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Can environmental sustainability be decoupled from economic growth? Empirical evidence from Eastern Europe using the common correlated effect mean group test 被引量:1
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作者 Kwaku ADDAI Berna SERENER Dervis KIRIKKALELI 《Regional Sustainability》 2023年第1期68-80,共13页
The European Union(EU) and Organisation for Economic Co-operation and Development(OECD) aim to develop long-term policies for their respective member countries. Having observed increasing dangers to the environment po... The European Union(EU) and Organisation for Economic Co-operation and Development(OECD) aim to develop long-term policies for their respective member countries. Having observed increasing dangers to the environment posed by rising economic growth, they are seeking pathways to enable policy action on economic growth and environmental sustainability. Given the facts in theoretical and empirical studies, this study assessed the validity of the decoupling hypothesis by investigating asymmetricity in the relationship between environmental sustainability and economic growth in nine Eastern European countries from 1998 to 2017 using the cross-section augmented Dickey-Fuller(CADF) unit root, panel corrected standard error(PCSE), common correlated effect mean group(CCEMG), and Dumitrescu Hurlin causality approaches. Both population growth and drinking water are used as controlled variables. The outcomes establish strong cointegration among all the variables of interest. According to the results of CCEMG test, economic growth exerts short-term environmental degradation but has long-term environmental benefits in Eastern Europe;and population growth and drinking water exert a positive effect on environmental sustainability in both the short-and long-run. The results of Dumitrescu Hurlin causality test indicate that environmental sustainability is unidirectionally affected by economic growth. Based on these outcomes, we suggest the following policies:(1) the EU and OECD should implement member-targeted policies on economic growth and fossil-fuel use towards regulating industrial pollution, water use, and population control;and(2) the EU and OECD member countries should invest in environmental technologies through green research and development(R&D) to transform their dirty industrial processes and ensure productive energy use. 展开更多
关键词 Economic growth Environment sustainability Decoupling Carbon emissions Eastern Europe Common correlated effect mean group(CCEMG)test Econometrics Population growth
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Field induced Chern insulating states in twisted monolayer–bilayer graphene
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作者 王政文 韩英卓 +3 位作者 Kenji Watanabe Takashi Taniguchi 姜宇航 毛金海 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第6期69-73,共5页
Unraveling the mechanism underlying topological phases, notably the Chern insulators(Ch Is) in strong correlated systems at the microscopy scale, has captivated significant research interest. Nonetheless, Ch Is harbor... Unraveling the mechanism underlying topological phases, notably the Chern insulators(Ch Is) in strong correlated systems at the microscopy scale, has captivated significant research interest. Nonetheless, Ch Is harboring topological information have not always manifested themselves, owing to the constraints imposed by displacement fields in certain experimental configurations. In this study, we employ density-tuned scanning tunneling microscopy(DT-STM) to investigate the Ch Is in twisted monolayer–bilayer graphene(t MBG). At zero magnetic field, we observe correlated metallic states.While under a magnetic field, a metal–insulator transition happens and an integer Ch I is formed emanating from the filling index s = 3 with a Chern number C = 1. Our results underscore the pivotal role of magnetic fields as a powerful probe for elucidating topological phases in twisted Van der Waals heterostructures. 展开更多
关键词 Chern insulators strong correlation effects two-dimensional van der Waals heterostructure density-tuned scanning tunneling microscopy(DT-STM)
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Velocity Form Calculations of Generalized Oscillator Strengths for 3s→ (3p, 4p, 5p, 6p) Dipole Transitions of Atomic Sodium in Debye Plasma
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作者 Louis Gomis Clement Diatta +4 位作者 Moustapha Sadibou Tall Ibrahima Gueye Faye Rama Gomis Yande Diouf Mamadou Coulibaly 《Open Journal of Applied Sciences》 2024年第6期1512-1529,共18页
