The global energy transition is a widespread phenomenon that requires international exchange of experiences and mutual learning.Germany’s success in its first phase of energy transition can be attributed to its adopt...The global energy transition is a widespread phenomenon that requires international exchange of experiences and mutual learning.Germany’s success in its first phase of energy transition can be attributed to its adoption of smart energy technology and implementation of electricity futures and spot marketization,which enabled the achievement of multiple energy spatial–temporal complementarities and overall grid balance through energy conversion and reconversion technologies.While China can draw from Germany’s experience to inform its own energy transition efforts,its 11-fold higher annual electricity consumption requires a distinct approach.We recommend a clean energy system based on smart sector coupling(ENSYSCO)as a suitable pathway for achieving sustainable energy in China,given that renewable energy is expected to guarantee 85%of China’s energy production by 2060,requiring significant future electricity storage capacity.Nonetheless,renewable energy storage remains a significant challenge.We propose four large-scale underground energy storage methods based on ENSYSCO to address this challenge,while considering China’s national conditions.These proposals have culminated in pilot projects for large-scale underground energy storage in China,which we believe is a necessary choice for achieving carbon neutrality in China and enabling efficient and safe grid integration of renewable energy within the framework of ENSYSCO.展开更多
Transition metal nitrides(TMN)have recently grabbed immensely appealing as ideal active materials in energy storage and catalysis fields on account of their remarkable electrical conductivity,excellent chemical stabil...Transition metal nitrides(TMN)have recently grabbed immensely appealing as ideal active materials in energy storage and catalysis fields on account of their remarkable electrical conductivity,excellent chemical stability,wide band gap and tunable morphology.Both pure TMN and TMN-based materials have been extensively studied concerned with their preparation approaches,nanostructures,and favored performance in various applications.However,the processes towards synthesis of TMN are numerous and complex.Choosing appropriate method to obtain target TMN with desired structure is crucial,which further affects its practical application performance.Herein,this review offers a timely and comprehensive summary of the synthetic ways to TMN and their application in energy related domains.The synthesis section is categorized into in-situ and ex-situ based on where the N element in TMN origins from.Then,overviews on the energy related applications including energy storage,electrocatalysis and photocatalysis are discussed.In the end,the problems to be solved and the development trend of the synthesis and application of transition metal nitrides are prospected.展开更多
At present,with the steady development of the global economy,more and more countries begin to pay attention to the impact of ecological environment on economic development and human society,so the ecological environme...At present,with the steady development of the global economy,more and more countries begin to pay attention to the impact of ecological environment on economic development and human society,so the ecological environment has become a global issue that cannot be ignored in today’s era.Therefore,from the perspective of the ecological philosophy of Diversity&Harmony as well as Interaction&Co-existence,this paper will conduct ecological discourse analysis on the Energy in China’s New Era based on the transitivity system of systemic-functional grammar,and use the Corpus analysis software UAM Corpus Tool 3.3x to label and make statistics on the transitivity system,aiming to explore the distribution characteristics of the transitivity system in this white paper.Through the transitivity analysis of the white paper,this study helps readers to have a deeper understanding of the positive significance contained in the white paper.To a certain extent,it enables readers at home and abroad to understand China’s stance on energy issues and the positive image of China in energy ecology.It also awaken readers’awareness of environmental protection and acquire good habits of resource conservation to be in harmony between human and nature for sustainable development.展开更多
As a major solution to climate change,the low-carbon transition of energy systems has received growing attention in the past decade.This paper presents a bibliometric review of the literature on the low-carbon transit...As a major solution to climate change,the low-carbon transition of energy systems has received growing attention in the past decade.This paper presents a bibliometric review of the literature on the low-carbon transition of energy systems from an engineering management perspective.First,the definition and boundaries of the energy system transition are clarified,covering transformation of the energy structure,decarbonization of fossil fuel utilization,and improvement in energy efficiency.Second,a systematic search of the related literature and a bibliometric analysis are conducted to reveal the research trends.It is found that the number of related publications has been growing exponentially during the past decade,with researchers from China,the United Kingdom,the United States,Germany,and the Netherlands comprising the majority of authors.Related studies with interdisciplinary characteristics appear in journals focusing on energy engineering,environmental science,and social science related to energy issues.Four major research themes are identified by clustering the existing literature:(1)low-carbon transition pathways with different spatiotemporal scales and transition constraints;(2)low-carbon technology diffusion with a focus on renewable energy technologies,pollution control technologies,and other technologies facilitating the energy transition;(3)infrastructure network planning for energy systems covering various sectors and regions;and(4)transition-driving mechanisms from the political,economic,social,and natural perspectives.These four topics play distinct but mutually supportive roles in facilitating the low-carbon transition of energy systems,and require more in-depth research on designing resilient low-carbon transition pathways with coordinated goals,promoting low-carbon technologies with cost-effective and reliable infrastructure network deployment,and balancing multi-level risks in various systems.Finally,business models,nongovernment actors,energy justice,deep decarbonization,and zero-energy buildings are recognized as emerging hot topics.展开更多
To reduce the adverse effects of traditional domestic solid fuel,the central government began implementing a clean heating policy in northern China in 2017.Clean coal is an alternative low-cost fuel for rural househol...To reduce the adverse effects of traditional domestic solid fuel,the central government began implementing a clean heating policy in northern China in 2017.Clean coal is an alternative low-cost fuel for rural households at the present stage.In this study,18 households that used lump coal,biomass,and clean coal as the main fuel were selected to evaluate the benefits of clean heating transformation in Tongchuan,an energy city in the Fenwei Plain,China.Both indoor and personal exposure(PE)samples of fine particulate matter(PM_(2.5))were synchronically collected.Compared with the lump coal and biomass groups,the indoor PM_(2.5)concentration in the clean coal group is 43.6%and 20.0%lower,respectively,while the values are 16.8%and 21.3%lower,respectively,in the personal exposure samples.PM_(2.5)-bound elements Cd,Ni,Zn,and Mn strongly correlated with reactive oxygen species(ROS)levels in all fuel groups,indicating that transition metals are the principal components to generate oxidative stress.Using a reliable estimation method,it is predicted that after the substitution of clean coal as a household fuel,the all-cause,cardiovascular,and respiratory disease that causes female deaths per year could be reduced by 16,6,and 3,respectively,in the lump coal group,and 22,8,and 3,respectively,in the biomass group.Even though the promotion of clean coal has led to impressive environmental and health benefits,the efficiencies are still limited.More environmental-friendly energy sources must be promoted in the rural regions of China.展开更多
