Phase Field Modeling Using PetIGA
Vignal, Philippe
2013-06-01
Phase field modeling has become a widely used framework in the computational material science community. Its ability to model different problems by defining appropriate phase field parameters and relating it to a free energy functional makes it highly versatile. Thermodynamically consistent partial differential equations can then be generated by assuming dissipative dynamics, and setting up the problem as one of minimizing this free energy. The equations are nonetheless challenging to solve, and having a highly efficient and parallel framework to solve them is necessary. In this work, a brief review on phase field models is given, followed by a short analysis of the Phase Field Crystal Model solved with Isogeometric Analysis us- ing PetIGA. We end with an introduction to a new modeling concept, where free energy functions are built with a periodic equilibrium structure in mind.
Anisotropy in wavelet-based phase field models
Korzec, Maciek; Mü nch, Andreas; Sü li, Endre; Wagner, Barbara
2016-01-01
When describing the anisotropic evolution of microstructures in solids using phase-field models, the anisotropy of the crystalline phases is usually introduced into the interfacial energy by directional dependencies of the gradient energy coefficients. We consider an alternative approach based on a wavelet analogue of the Laplace operator that is intrinsically anisotropic and linear. The paper focuses on the classical coupled temperature/Ginzburg--Landau type phase-field model for dendritic growth. For the model based on the wavelet analogue, existence, uniqueness and continuous dependence on initial data are proved for weak solutions. Numerical studies of the wavelet based phase-field model show dendritic growth similar to the results obtained for classical phase-field models.
Anisotropy in wavelet-based phase field models
Korzec, Maciek
2016-04-01
When describing the anisotropic evolution of microstructures in solids using phase-field models, the anisotropy of the crystalline phases is usually introduced into the interfacial energy by directional dependencies of the gradient energy coefficients. We consider an alternative approach based on a wavelet analogue of the Laplace operator that is intrinsically anisotropic and linear. The paper focuses on the classical coupled temperature/Ginzburg--Landau type phase-field model for dendritic growth. For the model based on the wavelet analogue, existence, uniqueness and continuous dependence on initial data are proved for weak solutions. Numerical studies of the wavelet based phase-field model show dendritic growth similar to the results obtained for classical phase-field models.
Preliminary Phase Field Computational Model Development
Energy Technology Data Exchange (ETDEWEB)
Li, Yulan [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Hu, Shenyang Y. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Xu, Ke [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Suter, Jonathan D. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); McCloy, John S. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Johnson, Bradley R. [Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Ramuhalli, Pradeep [Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
2014-12-15
This interim report presents progress towards the development of meso-scale models of magnetic behavior that incorporate microstructural information. Modeling magnetic signatures in irradiated materials with complex microstructures (such as structural steels) is a significant challenge. The complexity is addressed incrementally, using the monocrystalline Fe (i.e., ferrite) film as model systems to develop and validate initial models, followed by polycrystalline Fe films, and by more complicated and representative alloys. In addition, the modeling incrementally addresses inclusion of other major phases (e.g., martensite, austenite), minor magnetic phases (e.g., carbides, FeCr precipitates), and minor nonmagnetic phases (e.g., Cu precipitates, voids). The focus of the magnetic modeling is on phase-field models. The models are based on the numerical solution to the Landau-Lifshitz-Gilbert equation. From the computational standpoint, phase-field modeling allows the simulation of large enough systems that relevant defect structures and their effects on functional properties like magnetism can be simulated. To date, two phase-field models have been generated in support of this work. First, a bulk iron model with periodic boundary conditions was generated as a proof-of-concept to investigate major loop effects of single versus polycrystalline bulk iron and effects of single non-magnetic defects. More recently, to support the experimental program herein using iron thin films, a new model was generated that uses finite boundary conditions representing surfaces and edges. This model has provided key insights into the domain structures observed in magnetic force microscopy (MFM) measurements. Simulation results for single crystal thin-film iron indicate the feasibility of the model for determining magnetic domain wall thickness and mobility in an externally applied field. Because the phase-field model dimensions are limited relative to the size of most specimens used in
Phase Field Modeling Using PetIGA
Vignal, Philippe; Collier, Nathan; Calo, Victor M.
2013-01-01
, and having a highly efficient and parallel framework to solve them is necessary. In this work, a brief review on phase field models is given, followed by a short analysis of the Phase Field Crystal Model solved with Isogeometric Analysis us- ing PetIGA. We
High-performance phase-field modeling
Vignal, Philippe
2015-04-27
Many processes in engineering and sciences involve the evolution of interfaces. Among the mathematical frameworks developed to model these types of problems, the phase-field method has emerged as a possible solution. Phase-fields nonetheless lead to complex nonlinear, high-order partial differential equations, whose solution poses mathematical and computational challenges. Guaranteeing some of the physical properties of the equations has lead to the development of efficient algorithms and discretizations capable of recovering said properties by construction [2, 5]. This work builds-up on these ideas, and proposes novel discretization strategies that guarantee numerical energy dissipation for both conserved and non-conserved phase-field models. The temporal discretization is based on a novel method which relies on Taylor series and ensures strong energy stability. It is second-order accurate, and can also be rendered linear to speed-up the solution process [4]. The spatial discretization relies on Isogeometric Analysis, a finite element method that possesses the k-refinement technology and enables the generation of high-order, high-continuity basis functions. These basis functions are well suited to handle the high-order operators present in phase-field models. Two-dimensional and three dimensional results of the Allen-Cahn, Cahn-Hilliard, Swift-Hohenberg and phase-field crystal equation will be presented, which corroborate the theoretical findings, and illustrate the robustness of the method. Results related to more challenging examples, namely the Navier-Stokes Cahn-Hilliard and a diusion-reaction Cahn-Hilliard system, will also be presented. The implementation was done in PetIGA and PetIGA-MF, high-performance Isogeometric Analysis frameworks [1, 3], designed to handle non-linear, time-dependent problems.