In this paper, the generalized oscillator strengths (GOSs) of excitations of atomic sodium from ground state to 2p63s0 (3p, 4p, 5p, 6p) states, immersed in Debye plasma, were calculated by using wavefunctions which we... In this paper, the generalized oscillator strengths (GOSs) of excitations of atomic sodium from ground state to 2p63s0 (3p, 4p, 5p, 6p) states, immersed in Debye plasma, were calculated by using wavefunctions which were obtained numerically from the restricted Hartree-Fock (RHF) equation. This RHF equation employs the local density approach for exchange interactions including plasma Debye screening. Theoretical RHF and random phase approximation with exchange (RPAE) velocity calculations have shown that the GOSs for excitations to 3 s0(3 p,4 p,5 p,6 p)depend on the plasma Debye screening effects, as shown by the reduction in the GOS amplitude with decreasing Debye length λD. The agreement between the present RPAE V results for the transitions 3 s→3 s0(3 p,4 p,5 p)and the length calculations of Martínez-Flores was satisfactory. Correlation effects were found quite to be significant in the vicinity of the maxima of the GOS of the 3 s→3 s0(4 p,5 p,6 p)excitations by using the RPAE V approach. We note the poor influence of many electron correlations on the GOS of (3 s→3 p)transition with the same principal quantum number. Finally, we comment that the RPAE V calculations are useful in investigating electron correlation effects on the transition GOS of atomic sodium planted in Debye plasma. The present velocity results also reveal that the 3 s→3 s0(5p, 6p)transition GOSs tend to be delocalized due to more significant screening effects at Debye lengths λD=20and 30 a.u. for excited subshells 5p and 6p, respectively. We report here novel results of GOS for 3 s→3 s06ptransition obtained from different Debye lengths. 展开更多
关键词 Plasma Screening effect Correlation effect Sodium Atomic Velocity Form GOS Restricted Hatree-Fock Random Phase Approximation with Exchange
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Correlation effects on the fine-structure splitting within the 3d9 ground configuration in highly-charged Co-like ions
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作者 郭学玲 黄敏 +4 位作者 颜君 李双 王凯 司然 陈重阳 《Chinese Physics B》 SCIE EI CAS CSCD 2016年第1期535-542,共8页
A comprehensive theoretical study of correlation effects on the fine-structure splitting within the ground configuration 3d9 of the Co-like HI45+, Ta46+, W47+, and Au52+ ions is performed by employing the multi-co... A comprehensive theoretical study of correlation effects on the fine-structure splitting within the ground configuration 3d9 of the Co-like HI45+, Ta46+, W47+, and Au52+ ions is performed by employing the multi-configuration Dirac-Hartree- Fock method in the active space approximation. It shows that the core-valence correlation with the inner-core 2p electron is more significant than with the outer 3p and 3s electrons, and the correlation with the 2s electron is also noticeable. The core-core correlation seems to be small and can be ignored. The calculated 2D3/2,5/2 splitting energies agree with the recent electron-beam ion-trap measurements [Phys. Rev. A 83 032517 (2011), Eur. Phys. J. D 66 286 (2012)] to within the experimental uncertainties. 展开更多
关键词 correlation effects multi-configuration Dirac-Hartree-Fock method high-Z Co-like ions fine- structure splitting
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Heavy Atom Effect on the First Hyperpolarizabilities of Squaric Acid Homologues Studied by Ab Initio and DFT Methods
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作者 FUWei-Wei ZHOULi-Xin WANHua-Ping 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2004年第5期480-485,共6页
We have calculated the first hyperpolarizabilities of four squaric acid homologue molecules: 3,4-dithiohydroxy-3-cyclobutene-1,2-dione (OSSQ), 3,4-dithiohydroxy-3-cyclobutene-1, 2-dithione (SSSQ), 3,4-dithiohydroxy-3-... We have calculated the first hyperpolarizabilities of four squaric acid homologue molecules: 3,4-dithiohydroxy-3-cyclobutene-1,2-dione (OSSQ), 3,4-dithiohydroxy-3-cyclobutene-1, 2-dithione (SSSQ), 3,4-dithiohydroxy-3-cyclobutene-1,2-diselenone (SeSSQ) and 3,4-dithiohydroxy- 3-cyclobutene-1,2-ditellurone (TeSSQ). The correlation effect was investigated at the second-order Mller-Plesset (MP2) perturbation and density functional theory (DFT) levels. The frequency disper- sion and solvent effect were considered to compare the theoretical values with the experimental observations. Based on all of these studies, it is worthy to point out that the heavy atom effect dis- covered for furan homologues is an influence on the first hyperpolarizabilities of squaric acid homologues. 展开更多
关键词 first hyperpolarizability correlation effect dispersion effect solvent effect
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Analysis of genetic effects and correlations for nutrient quality traits of indica rice in different environments 被引量:9
