graph with extraction of specific behavior dependence of joint pairs.By using the weight relationship between the joint pairs,an adaptive model is constructed.It also designs a self-attention module to obtain their inter-frame topological relationship for exploring the context of actions.Combining the shared topology and the multi-head self-attention map,the module obtains the context-based clue topology to update the dynamic graph convolution,achieving accurate recognition of different actions with similar poses.Detailed experiments on public datasets demonstrate that the proposed method achieves better results and realizes higher quality representation of actions under various evaluation protocols compared to state-of-the-art methods. 展开更多
关键词 Action recognition deep learning GCN behavior dependence context clue self-attention
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Functional microfluidics:theory,microfabrication,and applications
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作者 Mingzhu Xie Ziheng Zhan +4 位作者 Yinfeng Li Junkai Zhao Ce Zhang Zhaolong Wang Zuankai Wang 《International Journal of Extreme Manufacturing》 SCIE EI CAS CSCD 2024年第3期140-173,共34页
Microfluidic devices are composed of microchannels with a diameter ranging from ten to a few hundred micrometers.Thus,quite a small(10-9–10-18l)amount of liquid can be manipulated by such a precise system.In the past... Microfluidic devices are composed of microchannels with a diameter ranging from ten to a few hundred micrometers.Thus,quite a small(10-9–10-18l)amount of liquid can be manipulated by such a precise system.In the past three decades,significant progress in materials science,microfabrication,and various applications has boosted the development of promising functional microfluidic devices.In this review,the recent progress on novel microfluidic devices with various functions and applications is presented.First,the theory and numerical methods for studying the performance of microfluidic devices are briefly introduced.Then,materials and fabrication methods of functional microfluidic devices are summarized.Next,the recent significant advances in applications of microfluidic devices are highlighted,including heat sinks,clean water production,chemical reactions,sensors,biomedicine,capillaric circuits,wearable electronic devices,and microrobotics.Finally,perspectives on the challenges and future developments of functional microfluidic devices are presented.This review aims to inspire researchers from various fields engineering,materials,chemistry,mathematics,physics,and more—to collaborate and drive forward the development and applications of functional microfluidic devices,specifically for achieving carbon neutrality. 展开更多
关键词 capillary theory functional devices functional microfluidics
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Contract Mechanism of Water Environment Regulation for Small and Medium Sized Enterprises Based on Optimal Control Theory
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作者 Shuang Zhao Hongbin Gu +2 位作者 Lianfang Xue Dongsheng Wang Bin Huang 《Journal of Water Resource and Protection》 CAS 2024年第7期538-556,共20页
The small and scattered enterprise pattern in the county economy has formed numerous sporadic pollution sources, hindering the centralized treatment of the water environment, increasing the cost and difficulty of trea... The small and scattered enterprise pattern in the county economy has formed numerous sporadic pollution sources, hindering the centralized treatment of the water environment, increasing the cost and difficulty of treatment. How enterprises can make reasonable decisions on their water environment behavior based on the external environment and their own factors is of great significance for scientifically and effectively designing water environment regulation mechanisms. Based on optimal control theory, this study investigates the design of contractual mechanisms for water environmental regulation for small and medium-sized enterprises. The enterprise is regarded as an independent economic entity that can adopt optimal control strategies to maximize its own interests. Based on the participation of multiple subjects including the government, enterprises, and the public, an optimal control strategy model for enterprises under contractual water environmental regulation is constructed using optimal control theory, and a method for calculating the amount of unit pollutant penalties is derived. The water pollutant treatment cost data of a paper company is selected to conduct empirical numerical analysis on the model. The results show that the increase in the probability of government regulation and public participation, as well as the decrease in local government protection for enterprises, can achieve the same regulatory effect while reducing the number of administrative penalties per unit. Finally, the implementation process of contractual water environmental regulation for small and medium-sized enterprises is designed. 展开更多
关键词 Optimal Control theory Small and Medium-Sized Enterprises Water Environment Regulation Contract Mechanism
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Prospect Theory Based Individual Irrationality Modelling and Behavior Inducement in Pandemic Control
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作者 Wenxiang Dong H.Vicky Zhao 《Computer Modeling in Engineering & Sciences》 SCIE EI 2024年第7期139-170,共32页