Phase-field model of eutectic growth
International Nuclear Information System (INIS)
Karma, A.
1994-01-01
A phase-field model which describes the solidification of a binary eutectic alloy with a simple symmetric phase diagram is introduced and the sharp-interface limit of this model is explored both analytically and numerically
The phase field technique for modeling multiphase materials
Singer-Loginova, I.; Singer, H. M.
2008-10-01
This paper reviews methods and applications of the phase field technique, one of the fastest growing areas in computational materials science. The phase field method is used as a theory and computational tool for predictions of the evolution of arbitrarily shaped morphologies and complex microstructures in materials. In this method, the interface between two phases (e.g. solid and liquid) is treated as a region of finite width having a gradual variation of different physical quantities, i.e. it is a diffuse interface model. An auxiliary variable, the phase field or order parameter \\phi(\\vec{x}) , is introduced, which distinguishes one phase from the other. Interfaces are identified by the variation of the phase field. We begin with presenting the physical background of the phase field method and give a detailed thermodynamical derivation of the phase field equations. We demonstrate how equilibrium and non-equilibrium physical phenomena at the phase interface are incorporated into the phase field methods. Then we address in detail dendritic and directional solidification of pure and multicomponent alloys, effects of natural convection and forced flow, grain growth, nucleation, solid-solid phase transformation and highlight other applications of the phase field methods. In particular, we review the novel phase field crystal model, which combines atomistic length scales with diffusive time scales. We also discuss aspects of quantitative phase field modeling such as thin interface asymptotic analysis and coupling to thermodynamic databases. The phase field methods result in a set of partial differential equations, whose solutions require time-consuming large-scale computations and often limit the applicability of the method. Subsequently, we review numerical approaches to solve the phase field equations and present a finite difference discretization of the anisotropic Laplacian operator.
Regularity of solutions of a phase field model
Amler, Thomas
2013-01-01
Phase field models are widely-used for modelling phase transition processes such as solidification, freezing or CO2 sequestration. In this paper, a phase field model proposed by G. Caginalp is considered. The existence and uniqueness of solutions are proved in the case of nonsmooth initial data. Continuity of solutions with respect to time is established. In particular, it is shown that the governing initial boundary value problem can be considered as a dynamical system. © 2013 International Press.
A stochastic phase-field model determined from molecular dynamics
von Schwerin, Erik
2010-03-17
The dynamics of dendritic growth of a crystal in an undercooled melt is determined by macroscopic diffusion-convection of heat and by capillary forces acting on the nanometer scale of the solid-liquid interface width. Its modelling is useful for instance in processing techniques based on casting. The phase-field method is widely used to study evolution of such microstructural phase transformations on a continuum level; it couples the energy equation to a phenomenological Allen-Cahn/Ginzburg-Landau equation modelling the dynamics of an order parameter determining the solid and liquid phases, including also stochastic fluctuations to obtain the qualitatively correct result of dendritic side branching. This work presents a method to determine stochastic phase-field models from atomistic formulations by coarse-graining molecular dynamics. It has three steps: (1) a precise quantitative atomistic definition of the phase-field variable, based on the local potential energy; (2) derivation of its coarse-grained dynamics model, from microscopic Smoluchowski molecular dynamics (that is Brownian or over damped Langevin dynamics); and (3) numerical computation of the coarse-grained model functions. The coarse-grained model approximates Gibbs ensemble averages of the atomistic phase-field, by choosing coarse-grained drift and diffusion functions that minimize the approximation error of observables in this ensemble average. © EDP Sciences, SMAI, 2010.
A stochastic phase-field model determined from molecular dynamics
von Schwerin, Erik; Szepessy, Anders
2010-01-01
The dynamics of dendritic growth of a crystal in an undercooled melt is determined by macroscopic diffusion-convection of heat and by capillary forces acting on the nanometer scale of the solid-liquid interface width. Its modelling is useful for instance in processing techniques based on casting. The phase-field method is widely used to study evolution of such microstructural phase transformations on a continuum level; it couples the energy equation to a phenomenological Allen-Cahn/Ginzburg-Landau equation modelling the dynamics of an order parameter determining the solid and liquid phases, including also stochastic fluctuations to obtain the qualitatively correct result of dendritic side branching. This work presents a method to determine stochastic phase-field models from atomistic formulations by coarse-graining molecular dynamics. It has three steps: (1) a precise quantitative atomistic definition of the phase-field variable, based on the local potential energy; (2) derivation of its coarse-grained dynamics model, from microscopic Smoluchowski molecular dynamics (that is Brownian or over damped Langevin dynamics); and (3) numerical computation of the coarse-grained model functions. The coarse-grained model approximates Gibbs ensemble averages of the atomistic phase-field, by choosing coarse-grained drift and diffusion functions that minimize the approximation error of observables in this ensemble average. © EDP Sciences, SMAI, 2010.