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作者 SHI Chunhai and ZHU Jun , Agronomy Dept YANG Xiaoe, XUE Jianming , and YU Yonggui, Dept of Soil Sci and Agri Chem, Zhejiang Agri Univ, Hangzhou 310029, China 《Chinese Rice Research Newsletter》 1997年第1期2-4,共3页
Understanding the variation for the expressionof genes in different environments is one of themajor goals in qualitative genetics. In this pa-per, the genetic models for quantitative traitsof endosperm in cereal crops... Understanding the variation for the expressionof genes in different environments is one of themajor goals in qualitative genetics. In this pa-per, the genetic models for quantitative traitsof endosperm in cereal crops were used to eval-uate the seed, cytoplasm and maternal geneticeffects as well as the genotype × environment(GE) interaction effects, and to predict thebreeding value of parents and genotypic corre-lation for nutrient quality traits of indica rice (Oryza sativa L.). 展开更多
关键词 Analysis of genetic effects and correlations for nutrient quality traits of indica rice in different environments
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Capital mobility in Latin American and Caribbean countries: new evidence from dynamic common correlated effects panel data modeling
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作者 Vasudeva N.R.Murthy Natalya Ketenci 《Financial Innovation》 2020年第1期895-911,共17页
This study investigates the degree of capital mobility in a panel of 16 Latin American and 4 Caribbean countries during 1960 to 2017 against the backdrop of the Feldstein-Horioka hypothesis by applying recent panel da... This study investigates the degree of capital mobility in a panel of 16 Latin American and 4 Caribbean countries during 1960 to 2017 against the backdrop of the Feldstein-Horioka hypothesis by applying recent panel data techniques.This is the first study on capital mobility in Latin American and Caribbean countries to employ the recently developed panel data procedure of the dynamic common correlated effects modeling technique of Chudik and Pesaran(J Econ 188:393–420,2015)and the error-correction testing of Gengenbach,Urbain,and Westerlund(Panel error correction testing with global stochastic trends,2008,J Appl Econ 31:982–1004,2016).These approaches address the serious panel data econometric issues of crosssection dependence,slope heterogeneity,nonstationarity,and endogeneity in a multifactor error-structure framework.The empirical findings of this study reveal a low average(mean)savings–retention coefficient for the panel as a whole and for most individual countries,as well as indicating a cointegration relationship between saving and investment ratios.The results indicate that there is a relatively high degree of capital mobility in the Latin American and Caribbean countries in the short run,while the long-run solvency condition is maintained,which is due to reduced frictions in goods and services markets causing increase competition.Increased capital mobility in these countries can promote economic growth and hasten the process of globalization by creating a conducive economic environment for FDI in these countries. 展开更多
关键词 Dynamic common correlated effects Panel-error correction modeling Cross-sectional dependence Unobserved common factors Slope heterogeneity Capital mobility
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Electron Correlation Effects in Polaron-Pair Recombination in Conjugated Polymers
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作者 赵红霞 赵晖 +1 位作者 陈宇光 鄢永红 《Chinese Physics Letters》 SCIE CAS CSCD 2015年第4期85-89,共5页
Within a Su-Schriffer-Heeger model modified to include electron-electron interaction and an external electric field, we investigate the dynamics of oppositely charged polarons in a polymer chain in the presence of bot... Within a Su-Schriffer-Heeger model modified to include electron-electron interaction and an external electric field, we investigate the dynamics of oppositely charged polarons in a polymer chain in the presence of both electron-phonon and electron-electron interactions under the influence of an external electric field. We adopt a multi-configurational time-dependent Hartree-Fock method for the time-dependent Schrodinger equation and the Newtonian equation of motion for a lattice. Our results show that the on-site Coulomb interaction is of fundamental importance and favors the recombination between the pairs of polarons, and the yield of excitons depends crucially on the strength of the on-site Coulomb interaction U. Furthermore, the influence of the nearest neighbor interaction V is also discussed. 展开更多
关键词 Electron Correlation effects in Polaron-Pair Recombination in Conjugated Polymers
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Effect of Electron Correlation and Breit Interaction on Energies, Oscillator Strengths, and Transition Rates for Low-Lying States of Helium