Atomic radiative data such as excitation energies, transition wavelengths, radiative rates, and level lifetimes with high precision are the essential parameters for the abundance analysis, simulation, and diagnostics ...Atomic radiative data such as excitation energies, transition wavelengths, radiative rates, and level lifetimes with high precision are the essential parameters for the abundance analysis, simulation, and diagnostics in fusion and astrophysical plasmas. In this work, we mainly focus on reviewing our two projects performed in the past decade. One is about the ions with Z■30 that are generally of astrophysical interest, and the other one is about the highly charged krypton(Z = 36)and tungsten(Z = 74) ions that are relevant in research of magnetic confinement fusion. Two different and independent methods, namely, multiconfiguration Dirac–Hartree–Fock(MCDHF) and the relativistic many-body perturbation theory(RMBPT) are usually used in our studies. As a complement/extension to our previous works for highly charged tungsten ions with open M-shell and open N-shell, we also mainly focus on presenting and discussing our complete RMBPT and MCDHF calculations for the excitation energies, wavelengths, electric dipole(E1), magnetic dipole(M1), electric quadrupole(E2), and magnetic quadrupole(M2) transition properties, and level lifetimes for the lowest 148 levels belonging to the 3l3configurations in Al-like W61+. We also summarize the uncertainties of our systematical theoretical calculations, by cross-checking/validating our datasets from our RMBPT and MCDHF calculations, and by detailed comparisons with available accurate observations and other theoretical calculations. The data are openly available in Science Data Bank at https://doi.org/10.57760/sciencedb.10569.展开更多
This paper describes the phase-transition energies from published loading curves on the basis of the physically deduced F<sub>N</sub> = k-h<sup>3/2</sup> law that does not violate the energy la...This paper describes the phase-transition energies from published loading curves on the basis of the physically deduced F<sub>N</sub> = k-h<sup>3/2</sup> law that does not violate the energy law by assuming h<sup>2</sup> instead, as still do ISO-ASTM 14,577 standards. This law is valid for all materials and all “one-point indentation” temperatures. It detects initial surface effects and phase-transition kink-unsteadiness. Why is that important? The mechanically induced phase-transitions form polymorph interfaces with increased risk of crash nucleation for example at the pickle forks of airliners. After our published crashing risk, as nucleated within microscopic polymorph-interfaces via pre-cracks, had finally appeared (we presented microscopic images (5000×) from a model system), 550 airliners were all at once grounded for 18 months due to such microscopic pre-cracks at their pickle forks (connection device for wing to body). These pre-cracks at phase-transition interfaces were previously not complained at the (semi)yearlycheckups of all airliners. But materials with higher compliance against phase- transitions must be developed for everybody’s safety, most easily by checking with nanoindentations, using their physically correct analyses. Unfortunately, non-physical analyses, as based on the after all incredible exponent 2 on h for the F<sub>N</sub> versus h loading curve are still enforced by ISO-ASTM standards that cannot detect phase-transitions. These standards propagate that all of the force, as applied to the penetrating cone or pyramid shall be used for the depth formation, but not also in part for the pressure to the indenter environment. However, the remaining part of pressure (that was not consumed for migrations, etc.) is always used for the elastic modulus detection routine. That severely violates the energy-law! Furthermore, the now physically analyzed published loading curves contain the phase-transition onsets and energies information, because these old-fashioned authors innocently (?) published (of course correct) experimental loading curves. These follow as ever the physically deduced F<sub>N</sub> = k-h<sup>3/2</sup> relation that does not violate the energy law. Nevertheless, the old-fashioned authors stubbornly assume h<sup>2</sup>instead of h<sup>3/2</sup> as still do ISO-ASTM 14,577 standards according to an Oliver-Pharr publication of 1992 and textbooks. The present work contributes to understanding the temperature dependence of phase-transitions under mechanical load, not only for aviation and space flights, which is important. The physical calculations use exclusively regressions and pure algebra (no iterations, no fittings, and no simulations) in a series of straightforward steps by correcting for unavoidable initial effects from the axis cuts of the linear branches from the above equation exhibiting sharp kink unsteadiness at the onset of phase transitions. The test loading curves are from Molybdenum and Al 7075 alloy. The valid published loading curves strictly follow the F<sub>N</sub> = k-h<sup>3/2</sup> relation. Full applied work, conversion work, and conversion work per depth unit show reliable overall comparable order of magnitude values at temperature increase by 150°C (Al 7075) and 980°C (Mo) when also considering different physical hardnesses and penetration depths. It turns out how much the normalized endothermic phase-transition energy decreases upon temperature increase. For the only known 1000°C indentation we provide reason that the presented loading curves changes are only to a minor degree caused by the thermal expansion. The results with Al 7075 up to 170°C are successfully compared. Al 7075 alloy is also checked by indentation with liquid nitrogen cooling (77 K). It gives two endothermic and one very prominent exothermic phase transition with particularly high normalized phase-transition energy. This indentation loading curve at liquid nitrogen temperature reveals epochal novelties. The energy requiring endothermic phase transitions (already seen at 20°C and above) at 77 K is shortly after the start of the second polymorph (sharply at 19.53 N loading force) followed by a strongly exothermic phase-transition by producing (that is losing) energy-content. Both processes at 77 K are totally unexpected. The produced energy per depth unit is much higher energy than the one required for the previous endothermic conversions. This exothermic phase-transition profits from the inability to provide further energy for the formation of the third polymorph as endothermic obtained at 70°C and above. That is only possible because the very cold crystal can no longer support endothermic events but supports exothermic ones. Both endothermic and exothermic phase-transitions at 77 K under load are unprecedented and were not expected before. While the energetic support at 77 K for endothermic processes under mechanical load is unusual but still understandable (there are also further means to produce lower temperatures). But strongly exothermicphase-transition under mechanical load for the production of new modification with negative energy content (less than the energy content of the ambient polymorph) at very low temperature is an epochal event here on earth. It leads to new global thinking and promises important new applications. The energy content of strongly exothermic transformed material is less than the thermodynamic standard zero energy-content on earth. And it can only be reached when there is no possibility left to produce an endothermic phase-transition. Such less than zero-energy-content materials should be isolated, using appropriate equipment. Their properties must be investigated by chemists, crystallographers, and physicists for cosmological reasons. It could be that such materials will require cooling despite their low energy content (higher stability!) and not survive at ambient temperatures and pressures on earth, but only because we do not know of such negative-energy-content materials with our arbitrary thermodynamic standard zeros on earth. At first one will have to study how far we can go up with temperature for keeping them stable. Thus, the apparently never before considered unprecedented result opens up new thinking for the search of new polymorphs that can, of course, not be reached by heating. Various further applications including cosmology and space flight explorations are profiting from it.展开更多
