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Evaluation method and optimization strategies of resilience for air&space defense system of systems based on kill network theory and improved self-information quantity 被引量:14
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作者 Qi Han Bo Pang +4 位作者 Sen Li Ning Li Peng-song Guo Cheng-li Fan Wei-min Li 《Defence Technology(防务技术)》 SCIE EI CAS CSCD 2023年第3期219-239,共21页
Resilience of air&space defense system of systems(SoSs)is critical to national air defense security.However,the research on it is still scarce.In this study,the resilience of air&space defense SoSs is firstly ... Resilience of air&space defense system of systems(SoSs)is critical to national air defense security.However,the research on it is still scarce.In this study,the resilience of air&space defense SoSs is firstly defined and the kill network theory is established by combining super network and kill chain theory.Two cases of the SoSs are considered:(a)The kill chains are relatively homogenous;(b)The kill chains are relatively heterogenous.Meanwhile,two capability assessment methods,which are based on the number of kill chains and improved self-information quantity,respectively,are proposed.The improved self-information quantity modeled based on nodes and edges can achieve qualitative and quantitative assessment of the combat capability by using linguistic Pythagorean fuzzy sets.Then,a resilient evaluation index consisting of risk response,survivability,and quick recovery is proposed accordingly.Finally,network models for regional air defense and anti-missile SoSs are established respectively,and the resilience measurement results are verified and analyzed under different attack and recovery strategies,and the optimization strategies are also proposed.The proposed theory and method can meet different demands to evaluate combat capability and optimize resilience of various types of air&space defense and similar SoSs. 展开更多
关键词 network optimization theory
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Immune multi-agent model using vaccine for cooperative air-defense system of systems for surface warship formation based on danger theory 被引量:9
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作者 Jun Wang Xiaozhe Zhao +2 位作者 Beiping Xu Wei Wang Zhiyong Niu 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2013年第6期946-953,共8页
Aiming at the problem on cooperative air-defense of surface warship formation, this paper maps the cooperative airdefense system of systems (SoS) for surface warship formation (CASoSSWF) to the biological immune s... Aiming at the problem on cooperative air-defense of surface warship formation, this paper maps the cooperative airdefense system of systems (SoS) for surface warship formation (CASoSSWF) to the biological immune system (BIS) according to the similarity of the defense mechanism and characteristics between the CASoSSWF and the BIS, and then designs the models of components and the architecture for a monitoring agent, a regulating agent, a killer agent, a pre-warning agent and a communicating agent by making use of the theories and methods of the artificial immune system, the multi-agent system (MAS), the vaccine and the danger theory (DT). Moreover a new immune multi-agent model using vaccine based on DT (IMMUVBDT) for the cooperative air-defense SoS is advanced. The immune response and immune mechanism of the CASoSSWF are analyzed. The model has a capability of memory, evolution, commendable dynamic environment adaptability and self-learning, and embodies adequately the cooperative air-defense mechanism for the CASoSSWF. Therefore it shows a novel idea for the CASoSSWF which can provide conception models for a surface warship formation operation simulation system. 展开更多
关键词 immune multi-agent model (IMM) VACCINE surface warship formation cooperative air-defense system of systems (CASoS) danger theory (DT)
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Multi-agent system application in accordance with game theory in bi-directional coordination network model 被引量:3
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作者 ZHANG Jie WANG Gang +3 位作者 YUE Shaohua SONG Yafei LIU Jiayi YAO Xiaoqiang 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2020年第2期279-289,共11页