Thermodynamically Consistent Algorithms for the Solution of Phase-Field Models
Vignal, Philippe
2016-01-01
of thermodynamically consistent algorithms for time integration of phase-field models. The first part of this thesis focuses on an energy-stable numerical strategy developed for the phase-field crystal equation. This model was put forward to model microstructure
Benchmark problems for numerical implementations of phase field models
International Nuclear Information System (INIS)
Jokisaari, A. M.; Voorhees, P. W.; Guyer, J. E.; Warren, J.; Heinonen, O. G.
2016-01-01
Here, we present the first set of benchmark problems for phase field models that are being developed by the Center for Hierarchical Materials Design (CHiMaD) and the National Institute of Standards and Technology (NIST). While many scientific research areas use a limited set of well-established software, the growing phase field community continues to develop a wide variety of codes and lacks benchmark problems to consistently evaluate the numerical performance of new implementations. Phase field modeling has become significantly more popular as computational power has increased and is now becoming mainstream, driving the need for benchmark problems to validate and verify new implementations. We follow the example set by the micromagnetics community to develop an evolving set of benchmark problems that test the usability, computational resources, numerical capabilities and physical scope of phase field simulation codes. In this paper, we propose two benchmark problems that cover the physics of solute diffusion and growth and coarsening of a second phase via a simple spinodal decomposition model and a more complex Ostwald ripening model. We demonstrate the utility of benchmark problems by comparing the results of simulations performed with two different adaptive time stepping techniques, and we discuss the needs of future benchmark problems. The development of benchmark problems will enable the results of quantitative phase field models to be confidently incorporated into integrated computational materials science and engineering (ICME), an important goal of the Materials Genome Initiative.
Thermodynamically Consistent Algorithms for the Solution of Phase-Field Models
Vignal, Philippe
2016-02-11
Phase-field models are emerging as a promising strategy to simulate interfacial phenomena. Rather than tracking interfaces explicitly as done in sharp interface descriptions, these models use a diffuse order parameter to monitor interfaces implicitly. This implicit description, as well as solid physical and mathematical footings, allow phase-field models to overcome problems found by predecessors. Nonetheless, the method has significant drawbacks. The phase-field framework relies on the solution of high-order, nonlinear partial differential equations. Solving these equations entails a considerable computational cost, so finding efficient strategies to handle them is important. Also, standard discretization strategies can many times lead to incorrect solutions. This happens because, for numerical solutions to phase-field equations to be valid, physical conditions such as mass conservation and free energy monotonicity need to be guaranteed. In this work, we focus on the development of thermodynamically consistent algorithms for time integration of phase-field models. The first part of this thesis focuses on an energy-stable numerical strategy developed for the phase-field crystal equation. This model was put forward to model microstructure evolution. The algorithm developed conserves, guarantees energy stability and is second order accurate in time. The second part of the thesis presents two numerical schemes that generalize literature regarding energy-stable methods for conserved and non-conserved phase-field models. The time discretization strategies can conserve mass if needed, are energy-stable, and second order accurate in time. We also develop an adaptive time-stepping strategy, which can be applied to any second-order accurate scheme. This time-adaptive strategy relies on a backward approximation to give an accurate error estimator. The spatial discretization, in both parts, relies on a mixed finite element formulation and isogeometric analysis. The codes are
Phase field model for the study of boiling
International Nuclear Information System (INIS)
Ruyer, P.
2006-07-01
This study concerns both the modeling and the numerical simulation of boiling flows. First we propose a review concerning nucleate boiling at high wall heat flux and focus more particularly on the current understanding of the boiling crisis. From this analysis we deduce a motivation for the numerical simulation of bubble growth dynamics. The main and remaining part of this study is then devoted to the development and analyze of a phase field model for the liquid-vapor flows with phase change. We propose a thermodynamic quasi-compressible formulation whose properties match the one required for the numerical study envisaged. The system of governing equations is a thermodynamically consistent regularization of the sharp interface model, that is the advantage of the di use interface models. We show that the thickness of the interface transition layer can be defined independently from the thermodynamic description of the bulk phases, a property that is numerically attractive. We derive the kinetic relation that allows to analyze the consequences of the phase field formulation on the model of the dissipative mechanisms. Finally we study the numerical resolution of the model with the help of simulations of phase transition in simple configurations as well as of isothermal bubble dynamics. (author)
Phase-field modeling of corrosion kinetics under dual-oxidants
Wen, You-Hai; Chen, Long-Qing; Hawk, Jeffrey A.
2012-04-01
A phase-field model is proposed to simulate corrosion kinetics under a dual-oxidant atmosphere. It will be demonstrated that the model can be applied to simulate corrosion kinetics under oxidation, sulfidation and simultaneous oxidation/sulfidation processes. Phase-dependent diffusivities are incorporated in a natural manner and allow more realistic modeling as the diffusivities usually differ by many orders of magnitude in different phases. Simple free energy models are then used for testing the model while calibrated free energy models can be implemented for quantitative modeling.