The transition energies, wavelengths and dipole oscillator strengths of 1s^22p-1s^2nd (3 ≤ n ≤ 9) for Cr^21+ ion are calculated. The fine structure splittings of 1s^2nd (n ≤ 9) states for this ion are also cal...The transition energies, wavelengths and dipole oscillator strengths of 1s^22p-1s^2nd (3 ≤ n ≤ 9) for Cr^21+ ion are calculated. The fine structure splittings of 1s^2nd (n ≤ 9) states for this ion are also calculated. In calculating energy, we have estimated the higher-order relativistic contribution under a hydrogenic approximation. The quantum defect of Rydberg series 1s^2nd is determined according to the quantum defect theory. The results obtained in this paper excellently agree with the experimental data available in the literature. Combining the quantum defect theory with the discrete oscillator strengths, the discrete oscillator strengths for the transitions from initial state 1s^22p to highly excited 1s^2nd states (n ≥ 10) and the oscillator strength density corresponding to the bound-free transitions are obtained.展开更多
When air is pumped in, a tubular balloon initially inflates slightly and homogeneously. A short section of the balloon then forms a bulge, which coexists with the unbulged section of the balloon. As more air is pumped...When air is pumped in, a tubular balloon initially inflates slightly and homogeneously. A short section of the balloon then forms a bulge, which coexists with the unbulged section of the balloon. As more air is pumped in, the bulged section elongates at the expense of the unbulged section, until the entire balloon is bulged. The phenomenon is analogous to the liquid-to-vapor phase transition. Here we study the bulging transition in a dielectric elastomer tube as air is pumped into the balloon and a voltage is applied through the thickness of the membrane. We formulate the condition for coexistent budged and unbulged sections, and identify allowable states set by electrical breakdown and mechanical rupture. We find that the bulging transition dramatically amplifies electromechanical energy conversion. Energy converted in an electromechanical cycle consisting of unbulged and bulged states is thousands of times that in an electromechanical cycle consisting of only unbulged states.展开更多
China’s energy system requires a thorough transformation to achieve carbon neutrality.Here,leveraging the highly acclaimed the Integrated MARKAL-EFOM System model of China(China TIMES)that takes energy,the environmen...China’s energy system requires a thorough transformation to achieve carbon neutrality.Here,leveraging the highly acclaimed the Integrated MARKAL-EFOM System model of China(China TIMES)that takes energy,the environment,and the economy into consideration,four carbon-neutral scenarios are proposed and compared for different emission peak times and carbon emissions in 2050.The results show that China’s carbon emissions will peak at 10.3–10.4 Gt between 2025 and 2030.In 2050,renewables will account for 60%of total energy consumption(calorific value calculation)and 90%of total electricity generation,and the electrification rate will be close to 60%.The energy transition will bring sustained air quality improvement,with an 85%reduction in local air pollutants in 2050 compared with 2020 levels,and an early emission peak will yield more near-term benefits.Early peak attainment requires the extensive deployment of renewables over the next decade and an accelerated phasing out of coal after 2025.However,it will bring benefits such as obtaining better air quality sooner,reducing cumulative CO_(2) emissions,and buying more time for other sectors to transition.The pressure for more ambitious emission reductions in 2050 can be transmitted to the near future,affecting renewable energy development,energy service demand,and welfare losses.展开更多
The transition energies and electric dipole (El) transition rates of the K, L, and M lines in neutral Np have been theoretically determined from the MultiConfiguration Dirac-Fock (MCDF) method. In the calculations...The transition energies and electric dipole (El) transition rates of the K, L, and M lines in neutral Np have been theoretically determined from the MultiConfiguration Dirac-Fock (MCDF) method. In the calculations, the contributions from Breit interaction and quantum electrodynamics (QED) effects (vacuum polarization and self-energy), as well as nu- clear finite mass and volume effects, are taken into account. The calculated transition energies and rates are found to be in good agreement with other experimental and theoretical results. The accuracy of the results is estimated and discussed. Furthermore, we calculated the transition energies of the same lines radiating from the decaying transitions of the K-, L-, and M-shell hole states of Np ions with the charge states Np1+ to Np6+ for the first time. We found that for a specific line, the corresponding transition energies relating to all the Np ions are almost the same; it means the outermost electrons have a very small influence on the inner-shell transition processes.展开更多
A family of 2D transition metal carbides and nitrides known as MXenes has received increasing attention since the discovery of Ti3C2 in 2011. To date, about 30 different MXenes with well-defined structures and propert...A family of 2D transition metal carbides and nitrides known as MXenes has received increasing attention since the discovery of Ti3C2 in 2011. To date, about 30 different MXenes with well-defined structures and properties have been synthesized, and many more are theoretically predicted to exist. Due to the numerous assets including excellent mechanical properties, metallic conductivity,unique in-plane anisotropic structure, tunable band gap, and so on, MXenes rapidly positioned themselves at the forefront of the 2D materials world and have found numerous promising applications. Particular interest is devoted to applications in electrochemical energy storage, whereby 2D MXenes work either as electrodes,additives, separators, or hosts. This review summarizes recent advances in the synthesis, fundamental properties and composites of MXene and highlights the state-of-the-art electrochemical performance of MXene-based electrodes/devices.The progresses in the field of supercapacitors and Li-ion batteries, Li-S batteries, Naand other alkali metal ion batteries are reviewed, and current challenges and new opportunities for MXenes in this surging energy storage field are presented. In the focus of interest is the possibility to boost device-level performance, particularly that of rechargeable batteries, which are of utmost importance in future energy technologies. Very recently, the 2019 Nobel Prize in Chemistry was awarded to the inventors of the Li-ion battery. For sure, this will provide an additional stimulation to study fundamental aspects of electrochemical energy storage.展开更多
In crystals BaFX:Eu^(2+)(X=Cl,Br).there exists configuration interaction between 4f^65d and 4f^65s ex- cited state of Eu^(2+)ion.and it results in the change of relative intensities of d-f and f-f transition.The trans...In crystals BaFX:Eu^(2+)(X=Cl,Br).there exists configuration interaction between 4f^65d and 4f^65s ex- cited state of Eu^(2+)ion.and it results in the change of relative intensities of d-f and f-f transition.The transition ~S_-_2→4f^65d-6s is observed.The variation of F/X atomic ratio between 110/90 and 90/110 does not obvi- ously influence the luminescence of BaFX:Eu^(2-).There is energy transfer between Eu^(2+)(f-f)and Eu^(3+)which coexists in the matrices.展开更多
-The ISO standard 14577 is challenged for its violation of the energy law, its wrong relation of normal force FN with impression depth h, and for its iterative treatments. The solution of this dilemma is the use of sa...-The ISO standard 14577 is challenged for its violation of the energy law, its wrong relation of normal force FN with impression depth h, and for its iterative treatments. The solution of this dilemma is the use of sacrosanct simplest calculation rules for the loading parabola (now FN = kh3/2) giving straight lines for cones, pyramids and wedges. They provide the physical penetration resistance hardness k with dimension [Nm-3/2] and allow for non-iterative calculations with closed formulas, using simple undeniable calculation rules. The physically correct FN versus h3/2 plot is universally valid. It separates out the most common surface effects and reveals gradients. It provides unmatched precision, including reliability checks of experimental data. Regression analysis of FN versus h3/2 plots reveals eventual unsteadiness kink phase-transition onset with the transition-energy. This is shown for all kinds of solid materials, including salts, silicon, organics, polymers, composites, and superalloys. Exothermic and endothermic single and consecutive multiple phase-transitions with their surface dependence are distinguished and the results compared in 5 Tables. The sharp phase-transition onsets and the transition energies provide unprecedented most important materials’ characteristics that are indispensable for safety reasons. ISO ASTM is thus urged to thoroughly revise ISO 14577 and to work out new standards for the mechanically (also thermally) stressed materials. For example, the constancy of the first phase-transition parameters must be controlled, and materials must only be admitted for maximal forces well below the first phase-transition onset. Such onset loads can now be easily calculated. The nevertheless repeated oppositions against the physical analysis of indentations rest on incredibly poor knowledge of basic mathematics, errors that are uncovered. The safety aspects caused by the present unphysical materials’ parameters are discussed.展开更多