The multi-agent system is the optimal solution to complex intelligent problems. In accordance with the game theory, the concept of loyalty is introduced to analyze the relationship between agents' individual incom... The multi-agent system is the optimal solution to complex intelligent problems. In accordance with the game theory, the concept of loyalty is introduced to analyze the relationship between agents' individual income and global benefits and build the logical architecture of the multi-agent system. Besides, to verify the feasibility of the method, the cyclic neural network is optimized, the bi-directional coordination network is built as the training network for deep learning, and specific training scenes are simulated as the training background. After a certain number of training iterations, the model can learn simple strategies autonomously. Also,as the training time increases, the complexity of learning strategies rises gradually. Strategies such as obstacle avoidance, firepower distribution and collaborative cover are adopted to demonstrate the achievability of the model. The model is verified to be realizable by the examples of obstacle avoidance, fire distribution and cooperative cover. Under the same resource background, the model exhibits better convergence than other deep learning training networks, and it is not easy to fall into the local endless loop.Furthermore, the ability of the learning strategy is stronger than that of the training model based on rules, which is of great practical values. 展开更多
关键词 LOYALTY GAME theory bi-directional COORDINATION network MULTI-AGENT system learning STRATEGY
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Close-in weapon system planning based on multi-living agent theory 被引量:2
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作者 Tang Tang Yue Wang +2 位作者 Li-juan Jia Jin Hu Cheng Ma 《Defence Technology(防务技术)》 SCIE EI CAS CSCD 2022年第7期1219-1231,共13页
The close-in weapon system(CIWS)is a combat system that faces a complex environment full of dynamic and unknown challenges,whose construction and planning require a systematic design method.Multiliving agent(MLA)theor... The close-in weapon system(CIWS)is a combat system that faces a complex environment full of dynamic and unknown challenges,whose construction and planning require a systematic design method.Multiliving agent(MLA)theory is a methodology for the combat system design,which uses the livelihood degree to evaluate the multi-dimensional long-term operational effectiveness of the system;whereas,there is still no uniform quantization framework for the livelihood degree,and the adjustment methods of livelihood degree need to be further improved.In this paper,we propose the uniform quantization framework for the livelihood degree and detailed discuss the methods of livelihood adjustment.Based on the MLA theory,the multi-dimensional operational effectiveness of the missile-gun integrated weapon system(MGIWS)is analyzed,and the long-term combat effectiveness against the saturation attack is assessed.Furthermore,the planning problem of the equipment deployment and configuration is investigated.Two objectives,including the overall livelihood degree and cost-effectiveness(CE),are proposed,and the optimization method based on genetic algorithm(GA)is studied for the planning problem. 展开更多
关键词 Multi-living agent theory Close-in weapon system Effectiveness evaluation Livelihood degree Queueing system Missile-gun integrated weapon system
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Probability estimation based on grey system theory for simulation evaluation 被引量:6
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作者 Jianmin Wang Jinbo Wang +1 位作者 Tao Zhang Yunjie Wu 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2016年第4期871-877,共7页
In the evaluation of some simulation systems, only small samples data are gotten due to the limited conditions. In allusion to the evaluation problem of small sample data, an interval estimation approach with the impr... In the evaluation of some simulation systems, only small samples data are gotten due to the limited conditions. In allusion to the evaluation problem of small sample data, an interval estimation approach with the improved grey confidence degree is proposed.On the basis of the definition of grey distance, three kinds of definition of the grey weight for every sample element in grey estimated value are put forward, and then the improved grey confidence degree is designed. In accordance with the new concept, the grey interval estimation for small sample data is deduced. Furthermore,the bootstrap method is applied for more accurate grey confidence interval. Through resampling of the bootstrap, numerous small samples with the corresponding confidence intervals can be obtained. Then the final confidence interval is calculated from the union of these grey confidence intervals. In the end, the simulation system evaluation using the proposed method is conducted. The simulation results show that the reasonable confidence interval is acquired, which demonstrates the feasibility and effectiveness of the proposed method. 展开更多
关键词 small sample interval estimation simulation system evaluation probability grey system theory
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Complex adaptive system theory,agent-based modeling,and simulation in dominant technology formation 被引量:1
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作者 ZHANG Ruihan SUN Bing 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2024年第1期130-153,共24页