Phase transitions in the random field Ising model in the presence of a transverse field
Energy Technology Data Exchange (ETDEWEB)
Dutta, A.; Chakrabarti, B.K. [Saha Institute of Nuclear Physics, Bidhannagar, Calcutta (India); Stinchcombe, R.B. [Saha Institute of Nuclear Physics, Bidhannagar, Calcutta (India); Department of Physics, Oxford (United Kingdom)
1996-09-07
We have studied the phase transition behaviour of the random field Ising model in the presence of a transverse (or tunnelling) field. The mean field phase diagram has been studied in detail, and in particular the nature of the transition induced by the tunnelling (transverse) field at zero temperature. Modified hyper-scaling relation for the zero-temperature transition has been derived using the Suzuki-Trotter formalism and a modified 'Harris criterion'. Mapping of the model to a randomly diluted antiferromagnetic Ising model in uniform longitudinal and transverse field is also given. (author)
Joshi, Vaibhav; Jaiman, Rajeev K.
2018-05-01
We present a positivity preserving variational scheme for the phase-field modeling of incompressible two-phase flows with high density ratio. The variational finite element technique relies on the Allen-Cahn phase-field equation for capturing the phase interface on a fixed Eulerian mesh with mass conservative and energy-stable discretization. The mass conservation is achieved by enforcing a Lagrange multiplier which has both temporal and spatial dependence on the underlying solution of the phase-field equation. To make the scheme energy-stable in a variational sense, we discretize the spatial part of the Lagrange multiplier in the phase-field equation by the mid-point approximation. The proposed variational technique is designed to reduce the spurious and unphysical oscillations in the solution while maintaining the second-order accuracy of both spatial and temporal discretizations. We integrate the Allen-Cahn phase-field equation with the incompressible Navier-Stokes equations for modeling a broad range of two-phase flow and fluid-fluid interface problems. The coupling of the implicit discretizations corresponding to the phase-field and the incompressible flow equations is achieved via nonlinear partitioned iterative procedure. Comparison of results between the standard linear stabilized finite element method and the present variational formulation shows a remarkable reduction of oscillations in the solution while retaining the boundedness of the phase-indicator field. We perform a standalone test to verify the accuracy and stability of the Allen-Cahn two-phase solver. We examine the convergence and accuracy properties of the coupled phase-field solver through the standard benchmarks of the Laplace-Young law and a sloshing tank problem. Two- and three-dimensional dam break problems are simulated to assess the capability of the phase-field solver for complex air-water interfaces involving topological changes on unstructured meshes. Finally, we demonstrate the phase-field
Phase-field modelling of microstructural evolution and properties
Zhu, Jingzhi
As one of the most powerful techniques in computational materials science, the diffuse-interface phase-field model has been widely employed for simulating various meso-scale microstructural evolution processes. The main purpose of this thesis is to develop a quantitative phase-field model for predicting microstructures and properties in real alloy systems which can be linked to existing thermodynamic/kinetic databases and parameters obtained from experimental measurements or first-principle calculations. To achieve this goal; many factors involved in complicated real systems are investigated, many of which are often simplified or ignored in existing models, e.g. the dependence of diffusional atomic mobility and elastic constants on composition. Efficient numerical techniques must be developed to solve those partial differential equations that are involved in modelling microstructural evolutions and properties. In this thesis, different spectral methods were proposed for the time-dependent phase-field kinetic equations and diffusion equations. For solving the elastic equilibrium equation with the consideration of elastic inhomogeneity, a conjugate gradient method was utilized. The numerical approaches developed were generally found to be more accurate and efficient than conventional approach such as finite difference method. A composition-dependent Cahn-Hilliard equation was solved by using a semi-implicit Fourier-spectral method. It was shown that the morphological evolutions in bulk-diffusion-controlled coarsening and interface-diffusion-controlled developed similar patterns and scaling behaviors. For bulk-diffusion-controlled coarsening, a cubic growth law was obeyed in the scaling regime, whereas a fourth power growth law was observed for interface-diffusion-controlled coarsening. The characteristics of a microstructure under the influence of elastic energy depend on elastic properties such as elastic anisotropy, lattice mismatch, elastic inhomogeneity and
Phase-Field Modeling of Sigma-Phase Precipitation in 25Cr7Ni4Mo Duplex Stainless Steel
Malik, Amer; Odqvist, Joakim; Höglund, Lars; Hertzman, Staffan; Ågren, John
2017-10-01
Phase-field modeling is used to simulate the formation of sigma phase in a model alloy mimicking a commercial super duplex stainless steel (SDSS) alloy, in order to study precipitation and growth of sigma phase under linear continuous cooling. The so-called Warren-Boettinger-McFadden (WBM) model is used to build the basis of the multiphase and multicomponent phase-field model. The thermodynamic inconsistency at the multiple junctions associated with the multiphase formulation of the WBM model is resolved by means of a numerical Cut-off algorithm. To make realistic simulations, all the kinetic and the thermodynamic quantities are derived from the CALPHAD databases at each numerical time step, using Thermo-Calc and TQ-Interface. The credibility of the phase-field model is verified by comparing the results from the phase-field simulations with the corresponding DICTRA simulations and also with the empirical data. 2D phase-field simulations are performed for three different cooling rates in two different initial microstructures. A simple model for the nucleation of sigma phase is also implemented in the first case. Simulation results show that the precipitation of sigma phase is characterized by the accumulation of Cr and Mo at the austenite-ferrite and the ferrite-ferrite boundaries. Moreover, it is observed that a slow cooling rate promotes the growth of sigma phase, while a higher cooling rate restricts it, eventually preserving the duplex structure in the SDSS alloy. Results from the phase-field simulations are also compared quantitatively with the experiments, performed on a commercial 2507 SDSS alloy. It is found that overall, the predicted morphological features of the transformation and the composition profiles show good conformity with the empirical data.