This paper provides a theoretical model to explain the causality between China's energy transition and capital deepening found by the empirical study.We prove that in the equilibrium,China's energy transition ...This paper provides a theoretical model to explain the causality between China's energy transition and capital deepening found by the empirical study.We prove that in the equilibrium,China's energy transition is endogenously determined by capital deepening due to the homogeneity of electricity and the monopolistic competition features of China's electricity market.Price effect,which is the effect of change in relative factor price,will affect energy transition only if the policy intervenes electricity price in terms of the primary sources from which it is generated.We propose that investment can promote energy transition by stimulating capital deepening which is biased to clean energy development.In this regard,our paper provides a new way of thinking for other developing countries to design an effective energy transition policy.展开更多
Non-iterative analysis of indentation results allows for the detection of phase transitions under load and their transition energy. The closed algebraic equations have been deduced on the basis of the physically found...Non-iterative analysis of indentation results allows for the detection of phase transitions under load and their transition energy. The closed algebraic equations have been deduced on the basis of the physically founded normal force ?depth3/2 relation. The precise transition onset position is obtained by linear regression of the FN = kh3/2 plot, where k is the penetration resistance, which also provides the axis cuts of both polymorphs of first order phase transitions. The phase changes can be endothermic or exothermic. They are normalized per μN or mN normal load. The analyses of indentation loading curves with self-similar diamond indenters are used as validity check of the loading curves, also from calibration standards that exhibit previously undetected phase-transitions and are thus incorrect. The phase-transition energies for fused quartz are determined from the loading curves from instrument provider handbooks. The anisotropic behavior of phase transition energies is studied for the first time. Quartz is a useful test object. The reasons for the packing-dependent differences are discussed on the basis of the local crystal structure under and around the inserting tip.展开更多
Thick film of Polystyrene (PS)/CdS semiconducting optical nanocomposite has been synthesized by dispersing nanofiller particles of CdS in PS matrix. The nanostructure of the CdS particles has been ascertained through ...Thick film of Polystyrene (PS)/CdS semiconducting optical nanocomposite has been synthesized by dispersing nanofiller particles of CdS in PS matrix. The nanostructure of the CdS particles has been ascertained through X-ray Diffraction (XRD) and Transmission Electron Microscopy (TEM). Small angle x-ray scattering analysis has been performed in order to ascertain nanocomposite character of the PS/CdS sample. Scanning Electron Microscopy (SEM) analyses of these samples have been carried out to establish the surface morphology. Optical Absorption Spectroscopy is used to measure the energy band gap of PS/CdS nanocomposite by using Tauc relation whereas Transient Plane Source Technique is used for the determination of thermal conductivity of the prepared samples. The phase transition temperature and elastic response of the prepared samples have been ascertained through Dynamic Mechanical Analyzer (DMA). This study reveals that the thermal conductivity, Young’s modulus and the toughness of the material are greatly influenced by the existence of interfacial energetic interaction between dispersed CdS nanofiller particles and matrix of PS.展开更多
The neutrons have been captured by Erbium nuclei which were received by using clinical electron linear accelerator. In this experiment, the possibility of the neutron capture process has been observed because of emitt...The neutrons have been captured by Erbium nuclei which were received by using clinical electron linear accelerator. In this experiment, the possibility of the neutron capture process has been observed because of emitted neutrons appearing in the experimental area. In particular,neutron capture of ^(170)Er nucleus has been observed. After the neutron capture of ^(170)Er nucleus, the unstable ^(171)Er has been formed and decayed into the ^(171)Tm. By using this reaction path, some transition energies of ^(171)Tm obtained from the residual activity measurements and the half-life of ^(171)Er have been determined, and they are in agreement with adopted values in the literature.展开更多
An ab initio calculations on the ground and low-lying excited statesX2∑+,2^2∑+,3^2∑+,1^4∏,2^4∏,1^4∑+,2^4∑+,and 3^4∑+of KBe molecule have been performed using multireference configuration interaction (M...An ab initio calculations on the ground and low-lying excited statesX2∑+,2^2∑+,3^2∑+,1^4∏,2^4∏,1^4∑+,2^4∑+,and 3^4∑+of KBe molecule have been performed using multireference configuration interaction (MRCI) plus Davidsoncorrections (MRCI+Q) approach with all electron basis set aug-cc-pCV5Z-DK for Be and def2-AQZVPP-JKFI for K.3^2∑+,1^4∏,2^4∏,1^4∑+,2^4∑+and3^4∑+states are investigated for the first time. Inner shell electron correlations are computed on the potential energy curves (PECs) calculations. The spectroscopic and molecular parameters are also predicted. In addition, The transition properties including transition dipole moment, Franck-Condon factors qv′v″, Einstein coefficients Av′v″, and the radiative lifetimesτ′for the2^2∑+-X2∑+,3^2∑+-X2∑+,and 2^4∏-1^4∏ transitions are predictedat the same time.展开更多
The essential role of zonal flow in the L-H transition and the suppression of turbulence have been studied with a long range correlation technique using Langmuir probe arrays in EAST tokamak.Two toroidally localized p...The essential role of zonal flow in the L-H transition and the suppression of turbulence have been studied with a long range correlation technique using Langmuir probe arrays in EAST tokamak.Two toroidally localized probe arrays are used to measure the zonal flow during L-H transition and H-L back transition.The energy ratio of the low frequency zonal flow to the total drift wave turbulence is calculated.During ELM-free H mode,the energy ratio is higher than that in L mode,which reveals the important role of zonal flows in regulating turbulence amplitude in L-H transition.展开更多
基金Henan Institute for Chinese Development Strategy of Engineering&Technology(No.2022HENZDA02)the Science&Technology Department of Sichuan Province(No.2021YFH0010)。
文摘The global energy transition is a widespread phenomenon that requires international exchange of experiences and mutual learning.Germany’s success in its first phase of energy transition can be attributed to its adoption of smart energy technology and implementation of electricity futures and spot marketization,which enabled the achievement of multiple energy spatial–temporal complementarities and overall grid balance through energy conversion and reconversion technologies.While China can draw from Germany’s experience to inform its own energy transition efforts,its 11-fold higher annual electricity consumption requires a distinct approach.We recommend a clean energy system based on smart sector coupling(ENSYSCO)as a suitable pathway for achieving sustainable energy in China,given that renewable energy is expected to guarantee 85%of China’s energy production by 2060,requiring significant future electricity storage capacity.Nonetheless,renewable energy storage remains a significant challenge.We propose four large-scale underground energy storage methods based on ENSYSCO to address this challenge,while considering China’s national conditions.These proposals have culminated in pilot projects for large-scale underground energy storage in China,which we believe is a necessary choice for achieving carbon neutrality in China and enabling efficient and safe grid integration of renewable energy within the framework of ENSYSCO.
