Metal-organic framework(MOF) has been widely applied in photocatalysis, which is significant for addressing energy crises and environmental issues. Based on density functional theory calculations,the performances of C...Metal-organic framework(MOF) has been widely applied in photocatalysis, which is significant for addressing energy crises and environmental issues. Based on density functional theory calculations,the performances of Cu-BTC, a copper-based MOF, and its derivatives Cu TM-BTC via the substitution of transition metal(TM) elements at the Cu site for photocatalytic overall water splitting(POWS) have been studied. POWS of Cu-BTC suffers from the sluggish hydrogen evolution reaction due to the large overpotential of 2.02 V and limited solar utilization due to a wide HOMO-LUMO gap of 4.11 e V. Via TM substitution, the HOMO-LUMO gap narrows but still satisfies the redox potentials when taken 3d-TM of Cr, Fe, Co or Ni, 4d-TM of Rh or Pd, or 5d-TM of Re or Pt into consideration, benefiting for the light absorption. Furthermore, Cr and Re could serve as active sites for hydrogen evolution with remarkably lowered overpotentials of 0.79 V and 0.28 V, respectively;similarly, oxygen evolution activities could be enhanced by Fe, Co and Rh because of their reduced overpotentials which are less than 0.5 V. Therefore,our findings pave guidance for designing Cu-BTC derivatives in overall water splitting.展开更多
Based on the meaning of economic theory as well as analysis of relevant characteristics of watershed environmental management,a watershed environmental management framework will be created,with building systems of the...Based on the meaning of economic theory as well as analysis of relevant characteristics of watershed environmental management,a watershed environmental management framework will be created,with building systems of theory,principles,methods,and supporting measures.Through the general structure,the watershed environmental management system design can be explored to optimize the allocation of resources and achieve coordinated development of watershed economic growth and environmental protection.展开更多
This paper focuses on C-K theory with its application to expand the scope of innovative solutions to transform health systems.The previous paper(Huttin,2024)provided a review of main design theories and a description ...This paper focuses on C-K theory with its application to expand the scope of innovative solutions to transform health systems.The previous paper(Huttin,2024)provided a review of main design theories and a description of the research process and interactions between investigators for physicians’choice models using random price generators.The selection of alternatives for that user case mainly related to medical policy problems(e.g.Huttin&Hausman,2021).However,such experimental studies require scaling up for bigger samples and therefore comprehensive user cases,to be useful for transformative tools in health system reforms.The use of C-K theory(Hatchuel&Weil,2002)may be a useful framework to generate data elements on economic and financial information,from conversation of care,and expand the dataspace,with innovative applications of the algorithms(as proposed in Prof.Huttin’s studies).The development of such economic models will impact the architecture of national or international accounting systems;therefore,they may require the design of ad hoc or satellite health accounts with such additional type of information.However,the architecture of health accounts is more driven by environmental communities who dominate methodological advances(e.g.agriculture,forestry management,etc.);modeling techniques in international health accounting generate specific tracers to integrate in aggregate indexes.Such development of the K space may be used for the health targets under the global agenda(e.g.SDGs).The statistical methods used to transform this K space,their selection process,and the identification of key parameters estimates will determine to a certain extent the transformation of health systems and will nurture the C concepts(e.g.more justice in reallocation of services and access to care).In global health,comparable national estimates are used(e.g.“Global Burden of Diseases”(GBD)and risk predictors for health risk evaluation).In relation to global pricing,the agenda refers to“Universal Health Coverage”(UHC),to accelerate access to affordable medical services in different regions of the world.Additional economic and financial information on populations with methodologies such as Hierarchical Bayesian Modeling(HBM)and its countervailing use(e.g.,physicians reversed conjoint models,Huttin,2017),with trained models on bigger samples and comprehensive user cases,contributes to structuring the pathway to transformative changes.展开更多
This study aims to construct a virtual twin testing framework for the safety of the intended functionality of intelligent connected vehicles to address the safety requirements of intelligent driving and transportation...This study aims to construct a virtual twin testing framework for the safety of the intended functionality of intelligent connected vehicles to address the safety requirements of intelligent driving and transportation systems.The research methods include the construction of a theoretical model of safety for intelligent connected vehicles based on the concept of virtual twins,the correlation study between key concepts and functional safety,and the application research of virtual twin technology in the safety testing of intelligent connected vehicles.The results reveal that the virtual twin testing framework can effectively enhance the functional safety of intelligent connected vehicles,reduce development costs,and shorten the product launch cycle.The conclusion suggests that this framework provides strong support for the healthy development of the intelligent connected vehicle industry and has a positive impact on the safety and efficiency of intelligent transportation systems.展开更多