Phase diagram of the mean field model of simplicial gravity
International Nuclear Information System (INIS)
Bialas, P.; Burda, Z.; Johnston, D.
1999-01-01
We discuss the phase diagram of the balls in boxes model, with a varying number of boxes. The model can be regarded as a mean-field model of simplicial gravity. We analyse in detail the case of weights of the form p(q) = q -β , which correspond to the measure term introduced in the simplicial quantum gravity simulations. The system has two phases: elongated (fluid) and crumpled. For β ε (2, ∞) the transition between these two phases is first-order, while for β ε (1, 2) it is continuous. The transition becomes softer when β approaches unity and eventually disappears at β = 1. We then generalise the discussion to an arbitrary set of weights. Finally, we show that if one introduces an additional kinematic bound on the average density of balls per box then a new condensed phase appears in the phase diagram. It bears some similarity to the crinkled phase of simplicial gravity discussed recently in models of gravity interacting with matter fields
Phase field modeling of rapid crystallization in the phase-change material AIST
Tabatabaei, Fatemeh; Boussinot, Guillaume; Spatschek, Robert; Brener, Efim A.; Apel, Markus
2017-07-01
We carry out phase field modeling as a continuum simulation technique in order to study rapid crystallization processes in the phase-change material AIST (Ag4In3Sb67Te26). In particular, we simulate the spatio-temporal evolution of the crystallization of a molten area of the phase-change material embedded in a layer stack. The simulation model is adapted to the experimental conditions used for recent measurements of crystallization rates by a laser pulse technique. Simulations are performed for substrate temperatures close to the melting temperature of AIST down to low temperatures when an amorphous state is involved. The design of the phase field model using the thin interface limit allows us to retrieve the two limiting regimes of interface controlled (low temperatures) and thermal transport controlled (high temperatures) dynamics. Our simulations show that, generically, the crystallization velocity presents a maximum in the intermediate regime where both the interface mobility and the thermal transport, through the molten area as well as through the layer stack, are important. Simulations reveal the complex interplay of all different contributions. This suggests that the maximum switching velocity depends not only on material properties but also on the precise design of the thin film structure into which the phase-change material is embedded.
Numerical approach of multi-field two-phase flow models in the OVAP code
International Nuclear Information System (INIS)
Anela Kumbaro
2005-01-01
Full text of publication follows: A significant progress has been made in modeling the complexity of vapor-liquid two-phase flow. Different three-dimensional models exist in order to simulate the evolution of parameters which characterize a two-phase model. These models can be classified into various groups depending on the inter-field coupling. A hierarchy of increasing physical complexity can be defined. The simplest group corresponds to the homogeneous mixture models where no interactions are taken into account. Another group is constituted by the two-fluid models employing physically important interfacial forces between two-phases, liquid, and water. The last group is multi-field modeling where inter-field couplings can be taken into account at different degrees, such as the MUltiple Size Group modeling [2], the consideration of separate equations for the transport and generation of mass and momentum for each field under the assumption of the same energy for all the fields of the same phase, and a full multi-field two-phase model [1]. The numerical approach of the general three-dimensional two-phase flow is by complexity of the phenomena a very challenging task; the ideal numerical method should be at the same time simple in order to apply to any model, from equilibrium to multi-field model and conservative in order to respect the fundamental conservation physical laws. The approximate Riemann solvers have the good properties of conservation of mass, momentum and energy balance and have been extended successfully to two-fluid models [3]- [5]. But, the up-winding of the flux is based on the Eigen-decomposition of the two-phase flow model and the computation of the Eigen-structure of a multi-field model can be a high cost procedure. Our contribution will present a short review of the above two-phase models, and show numerical results obtained for some of them with an approximate Riemann solver and with lower-complexity alternative numerical methods that do not
A phase transition between small- and large-field models of inflation
International Nuclear Information System (INIS)
Itzhaki, Nissan; Kovetz, Ely D
2009-01-01
We show that models of inflection point inflation exhibit a phase transition from a region in parameter space where they are of large-field type to a region where they are of small-field type. The phase transition is between a universal behavior, with respect to the initial condition, at the large-field region and non-universal behavior at the small-field region. The order parameter is the number of e-foldings. We find integer critical exponents at the transition between the two phases.
Rate-independent dissipation in phase-field modelling of displacive transformations
Tůma, K.; Stupkiewicz, S.; Petryk, H.