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作者 刘青 李冀光 +1 位作者 王建国 屈一至 《Chinese Physics Letters》 SCIE CAS CSCD 2021年第11期23-29,共7页
The transition energies, E1 transitional oscillator strengths of the spin-allowed as well as the spin-forbidden and the corresponding transition rates, and complete M1, E2, M2 forbidden transition rates for 1s^(2), 1s... The transition energies, E1 transitional oscillator strengths of the spin-allowed as well as the spin-forbidden and the corresponding transition rates, and complete M1, E2, M2 forbidden transition rates for 1s^(2), 1s2s, and 1s2p states of He I, are investigated using the multi-configuration Dirac–Hartree–Fock method. In the subsequent relativistic configuration interaction computations, the Breit interaction and the QED effect are considered as perturbation, separately. Our transition energies, oscillator strengths, and transition rates are in good agreement with the experimental and other theoretical results. As a result, the QED effect is not important for helium atoms, however, the effect of the Breit interaction plays a significant role in the transition energies, the oscillator strengths and transition rates. 展开更多
关键词 QED DIRAC Oscillator Strengths and Transition Rates for Low-Lying States of Helium effect of Electron Correlation and Breit Interaction on Energies
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Correlation between current intensity and effective duration in the treatment of botulinus toxin for cerebral palsy by myoelectricity locating
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作者 Jianjun Liu Shurong Ji Yingyuan Hu Yanchun Li Weihong Wu Huabao Lu Yan Zhang 《Neural Regeneration Research》 SCIE CAS CSCD 2006年第4期361-363,共3页
BACKGROUND: Researches prove that the treatment of cerebral palsy by botulinus toxin (BTX-A) can improve effect and prolong effective duration. Current intensity is the important factor during injection. OBJECTIVE... BACKGROUND: Researches prove that the treatment of cerebral palsy by botulinus toxin (BTX-A) can improve effect and prolong effective duration. Current intensity is the important factor during injection. OBJECTIVE: To observe the changes of motor function and muscular intensity of children with spastic cerebral palsy after injecting BTX-A and analyze correlation between current intensity and effective duration. DESIGN: Cases control trial before and after nerves block SETTING: Capital University of Medical Sciences, China Rehabilitation Research Center PARTICIPANTS: From June 2002 to November 2004, 14 children with spastic cerebral palsy were treated by BTX-A block. All children were hospitalized in the Children Rehabilitation Department of China Rehabilitation Research Center. The children included 9 male and 5 female, and ranged from 4 to 13 years old, and average age was (6±2) years. Muscular tension ranged from grade 1 to grade 3. The diagnosis and the tape of cerebral palsy based on standard of the Fist Nationwide Cerebral Palsy Symposium, and all children were diagnosed with electroencephalogram (EEG), CT and MRI, and permitted by their guardians. METHODS: (1) Locating and calculation: To locate block points by G6805-2A electro-therapeutic apparatus (Shanghai Huayi Electronic Instrument Plant) at the least stimulating current (continuous wave; impulse frequency; 2.667-83.333 Hz; current intensity: 0-6 mA; voltage: 6 V) to touch off muscles contraction. The current intensity of each point was recorded, and the average current intensity of each patient was calculated at the same time. (2) Dose of BTX-A: Basing upon the spastic degree and weight of patients, the dose was made certain: dose (IU)=(scores of Modified Ashworth Scale +2.5) xweight (kg). The number of the block points was in all 4. The dose of injection ranged from 50 IU to 160 IU with the average of (73.6+25.8) IU. The BTX-A was made by Lanzhou Institute of Biological Products, and each bottle contains 100 IU BTX-A. Muscular tension was evaluated by Modified Ashworth Scale. The scale ranged from grade 0 to grade 4, and the scores were from 0 to 4. The higher the scores were, the higher the muscular tension was. (3) Effect: Changes of muscular tension were evaluated by modified Ashworth Scale before and after block. Motor function was evaluated by Physician Rating Scale (PRS) before and after treatment. It contained Gait pattern, Hindfoot (ankle) position (stance-floor contact), Hindfoot position (foot strike), Knee position (degree of recurvation), Crouch and Speed of gait. The scores ranged from 0 to 14. The higher the points were, the better the motor function was. (4) Effective duration: The duration was definited by the recovering of the Modified Ashworth Scale. (5) Statistic