基金support offered by National Natural Science Foundation of China(NSFC,Grant No.21403091)。
文摘Transition metal nitrides(TMN)have recently grabbed immensely appealing as ideal active materials in energy storage and catalysis fields on account of their remarkable electrical conductivity,excellent chemical stability,wide band gap and tunable morphology.Both pure TMN and TMN-based materials have been extensively studied concerned with their preparation approaches,nanostructures,and favored performance in various applications.However,the processes towards synthesis of TMN are numerous and complex.Choosing appropriate method to obtain target TMN with desired structure is crucial,which further affects its practical application performance.Herein,this review offers a timely and comprehensive summary of the synthetic ways to TMN and their application in energy related domains.The synthesis section is categorized into in-situ and ex-situ based on where the N element in TMN origins from.Then,overviews on the energy related applications including energy storage,electrocatalysis and photocatalysis are discussed.In the end,the problems to be solved and the development trend of the synthesis and application of transition metal nitrides are prospected.
文摘At present,with the steady development of the global economy,more and more countries begin to pay attention to the impact of ecological environment on economic development and human society,so the ecological environment has become a global issue that cannot be ignored in today’s era.Therefore,from the perspective of the ecological philosophy of Diversity&Harmony as well as Interaction&Co-existence,this paper will conduct ecological discourse analysis on the Energy in China’s New Era based on the transitivity system of systemic-functional grammar,and use the Corpus analysis software UAM Corpus Tool 3.3x to label and make statistics on the transitivity system,aiming to explore the distribution characteristics of the transitivity system in this white paper.Through the transitivity analysis of the white paper,this study helps readers to have a deeper understanding of the positive significance contained in the white paper.To a certain extent,it enables readers at home and abroad to understand China’s stance on energy issues and the positive image of China in energy ecology.It also awaken readers’awareness of environmental protection and acquire good habits of resource conservation to be in harmony between human and nature for sustainable development.
基金the financial support provided by the National Natural Science Foundation of China(71934007 and 72004228)。
文摘As a major solution to climate change,the low-carbon transition of energy systems has received growing attention in the past decade.This paper presents a bibliometric review of the literature on the low-carbon transition of energy systems from an engineering management perspective.First,the definition and boundaries of the energy system transition are clarified,covering transformation of the energy structure,decarbonization of fossil fuel utilization,and improvement in energy efficiency.Second,a systematic search of the related literature and a bibliometric analysis are conducted to reveal the research trends.It is found that the number of related publications has been growing exponentially during the past decade,with researchers from China,the United Kingdom,the United States,Germany,and the Netherlands comprising the majority of authors.Related studies with interdisciplinary characteristics appear in journals focusing on energy engineering,environmental science,and social science related to energy issues.Four major research themes are identified by clustering the existing literature:(1)low-carbon transition pathways with different spatiotemporal scales and transition constraints;(2)low-carbon technology diffusion with a focus on renewable energy technologies,pollution control technologies,and other technologies facilitating the energy transition;(3)infrastructure network planning for energy systems covering various sectors and regions;and(4)transition-driving mechanisms from the political,economic,social,and natural perspectives.These four topics play distinct but mutually supportive roles in facilitating the low-carbon transition of energy systems,and require more in-depth research on designing resilient low-carbon transition pathways with coordinated goals,promoting low-carbon technologies with cost-effective and reliable infrastructure network deployment,and balancing multi-level risks in various systems.Finally,business models,nongovernment actors,energy justice,deep decarbonization,and zero-energy buildings are recognized as emerging hot topics.
基金supported by the National Natural Science Foundation of China(Grant Nos.41877376 and 41877404)the open fund of the State Key Laboratory of Loess and Quaternary Geology,Institute of Earth Environm ent,Chinese Academy of Sciences(SKLLQG2110)。
文摘To reduce the adverse effects of traditional domestic solid fuel,the central government began implementing a clean heating policy in northern China in 2017.Clean coal is an alternative low-cost fuel for rural households at the present stage.In this study,18 households that used lump coal,biomass,and clean coal as the main fuel were selected to evaluate the benefits of clean heating transformation in Tongchuan,an energy city in the Fenwei Plain,China.Both indoor and personal exposure(PE)samples of fine particulate matter(PM_(2.5))were synchronically collected.Compared with the lump coal and biomass groups,the indoor PM_(2.5)concentration in the clean coal group is 43.6%and 20.0%lower,respectively,while the values are 16.8%and 21.3%lower,respectively,in the personal exposure samples.PM_(2.5)-bound elements Cd,Ni,Zn,and Mn strongly correlated with reactive oxygen species(ROS)levels in all fuel groups,indicating that transition metals are the principal components to generate oxidative stress.Using a reliable estimation method,it is predicted that after the substitution of clean coal as a household fuel,the all-cause,cardiovascular,and respiratory disease that causes female deaths per year could be reduced by 16,6,and 3,respectively,in the lump coal group,and 22,8,and 3,respectively,in the biomass group.Even though the promotion of clean coal has led to impressive environmental and health benefits,the efficiencies are still limited.More environmental-friendly energy sources must be promoted in the rural regions of China.