Dominant technology formation is the key for the hightech industry to“cross the chasm”and gain an established foothold in the market(and hence disrupt the regime).Therefore,a stimulus-response model is proposed to i... Dominant technology formation is the key for the hightech industry to“cross the chasm”and gain an established foothold in the market(and hence disrupt the regime).Therefore,a stimulus-response model is proposed to investigate the dominant technology by exploring its formation process and mechanism.Specifically,based on complex adaptive system theory and the basic stimulus-response model,we use a combination of agent-based modeling and system dynamics modeling to capture the interactions between dominant technology and the socio-technical landscape.The results indicate the following:(i)The dynamic interaction is“stimulus-reaction-selection”,which promotes the dominant technology’s formation.(ii)The dominant technology’s formation can be described as a dynamic process in which the adaptation intensity of technology standards increases continuously until it becomes the leading technology under the dual action of internal and external mechanisms.(iii)The dominant technology’s formation in the high-tech industry is influenced by learning ability,the number of adopting users and adaptability.Therein,a“critical scale”of learning ability exists to promote the formation of leading technology:a large number of adopting users can promote the dominant technology’s formation by influencing the adaptive response of technology standards to the socio-technical landscape and the choice of technology standards by the socio-technical landscape.There is a minimum threshold and a maximum threshold for the role of adaptability in the dominant technology’s formation.(iv)The socio-technical landscape can promote the leading technology’s shaping in the high-tech industry,and different elements have different effects.This study promotes research on the formation mechanism of dominant technology in the high-tech industry,presents new perspectives and methods for researchers,and provides essential enlightenment for managers to formulate technology strategies. 展开更多
关键词 complex adaptive system theory agent-based modeling and simulation dominant technology socio-technical landscape adaptation-choice
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Cooperative game theory-based steering law design of a CMG system 被引量:1
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作者 HUA Bing NI Rui +2 位作者 ZHENG Mohong WU Yunhua CHEN Zhiming 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2023年第1期185-196,共12页
Spacecraft require a large-angle manoeuvre when performing agile manoeuvring tasks, therefore a control moment gyroscope(CMG) is employed to provide a strong moment.However, the control of the CMG system easily falls ... Spacecraft require a large-angle manoeuvre when performing agile manoeuvring tasks, therefore a control moment gyroscope(CMG) is employed to provide a strong moment.However, the control of the CMG system easily falls into singularity, which renders the actuator unable to output the required moment. To solve the singularity problem of CMGs, the control law design of a CMG system based on a cooperative game is proposed. First, the cooperative game model is constructed according to the quadratic programming problem, and the cooperative strategy is constructed. When the strategy falls into singularity, the weighting coefficient is introduced to carry out the strategy game to achieve the optimal strategy. In theory, it is proven that the cooperative game manipulation law of the CMG system converges, the sum of the CMG frame angular velocities is minimized, the energy consumption is small, and there is no output torque error. Then, the CMG group system is simulated.When the CMG system is near the singular point, it can quickly escape the singularity. When the CMG system falls into the singularity, it can also escape the singularity. Considering the optimization of angular momentum and energy consumption, the feasibility of the CMG system steering law based on a cooperative game is proven. 展开更多
关键词 control moment gyroscopes(CMG) cooperative game theory steering laws
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Group Support Systems: Implications for Multi-Disciplinary Theory Building 被引量:1
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作者 Leonard M. Jessup Joseph S. Valacich(College of Business Administration California State University, San Marcos 820 West Los Vallecitos Boulevard San Marcos, California 92069 (619) 752-4233) (Department of Decision and Information SystemsSchool of Busi 《决策与决策支持系统》 1996年第2期92-107,共16页
Group Support Systems:Implications for Multi-Disciplinary Theory BuildingLeonardM.Jessup;JosephS.Valacich(Co... Group Support Systems:Implications for Multi-Disciplinary Theory BuildingLeonardM.Jessup;JosephS.Valacich(CollegeofBusinessAd... 展开更多