Understanding and modeling individuals’behaviors during epidemics is crucial for effective epidemic control.However,existing research ignores the impact of users’irrationality on decision-making in the epidemic.Mean... Understanding and modeling individuals’behaviors during epidemics is crucial for effective epidemic control.However,existing research ignores the impact of users’irrationality on decision-making in the epidemic.Meanwhile,existing disease control methods often assume users’full compliance with measures like mandatory isolation,which does not align with the actual situation.To address these issues,this paper proposes a prospect theorybased framework to model users’decision-making process in epidemics and analyzes how irrationality affects individuals’behaviors and epidemic dynamics.According to the analysis results,irrationality tends to prompt conservative behaviors when the infection risk is low but encourages risk-seeking behaviors when the risk is high.Then,this paper proposes a behavior inducement algorithm to guide individuals’behaviors and control the spread of disease.Simulations and real user tests validate our analysis,and simulation results show that the proposed behavior inducement algorithm can effectively guide individuals’behavior. 展开更多
关键词 Disease spread behavior model IRRATIONALITY prospect theory
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Density functional theory study of B- and Si-doped carbons and their adsorption interactions with sulfur compounds
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作者 Peng Guo Hong Zhang +1 位作者 Shuliang Dong Libao An 《Carbon Energy》 SCIE EI CAS CSCD 2024年第2期195-208,共14页
Understanding the adsorption interactions between carbon materials and sulfur compounds has far-reaching impacts,in addition to their well-known important role in energy storage and conversion,such as lithium-ion batt... Understanding the adsorption interactions between carbon materials and sulfur compounds has far-reaching impacts,in addition to their well-known important role in energy storage and conversion,such as lithium-ion batteries.In this paper,properties of intrinsic B or Si single-atom doped,and B-Si codoped graphene(GR)and graphdiyne(GDY)were investigated by using density functional theory-based calculations,in which the optimal doping configurations were explored for potential applications in adsorbing sulfur compounds.Results showed that both B or Si single-atom doping and B-Si codoping could substantially enhance the electron transport properties of GR and GDY,improving their surface activity.Notably,B and Si atoms displayed synergistic effects for the codoped configurations,where B-Si codoped GR/GDY exhibited much better performance in the adsorption of sulfurcontaining chemicals than single-atom doped systems.In addition,results demonstrated that,after B-Si codoping,the adsorption energy and charge transfer amounts of GDY with sulfur compounds were much larger than those of GR,indicating that B-Si codoped GDY might be a favorable material for more effectively interacting with sulfur reagents. 展开更多
关键词 ADSORPTION density functional theory DOPING graphdiyne GRAPHENE sulfur compounds
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Local thermal conductivity of inhomogeneous nano-fluidic films:A density functional theory perspective
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作者 孙宗利 康艳霜 康艳梅 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第4期594-603,共10页
Combining the mean field Pozhar-Gubbins(PG)theory and the weighted density approximation,a novel method for local thermal conductivity of inhomogeneous fluids is proposed.The correlation effect that is beyond the mean... Combining the mean field Pozhar-Gubbins(PG)theory and the weighted density approximation,a novel method for local thermal conductivity of inhomogeneous fluids is proposed.The correlation effect that is beyond the mean field treatment is taken into account by the simulation-based empirical correlations.The application of this method to confined argon in slit pore shows that its prediction agrees well with the simulation results,and that it performs better than the original PG theory as well as the local averaged density model(LADM).In its further application to the nano-fluidic films,the influences of fluid parameters and pore parameters on the thermal conductivity are calculated and investigated.It is found that both the local thermal conductivity and the overall thermal conductivity can be significantly modulated by these parameters.Specifically,in the supercritical states,the thermal conductivity of the confined fluid shows positive correlation to the bulk density as well as the temperature.However,when the bulk density is small,the thermal conductivity exhibits a decrease-increase transition as the temperature is increased.This is also the case in which the temperature is low.In fact,the decrease-increase transition in both the small-bulk-density and low-temperature cases arises from the capillary condensation in the pore.Furthermore,smaller pore width and/or stronger adsorption potential can raise the critical temperature for condensation,and then are beneficial to the enhancement of the thermal conductivity.These modulation behaviors of the local thermal conductivity lead immediately to the significant difference of the overall thermal conductivity in different phase regions. 展开更多
关键词 thermal conductivity nano-fluidic films density functional theory
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The “Dead Universe” Theory: Natural Separation of Galaxies Driven by the Remnants of a Supermassive Dead Universe
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作者 Joel Almeida 《Natural Science》 2024年第6期65-101,共37页
This article explores the dead universe theory as a novel interpretation for the origin and evolution of the universe, suggesting that our cosmos may have originated from the remnants of a preceding universe. This per... This article explores the dead universe theory as a novel interpretation for the origin and evolution of the universe, suggesting that our cosmos may have originated from the remnants of a preceding universe. This perspective challenges the conventional Big Bang theory, particularly concerning dark matter, the expansion of the universe, and the interpretation of phenomena such as gravitational waves. 展开更多
关键词 Dead Universe theory Heat Death of the Universe Big Bang theory Universe’s Ultimate Fate Universe Expansion Big Freeze Universe Cosmological Models End of Universe Theories Natural Galaxy Drift Future of the Universe Universe Cooling Down Cosmology and Entropy
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