基金the support from the National Natural Science Foundation of China (Grant Nos. 12074081 and 12104095)。
文摘Atomic radiative data such as excitation energies, transition wavelengths, radiative rates, and level lifetimes with high precision are the essential parameters for the abundance analysis, simulation, and diagnostics in fusion and astrophysical plasmas. In this work, we mainly focus on reviewing our two projects performed in the past decade. One is about the ions with Z■30 that are generally of astrophysical interest, and the other one is about the highly charged krypton(Z = 36)and tungsten(Z = 74) ions that are relevant in research of magnetic confinement fusion. Two different and independent methods, namely, multiconfiguration Dirac–Hartree–Fock(MCDHF) and the relativistic many-body perturbation theory(RMBPT) are usually used in our studies. As a complement/extension to our previous works for highly charged tungsten ions with open M-shell and open N-shell, we also mainly focus on presenting and discussing our complete RMBPT and MCDHF calculations for the excitation energies, wavelengths, electric dipole(E1), magnetic dipole(M1), electric quadrupole(E2), and magnetic quadrupole(M2) transition properties, and level lifetimes for the lowest 148 levels belonging to the 3l3configurations in Al-like W61+. We also summarize the uncertainties of our systematical theoretical calculations, by cross-checking/validating our datasets from our RMBPT and MCDHF calculations, and by detailed comparisons with available accurate observations and other theoretical calculations. The data are openly available in Science Data Bank at https://doi.org/10.57760/sciencedb.10569.
文摘This paper describes the phase-transition energies from published loading curves on the basis of the physically deduced F<sub>N</sub> = k-h<sup>3/2</sup> law that does not violate the energy law by assuming h<sup>2</sup> instead, as still do ISO-ASTM 14,577 standards. This law is valid for all materials and all “one-point indentation” temperatures. It detects initial surface effects and phase-transition kink-unsteadiness. Why is that important? The mechanically induced phase-transitions form polymorph interfaces with increased risk of crash nucleation for example at the pickle forks of airliners. After our published crashing risk, as nucleated within microscopic polymorph-interfaces via pre-cracks, had finally appeared (we presented microscopic images (5000×) from a model system), 550 airliners were all at once grounded for 18 months due to such microscopic pre-cracks at their pickle forks (connection device for wing to body). These pre-cracks at phase-transition interfaces were previously not complained at the (semi)yearlycheckups of all airliners. But materials with higher compliance against phase- transitions must be developed for everybody’s safety, most easily by checking with nanoindentations, using their physically correct analyses. Unfortunately, non-physical analyses, as based on the after all incredible exponent 2 on h for the F<sub>N</sub> versus h loading curve are still enforced by ISO-ASTM standards that cannot detect phase-transitions. These standards propagate that all of the force, as applied to the penetrating cone or pyramid shall be used for the depth formation, but not also in part for the pressure to the indenter environment. However, the remaining part of pressure (that was not consumed for migrations, etc.) is always used for the elastic modulus detection routine. That severely violates the energy-law! Furthermore, the now physically analyzed published loading curves contain the phase-transition onsets and energies information, because these old-fashioned authors innocently (?) published (of course correct) experimental loading curves. These follow as ever the physically deduced F<sub>N</sub> = k-h<sup>3/2</sup> relation that does not violate the energy law. Nevertheless, the old-fashioned authors stubbornly assume h<sup>2</sup>instead of h<sup>3/2</sup> as still do ISO-ASTM 14,577 standards according to an Oliver-Pharr publication of 1992 and textbooks. The present work contributes to understanding the temperature dependence of phase-transitions under mechanical load, not only for aviation and space flights, which is important. The physical calculations use exclusively regressions and pure algebra (no iterations, no fittings, and no simulations) in a series of straightforward steps by correcting for unavoidable initial effects from the axis cuts of the linear branches from the above equation exhibiting sharp kink unsteadiness at the onset of phase transitions. The test loading curves are from Molybdenum and Al 7075 alloy. The valid published loading curves strictly follow the F<sub>N</sub> = k-h<sup>3/2</sup> relation. Full applied work, conversion work, and conversion work per depth unit show reliable overall comparable order of magnitude values at temperature increase by 150°C (Al 7075) and 980°C (Mo) when also considering different physical hardnesses and penetration depths. It turns out how much the normalized endothermic phase-transition energy decreases upon temperature increase. For the only known 1000°C indentation we provide reason that the presented loading curves changes are only to a minor degree caused by the thermal expansion. The results with Al 7075 up to 170°C are successfully compared. Al 7075 alloy is also checked by indentation with liquid nitrogen cooling (77 K). It gives two endothermic and one very prominent exothermic phase transition with particularly high normalized phase-transition energy. This indentation loading curve at liquid nitrogen temperature reveals epochal novelties. The energy requiring endothermic phase transitions (already seen at 20°C and above) at 77 K is shortly after the start of the second polymorph (sharply at 19.53 N loading force) followed by a strongly exothermic phase-transition by producing (that is losing) energy-content. Both processes at 77 K are totally unexpected. The produced energy per depth unit is much higher energy than the one required for the previous endothermic conversions. This exothermic phase-transition profits from the inability to provide further energy for the formation of the third polymorph as endothermic obtained at 70°C and above. That is only possible because the very cold crystal can no longer support endothermic events but supports exothermic ones. Both endothermic and exothermic phase-transitions at 77 K under load are unprecedented and were not expected before. While the energetic support at 77 K for endothermic processes under mechanical load is unusual but still understandable (there are also further means to produce lower temperatures). But strongly exothermicphase-transition under mechanical load for the production of new modification with negative energy content (less than the energy content of the ambient polymorph) at very low temperature is an epochal event here on earth. It leads to new global thinking and promises important new applications. The energy content of strongly exothermic transformed material is less than the thermodynamic standard zero energy-content on earth. And it can only be reached when there is no possibility left to produce an endothermic phase-transition. Such less than zero-energy-content materials should be isolated, using appropriate equipment. Their properties must be investigated by chemists, crystallographers, and physicists for cosmological reasons. It could be that such materials will require cooling despite their low energy content (higher stability!) and not survive at ambient temperatures and pressures on earth, but only because we do not know of such negative-energy-content materials with our arbitrary thermodynamic standard zeros on earth. At first one will have to study how far we can go up with temperature for keeping them stable. Thus, the apparently never before considered unprecedented result opens up new thinking for the search of new polymorphs that can, of course, not be reached by heating. Various further applications including cosmology and space flight explorations are profiting from it.