关键词 Group Support systems Implications for Multi-Disciplinary theory Building
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Optimal Adaptive Control of a Class of Stochastic Systems Using Game Theory
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作者 CAI Jian-li (Automation Dept., Xiamen University, Xiamen 361005, China) 《厦门大学学报(自然科学版)》 CAS CSCD 北大核心 2002年第S1期287-,共1页
This paper attempts to study a optimal adaptive con tr ol problem using game theory, and proposes an important practical result that an adaptive processes is a set of sufficient conditions under which pure strategy is... This paper attempts to study a optimal adaptive con tr ol problem using game theory, and proposes an important practical result that an adaptive processes is a set of sufficient conditions under which pure strategy is essentially complete, and thus the fact that yield a very useful desirable pu re optimal control rule. 展开更多
关键词 game theory optimal adaptive control pure strat egy mixed extension
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Engineering System Theory─A New Engineering Meta-Discipline
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作者 Wang Liancheng(Beijing Institute of Electronic System Engineering, 100854, P. R. China)(Received July 2, 1998) 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 1999年第1期1-3,共3页
This paper proposes a new engineering disciplin─Engineering System Theory. It dis cusses rendered background, research objects and contents of the engineering system theory briefly. Finally, the met-discipline stand... This paper proposes a new engineering disciplin─Engineering System Theory. It dis cusses rendered background, research objects and contents of the engineering system theory briefly. Finally, the met-discipline standing of the engineering system theory in the whole knowledge system of engineering science and its development potential are pointed out. 展开更多
关键词 ENGINEERING system DISCIPLINE systems theory.
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A new method for evaluating the firing precision of multiple launch rocket system based on Bayesian theory
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作者 Yunfei Miao Guoping Wang Wei Tian 《Defence Technology(防务技术)》 SCIE EI CAS CSCD 2024年第2期232-241,共10页
How to effectively evaluate the firing precision of weapon equipment at low cost is one of the core contents of improving the test level of weapon system.A new method to evaluate the firing precision of the MLRS consi... How to effectively evaluate the firing precision of weapon equipment at low cost is one of the core contents of improving the test level of weapon system.A new method to evaluate the firing precision of the MLRS considering the credibility of simulation system based on Bayesian theory is proposed in this paper.First of all,a comprehensive index system for the credibility of the simulation system of the firing precision of the MLRS is constructed combined with the group analytic hierarchy process.A modified method for determining the comprehensive weight of the index is established to improve the rationality of the index weight coefficients.The Bayesian posterior estimation formula of firing precision considering prior information is derived in the form of mixed prior distribution,and the rationality of prior information used in estimation model is discussed quantitatively.With the simulation tests,the different evaluation methods are compared to validate the effectiveness of the proposed method.Finally,the experimental results show that the effectiveness of estimation method for firing precision is improved by more than 25%. 展开更多
关键词 Multiple launch rocket system Bayesian theory Simulation credibility Mixed prior distribution Firing precision
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Map Building for a Mobile Robot Based on Grey System Theory
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作者 王卫华 席裕庚 陈卫东 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2003年第3期67-72,共6页
In this paper, a new method for mobile robot map building based on grey system theory is presented, by which interpretation and integration of sonar readings can be solved robustly and efficiently. The conception of &... In this paper, a new method for mobile robot map building based on grey system theory is presented, by which interpretation and integration of sonar readings can be solved robustly and efficiently. The conception of 'grey number is introduced to model and handle the uncertainty of sonar reading. A new data fusion approach based on grey system theory is proposed to construct environment model. Map building experiments are performed both on a platform of simulation and a real mobile robot. Experimental results show that our method is robust and accurate. 展开更多
关键词 Grey system theory UNCERTAINTY Map building Mobile robot.