2018-05-01
In this paper, rate-independent dissipation is introduced into the phase-field framework for modelling of displacive transformations, such as martensitic phase transformation and twinning. The finite-strain phase-field model developed recently by the present authors is here extended beyond the limitations of purely viscous dissipation. The variational formulation, in which the evolution problem is formulated as a constrained minimization problem for a global rate-potential, is enhanced by including a mixed-type dissipation potential that combines viscous and rate-independent contributions. Effective computational treatment of the resulting incremental problem of non-smooth optimization is developed by employing the augmented Lagrangian method. It is demonstrated that a single Lagrange multiplier field suffices to handle the dissipation potential vertex and simultaneously to enforce physical constraints on the order parameter. In this way, the initially non-smooth problem of evolution is converted into a smooth stationarity problem. The model is implemented in a finite-element code and applied to solve two- and three-dimensional boundary value problems representative for shape memory alloys.
Computation of multiphase systems with phase field models
International Nuclear Information System (INIS)
Badalassi, V.E.; Ceniceros, H.D.; Banerjee, S.
2003-01-01
Phase field models offer a systematic physical approach for investigating complex multiphase systems behaviors such as near-critical interfacial phenomena, phase separation under shear, and microstructure evolution during solidification. However, because interfaces are replaced by thin transition regions (diffuse interfaces), phase field simulations require resolution of very thin layers to capture the physics of the problems studied. This demands robust numerical methods that can efficiently achieve high resolution and accuracy, especially in three dimensions. We present here an accurate and efficient numerical method to solve the coupled Cahn-Hilliard/Navier-Stokes system, known as Model H, that constitutes a phase field model for density-matched binary fluids with variable mobility and viscosity. The numerical method is a time-split scheme that combines a novel semi-implicit discretization for the convective Cahn-Hilliard equation with an innovative application of high-resolution schemes employed for direct numerical simulations of turbulence. This new semi-implicit discretization is simple but effective since it removes the stability constraint due to the nonlinearity of the Cahn-Hilliard equation at the same cost as that of an explicit scheme. It is derived from a discretization used for diffusive problems that we further enhance to efficiently solve flow problems with variable mobility and viscosity. Moreover, we solve the Navier-Stokes equations with a robust time-discretization of the projection method that guarantees better stability properties than those for Crank-Nicolson-based projection methods. For channel geometries, the method uses a spectral discretization in the streamwise and spanwise directions and a combination of spectral and high order compact finite difference discretizations in the wall normal direction. The capabilities of the method are demonstrated with several examples including phase separation with, and without, shear in two and three
A phase-field model for non-equilibrium solidification of intermetallics
International Nuclear Information System (INIS)
Assadi, H.
2007-01-01
Intermetallics may exhibit unique solidification behaviour-including slow growth kinetics, anomalous partitioning and formation of unusual growth morphologies-because of departure from local equilibrium. A phase-field model is developed and used to illustrate these non-equilibrium effects in solidification of a prototype B2 intermetallic phase. The model takes sublattice compositions as primary field variables, from which chemical long-range order is derived. The diffusive reactions between the two sublattices, and those between each sublattice and the liquid phase are taken as 'internal' kinetic processes, which take place within control volumes of the system. The model can thus capture solute and disorder trapping effects, which are consistent-over a wide range of the solid/liquid interface thickness-with the predictions of the sharp-interface theory of solute and disorder trapping. The present model can also take account of solid-state ordering and thus illustrate the effects of chemical ordering on microstructure formation and crystal growth kinetics
Modeling of Eutectic Formation in Al-Si Alloy Using A Phase-Field Method
Directory of Open Access Journals (Sweden)
Ebrahimi Z.
2017-12-01
Full Text Available We have utilized a phase-field model to investigate the evolution of eutectic silicon in Al-Si alloy. The interfacial fluctuations are included into a phase-field model of two-phase solidification, as stochastic noise terms and their dominant role in eutectic silicon formation is discussed. We have observed that silicon spherical particles nucleate on the foundation of primary aluminum phase and their nucleation continues on concentric rings, through the Al matrix. The nucleation of silicon particles is attributed to the inclusion of fluctuations into the phase-field equations. The simulation results have shown needle-like, fish-bone like and flakes of silicon phase by adjusting the noise coefficients to larger values. Moreover, the role of primary Al phase on nucleation of silicon particles in Al-Si alloy is elaborated. We have found that the addition of fluctuations plays the role of modifiers in our simulations and is essential for phase-field modeling of eutectic growth in Al-Si system. The simulated finger-like Al phases and spherical Si particles are very similar to those of experimental eutectic growth in modified Al-Si alloy.
Classical nucleation theory in the phase-field crystal model.
Jreidini, Paul; Kocher, Gabriel; Provatas, Nikolas
2018-04-01
A full understanding of polycrystalline materials requires studying the process of nucleation, a thermally activated phase transition that typically occurs at atomistic scales. The numerical modeling of this process is problematic for traditional numerical techniques: commonly used phase-field methods' resolution does not extend to the atomic scales at which nucleation takes places, while atomistic methods such as molecular dynamics are incapable of scaling to the mesoscale regime where late-stage growth and structure formation takes place following earlier nucleation. Consequently, it is of interest to examine nucleation in the more recently proposed phase-field crystal (PFC) model, which attempts to bridge the atomic and mesoscale regimes in microstructure simulations. In this work, we numerically calculate homogeneous liquid-to-solid nucleation rates and incubation times in the simplest version of the PFC model, for various parameter choices. We show that the model naturally exhibits qualitative agreement with the predictions of classical nucleation theory (CNT) despite a lack of some explicit atomistic features presumed in CNT. We also examine the early appearance of lattice structure in nucleating grains, finding disagreement with some basic assumptions of CNT. We then argue that a quantitatively correct nucleation theory for the PFC model would require extending CNT to a multivariable theory.