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
基金the financial support from National Natural Science Foundation of China (No. 21503097)Postgraduate Research & Practice Innovation Program of Jiangsu Province (No. KYCX23_3905)。
文摘Metal-organic framework(MOF) has been widely applied in photocatalysis, which is significant for addressing energy crises and environmental issues. Based on density functional theory calculations,the performances of Cu-BTC, a copper-based MOF, and its derivatives Cu TM-BTC via the substitution of transition metal(TM) elements at the Cu site for photocatalytic overall water splitting(POWS) have been studied. POWS of Cu-BTC suffers from the sluggish hydrogen evolution reaction due to the large overpotential of 2.02 V and limited solar utilization due to a wide HOMO-LUMO gap of 4.11 e V. Via TM substitution, the HOMO-LUMO gap narrows but still satisfies the redox potentials when taken 3d-TM of Cr, Fe, Co or Ni, 4d-TM of Rh or Pd, or 5d-TM of Re or Pt into consideration, benefiting for the light absorption. Furthermore, Cr and Re could serve as active sites for hydrogen evolution with remarkably lowered overpotentials of 0.79 V and 0.28 V, respectively;similarly, oxygen evolution activities could be enhanced by Fe, Co and Rh because of their reduced overpotentials which are less than 0.5 V. Therefore,our findings pave guidance for designing Cu-BTC derivatives in overall water splitting.
基金financially supported by the Fundamental Research Funds for the Central Public Welfare Research Institute of Chinese Research Academy of Environmental Sciences[grant number 2012YSKY17]
文摘Based on the meaning of economic theory as well as analysis of relevant characteristics of watershed environmental management,a watershed environmental management framework will be created,with building systems of theory,principles,methods,and supporting measures.Through the general structure,the watershed environmental management system design can be explored to optimize the allocation of resources and achieve coordinated development of watershed economic growth and environmental protection.
文摘This paper focuses on C-K theory with its application to expand the scope of innovative solutions to transform health systems.The previous paper(Huttin,2024)provided a review of main design theories and a description of the research process and interactions between investigators for physicians’choice models using random price generators.The selection of alternatives for that user case mainly related to medical policy problems(e.g.Huttin&Hausman,2021).However,such experimental studies require scaling up for bigger samples and therefore comprehensive user cases,to be useful for transformative tools in health system reforms.The use of C-K theory(Hatchuel&Weil,2002)may be a useful framework to generate data elements on economic and financial information,from conversation of care,and expand the dataspace,with innovative applications of the algorithms(as proposed in Prof.Huttin’s studies).The development of such economic models will impact the architecture of national or international accounting systems;therefore,they may require the design of ad hoc or satellite health accounts with such additional type of information.However,the architecture of health accounts is more driven by environmental communities who dominate methodological advances(e.g.agriculture,forestry management,etc.);modeling techniques in international health accounting generate specific tracers to integrate in aggregate indexes.Such development of the K space may be used for the health targets under the global agenda(e.g.SDGs).The statistical methods used to transform this K space,their selection process,and the identification of key parameters estimates will determine to a certain extent the transformation of health systems and will nurture the C concepts(e.g.more justice in reallocation of services and access to care).In global health,comparable national estimates are used(e.g.“Global Burden of Diseases”(GBD)and risk predictors for health risk evaluation).In relation to global pricing,the agenda refers to“Universal Health Coverage”(UHC),to accelerate access to affordable medical services in different regions of the world.Additional economic and financial information on populations with methodologies such as Hierarchical Bayesian Modeling(HBM)and its countervailing use(e.g.,physicians reversed conjoint models,Huttin,2017),with trained models on bigger samples and comprehensive user cases,contributes to structuring the pathway to transformative changes.
文摘This study aims to construct a virtual twin testing framework for the safety of the intended functionality of intelligent connected vehicles to address the safety requirements of intelligent driving and transportation systems.The research methods include the construction of a theoretical model of safety for intelligent connected vehicles based on the concept of virtual twins,the correlation study between key concepts and functional safety,and the application research of virtual twin technology in the safety testing of intelligent connected vehicles.The results reveal that the virtual twin testing framework can effectively enhance the functional safety of intelligent connected vehicles,reduce development costs,and shorten the product launch cycle.The conclusion suggests that this framework provides strong support for the healthy development of the intelligent connected vehicle industry and has a positive impact on the safety and efficiency of intelligent transportation systems.
文摘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.