基金supported by the National Natural Science Foundation of China (Grant No 10774063)
文摘The transition energies, wavelengths and dipole oscillator strengths of 1s^22p-1s^2nd (3 ≤ n ≤ 9) for Cr^21+ ion are calculated. The fine structure splittings of 1s^2nd (n ≤ 9) states for this ion are also calculated. In calculating energy, we have estimated the higher-order relativistic contribution under a hydrogenic approximation. The quantum defect of Rydberg series 1s^2nd is determined according to the quantum defect theory. The results obtained in this paper excellently agree with the experimental data available in the literature. Combining the quantum defect theory with the discrete oscillator strengths, the discrete oscillator strengths for the transitions from initial state 1s^22p to highly excited 1s^2nd states (n ≥ 10) and the oscillator strength density corresponding to the bound-free transitions are obtained.
基金supported by ARO(W911NF-09-1-0476)DARPA (W911NF-10-1-0113)+2 种基金MRSECsupported by China Scholarship Council as a visiting scholar for two years at Harvard Universitythe Alexander von Humboldt Foundation for the Humboldt Award
文摘When air is pumped in, a tubular balloon initially inflates slightly and homogeneously. A short section of the balloon then forms a bulge, which coexists with the unbulged section of the balloon. As more air is pumped in, the bulged section elongates at the expense of the unbulged section, until the entire balloon is bulged. The phenomenon is analogous to the liquid-to-vapor phase transition. Here we study the bulging transition in a dielectric elastomer tube as air is pumped into the balloon and a voltage is applied through the thickness of the membrane. We formulate the condition for coexistent budged and unbulged sections, and identify allowable states set by electrical breakdown and mechanical rupture. We find that the bulging transition dramatically amplifies electromechanical energy conversion. Energy converted in an electromechanical cycle consisting of unbulged and bulged states is thousands of times that in an electromechanical cycle consisting of only unbulged states.
基金supported by the National Natural Science Foundation of China (71690243 and 51861135102)the Ministry of Science and Technology of the People’s Republic of China (2018YFC1509006)the World Bank Group (7202065)
文摘China’s energy system requires a thorough transformation to achieve carbon neutrality.Here,leveraging the highly acclaimed the Integrated MARKAL-EFOM System model of China(China TIMES)that takes energy,the environment,and the economy into consideration,four carbon-neutral scenarios are proposed and compared for different emission peak times and carbon emissions in 2050.The results show that China’s carbon emissions will peak at 10.3–10.4 Gt between 2025 and 2030.In 2050,renewables will account for 60%of total energy consumption(calorific value calculation)and 90%of total electricity generation,and the electrification rate will be close to 60%.The energy transition will bring sustained air quality improvement,with an 85%reduction in local air pollutants in 2050 compared with 2020 levels,and an early emission peak will yield more near-term benefits.Early peak attainment requires the extensive deployment of renewables over the next decade and an accelerated phasing out of coal after 2025.However,it will bring benefits such as obtaining better air quality sooner,reducing cumulative CO_(2) emissions,and buying more time for other sectors to transition.The pressure for more ambitious emission reductions in 2050 can be transmitted to the near future,affecting renewable energy development,energy service demand,and welfare losses.
基金Project supported by the National Natural Science Foundation of China (Grant Nos.91126007,11274254,10964010,and 11064012)
文摘The transition energies and electric dipole (El) transition rates of the K, L, and M lines in neutral Np have been theoretically determined from the MultiConfiguration Dirac-Fock (MCDF) method. In the calculations, the contributions from Breit interaction and quantum electrodynamics (QED) effects (vacuum polarization and self-energy), as well as nu- clear finite mass and volume effects, are taken into account. The calculated transition energies and rates are found to be in good agreement with other experimental and theoretical results. The accuracy of the results is estimated and discussed. Furthermore, we calculated the transition energies of the same lines radiating from the decaying transitions of the K-, L-, and M-shell hole states of Np ions with the charge states Np1+ to Np6+ for the first time. We found that for a specific line, the corresponding transition energies relating to all the Np ions are almost the same; it means the outermost electrons have a very small influence on the inner-shell transition processes.
基金support from Empa internal research grantthe SFI-SIRG award under the Agreement Number 18/SIRG/5621+2 种基金National Natural Science Foundation of China(61874166,U1832149)Natural Science Foundation of Gansu province(18JR3RA292)the Fundamental Research Funds for the Central Universities(lzujbky-2017-k21)
文摘A family of 2D transition metal carbides and nitrides known as MXenes has received increasing attention since the discovery of Ti3C2 in 2011. To date, about 30 different MXenes with well-defined structures and properties have been synthesized, and many more are theoretically predicted to exist. Due to the numerous assets including excellent mechanical properties, metallic conductivity,unique in-plane anisotropic structure, tunable band gap, and so on, MXenes rapidly positioned themselves at the forefront of the 2D materials world and have found numerous promising applications. Particular interest is devoted to applications in electrochemical energy storage, whereby 2D MXenes work either as electrodes,additives, separators, or hosts. This review summarizes recent advances in the synthesis, fundamental properties and composites of MXene and highlights the state-of-the-art electrochemical performance of MXene-based electrodes/devices.The progresses in the field of supercapacitors and Li-ion batteries, Li-S batteries, Naand other alkali metal ion batteries are reviewed, and current challenges and new opportunities for MXenes in this surging energy storage field are presented. In the focus of interest is the possibility to boost device-level performance, particularly that of rechargeable batteries, which are of utmost importance in future energy technologies. Very recently, the 2019 Nobel Prize in Chemistry was awarded to the inventors of the Li-ion battery. For sure, this will provide an additional stimulation to study fundamental aspects of electrochemical energy storage.
基金Project supported by the National Natural Science Foundation of China
文摘In crystals BaFX:Eu^(2+)(X=Cl,Br).there exists configuration interaction between 4f^65d and 4f^65s ex- cited state of Eu^(2+)ion.and it results in the change of relative intensities of d-f and f-f transition.The transition ~S_-_2→4f^65d-6s is observed.The variation of F/X atomic ratio between 110/90 and 90/110 does not obvi- ously influence the luminescence of BaFX:Eu^(2-).There is energy transfer between Eu^(2+)(f-f)and Eu^(3+)which coexists in the matrices.