Classical nucleation theory in the phase-field crystal model
Jreidini, Paul; Kocher, Gabriel; Provatas, Nikolas
2018-04-01
A full understanding of polycrystalline materials requires studying the process of nucleation, a thermally activated phase transition that typically occurs at atomistic scales. The numerical modeling of this process is problematic for traditional numerical techniques: commonly used phase-field methods' resolution does not extend to the atomic scales at which nucleation takes places, while atomistic methods such as molecular dynamics are incapable of scaling to the mesoscale regime where late-stage growth and structure formation takes place following earlier nucleation. Consequently, it is of interest to examine nucleation in the more recently proposed phase-field crystal (PFC) model, which attempts to bridge the atomic and mesoscale regimes in microstructure simulations. In this work, we numerically calculate homogeneous liquid-to-solid nucleation rates and incubation times in the simplest version of the PFC model, for various parameter choices. We show that the model naturally exhibits qualitative agreement with the predictions of classical nucleation theory (CNT) despite a lack of some explicit atomistic features presumed in CNT. We also examine the early appearance of lattice structure in nucleating grains, finding disagreement with some basic assumptions of CNT. We then argue that a quantitatively correct nucleation theory for the PFC model would require extending CNT to a multivariable theory.
Phase Structure Of Fuzzy Field Theories And Multi trace Matrix Models
International Nuclear Information System (INIS)
Tekel, J.
2015-01-01
We review the interplay of fuzzy field theories and matrix models, with an emphasis on the phase structure of fuzzy scalar field theories. We give a self-contained introduction to these topics and give the details concerning the saddle point approach for the usual single trace and multi trace matrix models. We then review the attempts to explain the phase structure of the fuzzy field theory using a corresponding random matrix ensemble, showing the strength and weaknesses of this approach. We conclude with a list of challenges one needs to overcome and the most interesting open problems one can try to solve. (author)
Energy Technology Data Exchange (ETDEWEB)
Ertas, Mehmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Deviren, Bayram [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.tr [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2012-03-15
The dynamic phase transitions are studied in the kinetic spin-2 Blume-Capel model under a time-dependent oscillating magnetic field using the effective-field theory with correlations. The effective-field dynamic equation for the average magnetization is derived by employing the Glauber transition rates and the phases in the system are obtained by solving this dynamic equation. The nature (first- or second-order) of the dynamic phase transition is characterized by investigating the thermal behavior of the dynamic magnetization and the dynamic phase transition temperatures are obtained. The dynamic phase diagrams are constructed in the reduced temperature and magnetic field amplitude plane and are of seven fundamental types. Phase diagrams contain the paramagnetic (P), ferromagnetic-2 (F{sub 2}) and three coexistence or mixed phase regions, namely the F{sub 2}+P, F{sub 1}+P and F{sub 2}+F{sub 1}+P, which strongly depend on the crystal-field interaction (D) parameter. The system also exhibits the dynamic tricritical behavior. - Highlights: Black-Right-Pointing-Pointer Dynamic phase transitions are studied in spin-2 BC model using EFT. Black-Right-Pointing-Pointer Dynamic phase diagrams are constructed in (T/zJ, h/zJ) plane. Black-Right-Pointing-Pointer Seven fundamental types of dynamic phase diagrams are found in the system. Black-Right-Pointing-Pointer System exhibits dynamic tricritical behavior.