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Equivalent sample theory of networked control systems and its application
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作者 Ji Shunping Lu Yuping Wang Shipeng 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2008年第6期1199-1202,共4页
The equivalent sample theory and its application in analysis of networked control system (NCS) are presented. After analyzing NCS's scheduling in master-slave mode, the characteristics of time delay and sample are ... The equivalent sample theory and its application in analysis of networked control system (NCS) are presented. After analyzing NCS's scheduling in master-slave mode, the characteristics of time delay and sample are summarized. Looking on master station visiting the slave station as a special sample process, the theory of equivalent sample is presented. And based on it, the stability of a kind of NCS is analyzed. The criterion to determine the upper bound of transmission delay is introduced, which guarantees the stability. Finally, an example with simulation shows the availability and usability of this analysis method. 展开更多
关键词 networked control system equivalent sample theory STABILITY
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Construction of Public Security Risk Governance System under the View of Risk Society Theory
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作者 Ding Donghan 《学术界》 CSSCI 北大核心 2020年第6期193-201,共9页
With the development of economy,China has to fight against the increasing public security risk. The theory of risk society points out that the traditional system of hierarchical management should be transformed into t... With the development of economy,China has to fight against the increasing public security risk. The theory of risk society points out that the traditional system of hierarchical management should be transformed into the governance system led by government and participated in by multiple parties to avoid and reduce risk in modern society. In order to achieve modernization of the national governance system and capacity,we have to deal with these two important subjects,that is,what can we learn from the Western risk society theory and how to establish a scientific and efficient public security risk management system based on the characteristics of modern public security risk. 展开更多
关键词 risk society theory of risk society public security risk
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An Information Theory Approach to the Data Compression and Imaging System for Synthetic Aperture Radar (SAR)
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作者 Xiao Yongxin Peng Hailiang and Chen Zongzhi(Institute of Electronics, Chinese Academy of Sciences, Beijing 100080, P. R. China.) 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 1995年第1期1-15,共15页
Synthetic aperture radar (SAR) is portrayed as a multiple access channel. An information theory approach is applied to the SAR imaging system, and the information content about a target that can be extracted from its ... Synthetic aperture radar (SAR) is portrayed as a multiple access channel. An information theory approach is applied to the SAR imaging system, and the information content about a target that can be extracted from its radar image is evaluated by the average mutual information measure. A conditional (transition) probability density function (PDF) of the SAR imaging system is derived by analyzing the system and a closed form of the information content is found. It is shown that the information content obtained by the SAR imaging system from an independent sample of echoes will decrease and the total information content obtained by the SAR imaging system will increase with an increase in the number of looks. Because the total average mutual information is also used to define a measure of radiometric resolution for radar images, it is shown that the radiometric resolution of a radar image of terrain will be improved by spatial averaging. In addition, the imaging process and the data compression process for SAR are each treated as an independent generalized communication channel. The effects of data compression upon radiometric resolution for SAR are studied and some conclusions are obtained. 展开更多
关键词 Synthetic aperture radar (SAR) information theory data compression radiometric resolution probability density function (PDF) multiple access channel average mutual information
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Linguistic Reflection on the Online Catchword of Appreciation —From the Perspective of Usage-based Language Model and Complex Adaptive System Theory
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作者 HE Xiang 《北京第二外国语学院学报》 2016年第5期139-139,共1页
Language is a special social phenomenon and is always on the changing process with the development of society. During the evolving process of language, new language varieties will continuously emerge due to the change... Language is a special social phenomenon and is always on the changing process with the development of society. During the evolving process of language, new language varieties will continuously emerge due to the changes of some social and cultural factors. Cyber language is universally accepted as one type of the social language varieties. Basically, cyber language can be treated as a complex adaptive system which is influenced by the interaction between users’ cognition, social culture and the surrounding environments. Thus it is safe to say that cyber language is always undergoing a dynamic evolving process. With the usage-based language model as the theoretical foundation, this paper proposes a Complex Adaptive System (CAS) approach to analyze the expression of Appreciation to explore the complex, dynamic and nonlinear development of cyber language from the angle of meaning construction, grammaticalization and functional adaption respectively. It is found that the expression of Appreciation is experiencing adaptively a semantic connotations development and a process of grammatical functions expansion as well. This paper suggests that the emergence and development of cyber language is a novel and trendy social language phenomenon. Network language can achieve its process and evolution under the huge impact of social changes and social promotions. When faced with the changing surroundings, cyber language itself enjoys a timely adaption and responsive development to keep up with the new environments, which reflects the basic principle of language development, namely, language changes with the development of society. 展开更多