analysis: Firstly, the current intensity and the effect duration were analyzed by One-Sample Kolmogorov-Smirnov Test, the current intensity: Z= 0.456, P= 0.985, the effective duration: Z= 0.557, P= 0.915. Both data were normal distribution. Secondly, both data were analyzed by Linear Regression. The efficiency of the BTX-A block was analyzed by paired-samples t test. MAIN OUTCOME MEASURES: (1) Changes of motor function of muscular tension; (2) correlation between current intensity and effective duration. RESULTS: Fourteen children with spastic cerebral palsy were all involved in the final analysis. (1) Therapeutic effect: The average score of Ashworth scale after block was lower than that before block [(1.02±0.34) points vs. (2.12±0.48) points, t= 3.644, P〈 0.01]. The average score of RPS after block was higherthan that before block [(9.75±2.78) points vs. (6.16±0.58) points, t =13.222, P〈 0.01]. (2) Relation between the current intensity and the effective duration: The current intensity was (0.1857±0.0506) mA, and the effective duration was (26.36±4.48) weeks. The current intensity was negative correlation with effective duration (r = -0.775, P = 0.01 ). CONCLUSION: (1) BTX-A occlusion can decrease muscular tension and improve motor function of lower limbs of children with spastic cerebral palsy. (2) The lower the current intensity is, the longer the effective duration is. 展开更多
关键词 Correlation between current intensity and effective duration in the treatment of botulinus toxin for cerebral palsy by myoelectricity locating BTX
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Structural, electronic and magnetic properties of Fe-doped strontium ruthenates
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作者 刘楠 王晓超 司良 《Chinese Physics B》 SCIE EI CAS CSCD 2023年第11期96-104,共9页
By employing a combined approach of density-functional theory(DFT) and dynamical mean-field theory(DMFT) calculations, we examine the structural, electronic, and magnetic characteristics of two distinct strontium ruth... By employing a combined approach of density-functional theory(DFT) and dynamical mean-field theory(DMFT) calculations, we examine the structural, electronic, and magnetic characteristics of two distinct strontium ruthenates: Sr2RuO4,an unconventional superconductor, and the correlated metal SrRuO3, both at 50% Fe-doping level. In both Sr2Fe0.5Ru0.5O4and SrFe0.5Ru0.5O3, the original ruthenium(Ru) and the dopant iron(Fe) atoms adopt 3-dimensional and 2-dimensional G-type structures, respectively. The hybridization between Fe-3d and Ru-4d is comparatively weaker than in other double perovskite systems. The interplay between strong correlations and reduced itinerancy results in significant spin splitting at Fe and Ru sites. Consequently, a charge transfer process, along with the super-exchange effect, leads to antiferromagnetically coupled Fe3+and Ru5+ions and establishes a semiconducting ferrimagnetic order. Subsequent DMFT calculations demonstrate the persistence of the ferrimagnetic order even at room temperature(300 K). These findings align with prior reports on Sr Fe0.5Ru0.5O3, thus reinforcing the notion that 3d–4d transition metal oxides hold considerable promise as candidates for high-performance spintronic devices, such as spin-valve sensors and spintronic giant magnetoresistance devices. 展开更多
关键词 first-principles calculations double perovskites correlation effects dynamical mean-field theory
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A first-principles study of the structural and elastic properties of orthorhombic and tetragonal Ca_3Mn_2O_7 被引量:1
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作者 张玮 童培庆 《Chinese Physics B》 SCIE EI CAS CSCD 2013年第6期465-471,共7页
The structural and elastic properties of multiferroic Ca3Mn2O7 with ferroelectric orthorhombic (O-phase) and paraelectric tetragonal structures (T-phase) have been studied by first-principles calculations within t... The structural and elastic properties of multiferroic Ca3Mn2O7 with ferroelectric orthorhombic (O-phase) and paraelectric tetragonal structures (T-phase) have been studied by first-principles calculations within the generalized gradient approximation (GGA) and the GGA plus Hubbard U approaches (GGA + U). The calculated theoretical structures are in good agreement with the experimental values. The T-phase is found to be antiferromagnetic (AFM) and the AFM O-phase is more stable than the T-phase, which also agree with the experiments. On these bases, the single-crystal elastic constants (Cijs) and elastic properties of polycrystalline aggregates are investigated for the two phases. Our elasticity calculations indicate Ca3Mn2O7 is mechanically stable against volume expansions. The AFM O-phase is found to be a ductile material, while the AFM T-phase shows brittle nature and tends to be elastically isotropic. We also investigate the influence of strong correlation effects on the elastic properties, qualitatively consistent results are obtained in a reasonable range of values of U. Finally, the ionicity is discussed by Bader analysis. Our work provides useful guidance for the experimental elasticity measurements of Ca3Mn2O7, and makes the strain energy calculation in multiferroic Ca3Mn2O7 thin films possible. 展开更多
