In the frame of quantum defect theory,the state-testate dielectronic recombination rate coefficients of Fe^(25+) ion are calculated by a simple relativistic configuration interaction *** calculated results are further...
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In the frame of quantum defect theory,the state-testate dielectronic recombination rate coefficients of Fe^(25+) ion are calculated by a simple relativistic configuration interaction *** calculated results are further expressed with a two-parameter fitting formula,and then the dependence of fitting parameters on radiative decay final channel is studied.
In this paper, we apply arbitrary Riemann solvers, which may not satisfy the Maire's requirement, to the Maire's node-based Lagrangian scheme developed in [P. H. Maire et al., SIAM J. Sci. Comput, 29 (2007), 1781-...
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In this paper, we apply arbitrary Riemann solvers, which may not satisfy the Maire's requirement, to the Maire's node-based Lagrangian scheme developed in [P. H. Maire et al., SIAM J. Sci. Comput, 29 (2007), 1781-1824]. In particular, we apply the so-called Multi-Fluid Channel on Averaged Volume (MFCAV) Riemann solver and a Riemann solver that adaptively combines the MFCAV solver with other more dissipative Riemann solvers to the Maire's scheme. It is noted that neither of the two solvers satisfies the Maire's requirement. Numerical experiments are presented to demonstrate that the application of the two Riemann solvers is successful.
Magnons—carriers of spin information—can be controlled by electric fields in the multiferroic BiFeO3 (BFO), a milestone that brings magnons closer to application in future devices. The origin of magnon-spin currents...
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Magnons—carriers of spin information—can be controlled by electric fields in the multiferroic BiFeO3 (BFO), a milestone that brings magnons closer to application in future devices. The origin of magnon-spin currents in BFO, however, is not fully understood due to BFO’s complicated magnetic texture. In this Letter, we present a phenomenological model to elucidate the existence of magnon spin currents in generalized multiferroics by examining the symmetries inherent to their magnetic and polar structures. This model is grounded in experimental data obtained from BFO and its derivatives, which informs the symmetry operations and resultant magnon behavior. By doing so, we address the issue of symmetry-allowed, switchable magnon spin transport in multiferroics, thereby establishing a critical framework for comprehending magnon transport within complex magnetic textures.
Many of our previous studies have discussed the shock response of symmetrical grain boundaries in iron *** this paper, the molecular dynamics simulation of an iron bicrystal containing Σ3 [110] asymmetry tilt grain b...
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Many of our previous studies have discussed the shock response of symmetrical grain boundaries in iron *** this paper, the molecular dynamics simulation of an iron bicrystal containing Σ3 [110] asymmetry tilt grain boundary(ATGB) under shock-loading is performed. We find that the shock response of asymmetric grain boundaries is quite different from that of symmetric grain boundaries. Especially, our simulation proves that shock can induce migration of asymmetric grain boundary in iron. We also find that the shape and local structure of grain boundary(GB) would not be changed during shock-induced migration of Σ3 [110] ATGB, while the phase transformation near the GB could affect migration of GB. The most important discovery is that the shock-induced shear stress difference between two sides of GB is the key factor leading to GB migration. Our simulation involves a variety of piston velocities, and the migration of GB seems to be less sensitive to the piston velocity. Finally, the kinetics of GB migration at lattice level is discussed. Our work firstly reports the simulation of shock-induced grain boundary migration in iron. It is of great significance to the theory of GB migration and material engineering.
Recently synthesized Porous 12-Atom-Wide Armchair Graphene Nanoribbons (12-AGNRs) [Nano Lett. 2024, 24, 10718-10723]exhibit tunable properties through periodic porosity, enabling precise control over their electronic,...
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In this paper the qualitative analysis methods of planar autonomous systems and numerical simu-lation are used to investigate the peaked wave solutions of CH-r equation. Some explicit expressions of peakedsolitary wav...
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In this paper the qualitative analysis methods of planar autonomous systems and numerical simu-lation are used to investigate the peaked wave solutions of CH-r equation. Some explicit expressions of peakedsolitary wave solutions and peaked periodic wave solutions are obtained, and some of their relationships arerevealed. Why peaked points are generated is discussed.
A method to deal with the electron impact excitation cross sections of an atom from low to high incident energies are presented. This method combines the partial wave method and the first Born approximation(FBA), i.e....
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A method to deal with the electron impact excitation cross sections of an atom from low to high incident energies are presented. This method combines the partial wave method and the first Born approximation(FBA), i.e., replacing the several lowest partial wave cross sections of the total cross sections within FBA by the corresponding exact partial wave cross sections. A new set of codes are developed to calculate the FBA partial wave cross sections. Using this method,the convergent e–He collision cross sections of optical-forbidden and optical-allowed transitions at low to high incident energies are obtained. The calculation results demonstrate the validity and efficiency of the method.
Recent experiments observed significant energy transfer in type-II van der Waals(vdW)heterostructures,such as WS_(2)/MoSe_(2),which is surprising due to their staggered band alignment and weak spectral *** this work,w...
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Recent experiments observed significant energy transfer in type-II van der Waals(vdW)heterostructures,such as WS_(2)/MoSe_(2),which is surprising due to their staggered band alignment and weak spectral *** this work,we carry out first-principles calculations to shed light on energy and charge transfer in WS_(2)/MoSe_(2) *** excitonic effect in nonadiabatic electronic dynamics,our first-principles calculations uncover a two-step process in competing energy and charge transfer,unravel their relative efficiencies and explore the means to control their *** both Dexter and Förster mechanisms can be responsible for energy transfer,they are shown to operate at different *** excitonic effect is revealed to drive ultrafast energy and charge transfer in type-II WS_(2)/MoSe_(2) *** work provides a comprehensive picture of exciton dynamics in vdW heterostructures and paves the way for rational design of novel vdW heterostructures for optoelectronic and photovoltaic applications.
First-principles calculations based on the density functional theory were performed to systematically study the electronic properties of the thin film of antimony in(111)*** considering the spin-orbit interaction,for ...
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First-principles calculations based on the density functional theory were performed to systematically study the electronic properties of the thin film of antimony in(111)*** considering the spin-orbit interaction,for stoichiometric surface,the topological states keep robust for six-bilayer case,and can be recovered in the three-bilayer film,which are guaranteed by time-reversal symmetry and inverse *** reduced surface doped by non-magnetic Bi or magnetic Mn atom,localized three-fold symmetric features can be ***,band structures show that the non-trivial topological states stand for non-magnetic substitutional Bi atom,while can be eliminated by adsorbed or substitutional magnetic Mn atom.
In the present paper, we investigate the linear instability and adiabaticity of a dark state during conversion of two species of fermionic atoms to stable molecules through the stimulated Raman adiabatic passage aided...
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In the present paper, we investigate the linear instability and adiabaticity of a dark state during conversion of two species of fermionic atoms to stable molecules through the stimulated Raman adiabatic passage aided by Feshbach resonance. We analytically obtain the regions for the appearance of linear instability. Moreover, taking 40K and 6Li atom molecule conversion systems as examples, we give the unstable regions numerically. We also attempt to obtain the adiabatic criterion for this nonlinear system with classical adiabatic dynamics and study the adibaticity of the dark state with the adiabatic condition.
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