关键词 Usage-based LANGUAGE Model Complex Adaptive system theory the expression of APPRECIATION cyber LANGUAGE LANGUAGE var
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A series of iridium(Ⅲ)complexes with fluorophenyl isoquinoline ligand and low-efficiency roll-off properties:A density functional theory study
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作者 QIN Zhengkun PAN Zicong +2 位作者 TIAN Hui ZHANG Wanyi SONG Mingxing 《无机化学学报》 北大核心 2025年第6期1235-1244,共10页
We have examined the theoretical implications of combining two main and three auxiliary ligands to form several Ir(Ⅲ)complexes featuring a transition metal as their core atom to identify some appropriate organic ligh... We have examined the theoretical implications of combining two main and three auxiliary ligands to form several Ir(Ⅲ)complexes featuring a transition metal as their core atom to identify some appropriate organic lightemitting diode(OLED)materials.By utilizing electronic structure,frontier molecular orbitals,minimum single-line absorption,triplet excited states,and emission spectral data derived from the density functional theory,the usefulness of these Ir(Ⅲ)complexes,including(piq)_(2)Ir(acac),(piq)_(2)Ir(tmd),(piq)_(2)Ir(tpip),(fpiq)_(2)Ir(acac),(fpiq)_(2)Ir(tmd),and(fpiq)_(2)Ir(tpip),in OLEDs was examined,where piq=1-phenylisoquinoline,fpiq=1-(4-fluorophenyl)isoquinoline,acac=(3Z)-4-hydroxypent-3-en-2-one,tmd=(4Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one,and tpip=tetraphenylimido-diphosphonate.These complexes all have low-efficiency roll-off properties,especially(fpiq)_(2)Ir(tpip).Some researchers have successfully synthesized complexes extremely similar to(piq)_(2)Ir(acac)through the Suzuki-Miyaura coupling reaction. 展开更多
关键词 density functional theory organic light-emitting diodes luminescent materials Ir(Ⅲ)complexes
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A new theory for determining large deformation area of roof at intersection and verification analysis
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作者 WU Yi-yi GAO Yu-bing +2 位作者 MA Xiang ZHANG Xing-xing HE Man-chao 《Journal of Central South University》 2025年第2期656-677,共22页
The intersection is a widely used traffic line structure from the shallow tunnel to the deep roadway,and determining the subsidence hidden danger area of the roof is the key to its stability control.However,applying t... The intersection is a widely used traffic line structure from the shallow tunnel to the deep roadway,and determining the subsidence hidden danger area of the roof is the key to its stability control.However,applying traditional maximum equivalent span beam(MESB)theory to determine deformation range,peak point,and angle influence poses a challenge.Considering the overall structure of the intersection roof,the maximum equivalent triangular plate(METP)theory is proposed,and its geometric parameter calculation formula and deflection calculation formula are obtained.The application of the two theories in 18 models with different intersection angles,roadway types,and surrounding rock lithology is verified by numerical analysis.The results show that:1)The METP structure of the intersection roof established by the simulation results of each model successfully determined the location of the roof’s high displacement zone;2)The area comparison method of the METP theory can be reasonably explained:①The roof subsidence of the intersection decreases with the increase of the intersection angle;②The roof subsidence at the intersection of different roadway types has a rectangular type>arch type>circular type;③The roof subsidence of the intersection with weak surrounding rock is significantly larger than that of the intersection with hard surrounding rock.According to the application results of the two theories,the four advantages of the METP theory are compared and clarified in the basic assumptions,mechanical models,main viewpoints,and mechanism analysis.The large deformation inducement of the intersection roof is then explored.The J 2 peak area of the roof drives the large deformation of the area,the peak point of which is consistent with the center of gravity position of the METP.Furthermore,the change in the range of this peak is consistent with the change law of the METP’s area.Hence,this theory clarifies the large deformation area of the intersection roof,which provides a clear guiding basis for its initial support design,mid-term monitoring,and late local reinforcement. 展开更多
关键词 roadway intersection roof deformation equivalent span theory triangular plate structure numerical analysis stress partial tensor
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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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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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