关键词 elastic constant elastic anisotropy strong correlation effect MULTIFERROIC
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Uncertainty evaluation and correlation analysis of single-particle energies in phenomenological nuclear mean field:an investigation into propagating uncertainties for independent model parameters 被引量:1
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作者 Zhen-Zhen Zhang Hua-Lei Wang +1 位作者 Hai-Yan Meng Min-Liang Liu 《Nuclear Science and Techniques》 SCIE EI CAS CSCD 2021年第2期45-57,共13页
Based on the Monte Carlo approach and conventional error analysis theory,taking the heaviest doubly magic nucleus 208Pb as an example,we first evaluate the propagated uncertainties of universal potential parameters fo... Based on the Monte Carlo approach and conventional error analysis theory,taking the heaviest doubly magic nucleus 208Pb as an example,we first evaluate the propagated uncertainties of universal potential parameters for three typical types of single-particle energy in the phenomenological Woods–Saxon mean field.Accepting the Woods–Saxon modeling with uncorrelated model parameters,we found that the standard deviations of singleparticle energy obtained through the Monte Carlo simulation and the error propagation rules are in good agreement.It seems that the energy uncertainty of the single-particle levels regularly evoluate with certain quantum numbers to a large extent for the given parameter uncertainties.Further,the correlation properties of the single-particle levels within the domain of input parameter uncertainties are statistically analyzed,for example,with the aid of Pearson’s correlation coefficients.It was found that a positive,negative,or unrelated relationship may appear between two selected single-particle levels,which will be extremely helpful for evaluating the theoretical uncertainty related to the single-particle levels(e.g.,K isomer)in nuclear structural calculations. 展开更多
关键词 Uncertainty propagation Correlation effect Woods-Saxon potential
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Preliminary research on the relationship between long-range correlations and predictability 被引量:1
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作者 张志森 龚志强 +2 位作者 支蓉 封国林 胡经国 《Chinese Physics B》 SCIE EI CAS CSCD 2011年第1期23-32,共10页
By establishing the Markov model for a long-range correlated time series (LRCS) and analysing its evolutionary characteristics, this paper defines a physical effective correlation length (ECL) T, which reflects th... By establishing the Markov model for a long-range correlated time series (LRCS) and analysing its evolutionary characteristics, this paper defines a physical effective correlation length (ECL) T, which reflects the predictability of the LRCS. It also finds that the ECL has a better power law relation with the long-range correlated exponent γ of the LRCS: T = Kexp(-γ/0.3) + Y, (0 〈 γ〈 1) the predictability of the LRCS decays exponentially with the increase of γ It is then applied to a daily maximum temperature series (DMTS) recorded at 740 stations in China between the years 1960-2005 and calculates the ECL of the DMTS. The results show the remarkable regional distributive feature that the ECL is about 10-14 days in west, northwest and northern China, and about 5-10 days in east, southeast and southern China. Namely, the predictability of the DMTS is higher in central-west China than in east and southeast China. In addition, the ECL is reduced by 1-8 days in most areas of China after subtracting the seasonal oscillation signal of the DMTS from its original DMTS; however, it is only slightly altered when the decadal linear trend is removed from the original DMTS. Therefore, it is shown that seasonal oscillation is a significant component of daily maximum temperature evolution and may provide a basis for predicting daily maximum temperatures. Seasonal oscillation is also significant for guiding general weather predictions, as well as seasonal weather predictions. 展开更多
关键词 long-range correlation information entropy effective correlation length PREDICTABILITY
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Experimental and calculated momentum densities for the complete valence orbitals of the antimicrobial agent diacetyl