文摘-The ISO standard 14577 is challenged for its violation of the energy law, its wrong relation of normal force FN with impression depth h, and for its iterative treatments. The solution of this dilemma is the use of sacrosanct simplest calculation rules for the loading parabola (now FN = kh3/2) giving straight lines for cones, pyramids and wedges. They provide the physical penetration resistance hardness k with dimension [Nm-3/2] and allow for non-iterative calculations with closed formulas, using simple undeniable calculation rules. The physically correct FN versus h3/2 plot is universally valid. It separates out the most common surface effects and reveals gradients. It provides unmatched precision, including reliability checks of experimental data. Regression analysis of FN versus h3/2 plots reveals eventual unsteadiness kink phase-transition onset with the transition-energy. This is shown for all kinds of solid materials, including salts, silicon, organics, polymers, composites, and superalloys. Exothermic and endothermic single and consecutive multiple phase-transitions with their surface dependence are distinguished and the results compared in 5 Tables. The sharp phase-transition onsets and the transition energies provide unprecedented most important materials’ characteristics that are indispensable for safety reasons. ISO ASTM is thus urged to thoroughly revise ISO 14577 and to work out new standards for the mechanically (also thermally) stressed materials. For example, the constancy of the first phase-transition parameters must be controlled, and materials must only be admitted for maximal forces well below the first phase-transition onset. Such onset loads can now be easily calculated. The nevertheless repeated oppositions against the physical analysis of indentations rest on incredibly poor knowledge of basic mathematics, errors that are uncovered. The safety aspects caused by the present unphysical materials’ parameters are discussed.
文摘This paper provides a theoretical model to explain the causality between China's energy transition and capital deepening found by the empirical study.We prove that in the equilibrium,China's energy transition is endogenously determined by capital deepening due to the homogeneity of electricity and the monopolistic competition features of China's electricity market.Price effect,which is the effect of change in relative factor price,will affect energy transition only if the policy intervenes electricity price in terms of the primary sources from which it is generated.We propose that investment can promote energy transition by stimulating capital deepening which is biased to clean energy development.In this regard,our paper provides a new way of thinking for other developing countries to design an effective energy transition policy.
文摘Non-iterative analysis of indentation results allows for the detection of phase transitions under load and their transition energy. The closed algebraic equations have been deduced on the basis of the physically founded normal force ?depth3/2 relation. The precise transition onset position is obtained by linear regression of the FN = kh3/2 plot, where k is the penetration resistance, which also provides the axis cuts of both polymorphs of first order phase transitions. The phase changes can be endothermic or exothermic. They are normalized per μN or mN normal load. The analyses of indentation loading curves with self-similar diamond indenters are used as validity check of the loading curves, also from calibration standards that exhibit previously undetected phase-transitions and are thus incorrect. The phase-transition energies for fused quartz are determined from the loading curves from instrument provider handbooks. The anisotropic behavior of phase transition energies is studied for the first time. Quartz is a useful test object. The reasons for the packing-dependent differences are discussed on the basis of the local crystal structure under and around the inserting tip.
文摘Thick film of Polystyrene (PS)/CdS semiconducting optical nanocomposite has been synthesized by dispersing nanofiller particles of CdS in PS matrix. The nanostructure of the CdS particles has been ascertained through X-ray Diffraction (XRD) and Transmission Electron Microscopy (TEM). Small angle x-ray scattering analysis has been performed in order to ascertain nanocomposite character of the PS/CdS sample. Scanning Electron Microscopy (SEM) analyses of these samples have been carried out to establish the surface morphology. Optical Absorption Spectroscopy is used to measure the energy band gap of PS/CdS nanocomposite by using Tauc relation whereas Transient Plane Source Technique is used for the determination of thermal conductivity of the prepared samples. The phase transition temperature and elastic response of the prepared samples have been ascertained through Dynamic Mechanical Analyzer (DMA). This study reveals that the thermal conductivity, Young’s modulus and the toughness of the material are greatly influenced by the existence of interfacial energetic interaction between dispersed CdS nanofiller particles and matrix of PS.
基金supported by the Sinop University Scientific Research Projects Coordination Unit.Project Number:FEF-1901-14-04,2014
文摘The neutrons have been captured by Erbium nuclei which were received by using clinical electron linear accelerator. In this experiment, the possibility of the neutron capture process has been observed because of emitted neutrons appearing in the experimental area. In particular,neutron capture of ^(170)Er nucleus has been observed. After the neutron capture of ^(170)Er nucleus, the unstable ^(171)Er has been formed and decayed into the ^(171)Tm. By using this reaction path, some transition energies of ^(171)Tm obtained from the residual activity measurements and the half-life of ^(171)Er have been determined, and they are in agreement with adopted values in the literature.
基金Project supported by the National Natural Science Foundation of China(Grant No.11647075)the Scientific Research Fund of Sichuan Provincial Education Department,China(Grant No.14ZB0284)the Scientific Research Key Project of Yibin University,China(Grant No.2013QD09)
文摘An ab initio calculations on the ground and low-lying excited statesX2∑+,2^2∑+,3^2∑+,1^4∏,2^4∏,1^4∑+,2^4∑+,and 3^4∑+of KBe molecule have been performed using multireference configuration interaction (MRCI) plus Davidsoncorrections (MRCI+Q) approach with all electron basis set aug-cc-pCV5Z-DK for Be and def2-AQZVPP-JKFI for K.3^2∑+,1^4∏,2^4∏,1^4∑+,2^4∑+and3^4∑+states are investigated for the first time. Inner shell electron correlations are computed on the potential energy curves (PECs) calculations. The spectroscopic and molecular parameters are also predicted. In addition, The transition properties including transition dipole moment, Franck-Condon factors qv′v″, Einstein coefficients Av′v″, and the radiative lifetimesτ′for the2^2∑+-X2∑+,3^2∑+-X2∑+,and 2^4∏-1^4∏ transitions are predictedat the same time.
基金the EAST team for their support during the experimentssupported by the National Natural Science Foundation of China with Grant Nos.10990210,10990211,11375188,11105144,and 11375053+1 种基金the National Magnetic Confinement Fusion Science Program of China under Contracts Nos.2013GB106002, 2013GB106003the Innovative Program of Development Foundation of Hefei Center for Physical Science and Technology with Grant No.2014FXCX003
文摘The essential role of zonal flow in the L-H transition and the suppression of turbulence have been studied with a long range correlation technique using Langmuir probe arrays in EAST tokamak.Two toroidally localized probe arrays are used to measure the zonal flow during L-H transition and H-L back transition.The energy ratio of the low frequency zonal flow to the total drift wave turbulence is calculated.During ELM-free H mode,the energy ratio is higher than that in L mode,which reveals the important role of zonal flows in regulating turbulence amplitude in L-H transition.