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作者 苏国林 任雪光 +5 位作者 张书锋 宁传刚 周晖 李彬 李桂琴 邓景康 《Chinese Physics B》 SCIE EI CAS CSCD 2005年第10期1966-1973,共8页
The first electronic structural study of the complete valence shell binding energy spectra of the antimicrobial agent diacetyl, encompassing both the outer and inner valence regions, is reported. The binding energy sp... The first electronic structural study of the complete valence shell binding energy spectra of the antimicrobial agent diacetyl, encompassing both the outer and inner valence regions, is reported. The binding energy spectra as well as the individual orbital momentum profiles have been measured by using a high resolution (e, 2e) electron momentum spectrometer (EMS) at an impact energy of 1200eV plus the binding energy, and using symmetric noncoplanar kinematics. The experimental orbital electron momentum profiles are compared with self-consistent field (SCF) theoretical profiles calculated using the Hartree-Fock approximation and Density Functional theory predictions in the target Kohn-Sham approximation which includes some treatment of correlation via the exchange and correlation potentials with a range of basis sets. The pole strengths of the main ionization peaks from the inner valence orbitals are estimated. 展开更多
关键词 DIACETYL ionization energy electron momentum profiles electron correlation effects
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Study of ss-DNA Adsorption and Nano-mechanical Properties on Mica Substrate with Surface Forces Apparatus
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作者 Gui-Bin Shen Ya-Jing Kan +1 位作者 Min-Hua Chen Yun-Fei Chen 《Chinese Journal of Mechanical Engineering》 SCIE EI CAS CSCD 2018年第5期91-98,共8页
Many DNA?based devices need to build stable and controllable DNA films on surfaces. However, the most com?monly used method of film characterization, namely, the probe?like microscopes which may destroy the sample and... Many DNA?based devices need to build stable and controllable DNA films on surfaces. However, the most com?monly used method of film characterization, namely, the probe?like microscopes which may destroy the sample and substrate. Surface Forces Apparatus(SFA) technique, specializing in surface interaction studies, is introduced to investigate the e ects of DNA concentration on the formation of single?stranded DNA(ss?DNA) film. The result demonstrates that 50 ng/μL is the lowest concentration that ss?DNA construct a dense layer on mica. Besides, it is also indicated that at di erent DNA concentrations, ss?DNA exhibit diverse morphology: lying flat on surface at 50 ng/μL while forming bilayer or cross?link at 100 ng/μL, and these ss?DNA structures are stable enough due to the repeatabil?ity even under the load of 15 mN/m. At the same time, an obvious adhesion force is measured:/m at 100 ng/μL, respectively, which is attributed to the ion?correlation e ect. M-6.5 mN/m at 50 ng/μL and-5.3 mNoreover, the atomic force microscopy(AFM) images reveal the entire surface is covered with wormlike ss?DNA and the measured surface roughness(1.8±0.2 nm) also matches well with the film thickness by SFA. The desorption behaviors of ss?DNA layer from mica surface occur by adding sodium salt into gap bu er, which is mainly ascribed to the decreased ion?ion cor?relation force. This paper employing SFA and AFM techniques to characterize the DNA film with flexibility and stable mechanical ability achieved by ion bridging method, is helpful to fabricate the DNA?based devices in nanoscale. 展开更多
关键词 Single?stranded DNA ADSORPTION Nano?mechanical properties Ion?correlation effect Surface forces apparatus
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Excitation and decay dynamics of 1s2s inner-shell double-vacancy states of neon atoms
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作者 丁晓彬 董晨钟 +2 位作者 Fumihiro Koike Takako Kato Stephan Fritzsche 《Chinese Physics B》 SCIE EI CAS CSCD 2008年第2期592-598,共7页
The photo-excitation and Auger decay processes of inner-shell double vacancy states 1s2s2p^6(1,3^S)3s3p of neutral neon atoms have been studied theoretically. Multi-configuration Dirac-Fock (MCDF) calculations hav... The photo-excitation and Auger decay processes of inner-shell double vacancy states 1s2s2p^6(1,3^S)3s3p of neutral neon atoms have been studied theoretically. Multi-configuration Dirac-Fock (MCDF) calculations have been carried out, with electron correlation effects taken into consideration. The relaxation of core and excited orbitals and configuration interaction are found to be crucial to creating the double vacancy states by single photo-absorption. The predominant decay paths for the double vacancy states turn out to be of the LLM Auger decay to 1s 2s^22p^53s(3p), KLL Auger decay to 1s^22s2p^43s3p, and KLM Auger decay to 1s^22p^63s(3p). They lead to further Auger decay, creating the neon ions of multiple charge states. For both double and single vacancy states the spectator type of Auger process is dominated in all the Auger decay processes. Theoretical Anger electron spectra are presented for further investigations, experimental and theoretical. 展开更多
关键词 correlation effects multi-configuration Dirac-Fock (MCDF) method Auger decay
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Filling dependence of correlation exponents and metal-Mott insulator transition in strongly correlated electron systems
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作者 林明喜 祁胜文 《Chinese Physics B》 SCIE EI CAS CSCD 2010年第12期484-488,共5页
Using a universal relation between electron filling factor and ground state energy, this paper studies the dependence of correlation exponents on the electron filling factor of one-dimensional extended Hubbard model i... Using a universal relation between electron filling factor and ground state energy, this paper studies the dependence of correlation exponents on the electron filling factor of one-dimensional extended Hubbard model in a strong coupling regime, and demonstrates that in contrast to the usual Hubbard model (gc = 1/2), the dimensionless coupling strength parameter gc heavily depends on the electron filling, and it has a "particle-hole" symmetry about electron quarter filling point. As increasing the nearest neighbouring repulsive interaction, the single particle spectral weight is transferred from low energy to high energy regimes. Moreover, at electron quarter filling, there is a metal-Mott insulator transition at the strong coupling point gc = 1/4, and this transition is a continuous phase transition. 展开更多
关键词 strong correlation correlation effect correlation exponent correlation function
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Kosterlitz–Thouless transition, spectral property and magnetic moment for a two-dot structure with level difference
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作者 熊永臣 周望怀 +1 位作者 张俊 南楠 《Chinese Physics B》 SCIE EI CAS CSCD 2017年第6期378-383,共6页
By means of the numerical renormalization group method, we study the phase transition, the spectral property, and the temperature-dependent magnetic moment for a parallel double dot system with level difference, where... By means of the numerical renormalization group method, we study the phase transition, the spectral property, and the temperature-dependent magnetic moment for a parallel double dot system with level difference, where the dot energies are kept symmetric to the half-filled level. A Kosterlitz–Thouless(KT) transition between local spin triplet and singlet is found. In the triplet regime, the local spin is partially screened by the conduction leads and spin-1 Kondo effect is realized.While for the singlet, the Kondo peak is strongly suppressed and the magnetic moment decreases to 0 at a definite low temperature. We attribute this KT transition to the breaking of the reflection symmetry, resulting from the difference of the charge occupations of the two dots. To understand this KT transition and related critical phenomena, detailed scenarios are given in the transmission coefficient and the magnetic moment, and an effective Kondo model refers to the RayleighSchrdinger perturbation theory is used. 展开更多
关键词 double dot Structure Kosterlitz-Thouless transition numerical renormalization group strongly correlated effect
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Theoretical study on decay of the 4d core-excited states of Cs Ⅲ
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作者 丁晓彬 董晨钟 Stephan Fritzschec 《Chinese Physics B》 SCIE EI CAS CSCD 2008年第6期2033-2039,共7页
In a recent XUV photoabsorption spectrum of Cs Ⅲ ions by Cummings and O'Sullivan [2001 J. Phys. B 34 199], rather large linewidths were found for the 4d^95s^25p^6 - 4d^105s^25p^5 transition which are quite in disagr... In a recent XUV photoabsorption spectrum of Cs Ⅲ ions by Cummings and O'Sullivan [2001 J. Phys. B 34 199], rather large linewidths were found for the 4d^95s^25p^6 - 4d^105s^25p^5 transition which are quite in disagreement with corresponding quasi-relativistic multiconfiguration Hartree Fock (MCHF) calculation. In the present work, a detailed multiconfiguration Dirac-Fock study has been carried out to explore this discrepancy. Owing to the detailed consideration of electron correlation effects, some ‘forbidden' Auger decay channels, such as 4d^105s^25p^35d and 4d^105s^05p^6, would become ‘open'. As a result, remarkable improvement of the linewidths has been obtained in our calculation. Furthermore, the theoretical Auger spectrum of the 4d^ 95s^25p^6 core-excited states of Cs Ⅲ ions is Riven in the present work. 展开更多
关键词 correlation effects LINEWIDTH Auger decay
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