Phase-field models of microstructure evolution in a system with elastic inhomogeneity and defects
Hu, Shenyang
In this thesis, the phase-field approach is employed to study the effect of elastic inhomogeneity and structural defects on phase separation kinetics and morphological evolution in bulk and film systems, the precipitation of theta ' phase (Al2Cu) in Al-Cu alloys, and solute strengthening of alloys. By combining the iteration method for calculating the elastic energy and a semi-implicit spectral method for solving the Cahn-Hilliard equation an extremely efficient phase-field model is developed for studying morphological evolution in coherent systems with large elastic inhomogeneity. Spinodal decomposition in a thin film with periodically distributed arrays of interfacial dislocations is simulated. The results show that the periodic stress field associated with the array of interfacial dislocations leads to a directional phase separation and the formation of ordered microstructures. The metastable theta' (Al2Cu) precipitates are one of the primary strengthening precipitates in Al-Cu alloys. They are of a plate-like shape with strong interfacial energy and mobility anisotropies. A phase-field model which can automatically incorporate the thermodynamic and kinetic information from databases is developed. The relationships between phase-field model parameters and material thermodynamic and kinetic properties are established. Systematic simulations of theta' growth in 1D, 2D and 3D are carried out. The growth of a single theta ' precipitate in 1D exactly reproduces the results from analytical solutions. The phase-filed model can serve as a basis for quantitative understanding of the influence of elastic energy, interface energy anisotropy and interface mobility anisotropy on the precipitation of theta' in Al-Cu alloys. Precipitates and solutes are commonly used to strengthen alloys. A phase field model of dislocation dynamics, which employs 12 order parameter fields to describe the dislocation distribution in a single fcc crystal, and one composition field to describe
Combining phase-field crystal methods with a Cahn-Hilliard model for binary alloys
Balakrishna, Ananya Renuka; Carter, W. Craig
2018-04-01
Diffusion-induced phase transitions typically change the lattice symmetry of the host material. In battery electrodes, for example, Li ions (diffusing species) are inserted between layers in a crystalline electrode material (host). This diffusion induces lattice distortions and defect formations in the electrode. The structural changes to the lattice symmetry affect the host material's properties. Here, we propose a 2D theoretical framework that couples a Cahn-Hilliard (CH) model, which describes the composition field of a diffusing species, with a phase-field crystal (PFC) model, which describes the host-material lattice symmetry. We couple the two continuum models via coordinate transformation coefficients. We introduce the transformation coefficients in the PFC method to describe affine lattice deformations. These transformation coefficients are modeled as functions of the composition field. Using this coupled approach, we explore the effects of coarse-grained lattice symmetry and distortions on a diffusion-induced phase transition process. In this paper, we demonstrate the working of the CH-PFC model through three representative examples: First, we describe base cases with hexagonal and square symmetries for two composition fields. Next, we illustrate how the CH-PFC method interpolates lattice symmetry across a diffuse phase boundary. Finally, we compute a Cahn-Hilliard type of diffusion and model the accompanying changes to lattice symmetry during a phase transition process.
International Nuclear Information System (INIS)
Hua Jinsong; Lin Ping; Liu Chun; Wang Qi
2011-01-01
Highlights: → We study phase-field models for multi-phase flow computation. → We develop an energy-law preserving C0 FEM. → We show that the energy-law preserving method work better. → We overcome unphysical oscillation associated with the Cahn-Hilliard model. - Abstract: We use the idea in to develop the energy law preserving method and compute the diffusive interface (phase-field) models of Allen-Cahn and Cahn-Hilliard type, respectively, governing the motion of two-phase incompressible flows. We discretize these two models using a C 0 finite element in space and a modified midpoint scheme in time. To increase the stability in the pressure variable we treat the divergence free condition by a penalty formulation, under which the discrete energy law can still be derived for these diffusive interface models. Through an example we demonstrate that the energy law preserving method is beneficial for computing these multi-phase flow models. We also demonstrate that when applying the energy law preserving method to the model of Cahn-Hilliard type, un-physical interfacial oscillations may occur. We examine the source of such oscillations and a remedy is presented to eliminate the oscillations. A few two-phase incompressible flow examples are computed to show the good performance of our method.
International Nuclear Information System (INIS)
Thiessen, R.G.; Sietsma, J.; Palmer, T.A.; Elmer, J.W.; Richardson, I.M.
2007-01-01
A thermodynamically based method to describe the phase transformations during heating and cooling of martensitic dual-phase steel has been developed, and in situ synchrotron measurements of phase transformations have been undertaken to support the model experimentally. Nucleation routines are governed by a novel implementation of the classical nucleation theory in a general phase-field code. Physically-based expressions for the temperature-dependent interface mobility and the driving forces for transformation have also been constructed. Modelling of martensite was accomplished by assuming a carbon supersaturation of the body-centred-cubic ferrite lattice. The simulations predict kinetic aspects of the austenite formation during heating and ferrite formation upon cooling. Simulations of partial austenitising thermal cycles predicted peak and retained austenite percentages of 38.2% and 6.7%, respectively, while measurements yielded peak and retained austenite percentages of 31.0% and 7.2% (±1%). Simulations of a complete austenitisation thermal cycle predicted the measured complete austenitisation and, upon cooling, a retained austenite percentage of 10.3% while 9.8% (±1%) retained austenite was measured
Phase-field model of insulator-to-metal transition in VO2 under an electric field
Shi, Yin; Chen, Long-Qing
2018-05-01
The roles of an electric field and electronic doping in insulator-to-metal transitions are still not well understood. Here we formulated a phase-field model of insulator-to-metal transitions by taking into account both structural and electronic instabilities as well as free electrons and holes in VO2, a strongly correlated transition-metal oxide. Our phase-field simulations demonstrate that in a VO2 slab under a uniform electric field, an abrupt universal resistive transition occurs inside the supercooling region, in sharp contrast to the conventional Landau-Zener smooth electric breakdown. We also show that hole doping may decouple the structural and electronic phase transitions in VO2, leading to a metastable metallic monoclinic phase which could be stabilized through a geometrical confinement and the size effect. This work provides a general mesoscale thermodynamic framework for understanding the influences of electric field, electronic doping, and stress and strain on insulator-to-metal transitions and the corresponding mesoscale domain structure evolution in VO2 and related strongly correlated systems.
2D phase field modeling of sintering of silver nanoparticles
Chockalingam, K.; Kouznetsova, V.; van der Sluis, O.; Geers, M.G.D.
2016-01-01
The sintering mechanism of silver nanoparticles is modelled by incorporating surface, volume and grain boundary diffusion in a phase field model. A direction-dependent tensorial mobility formulation is adopted, capturing the fact that diffusion mainly occurs along the directions tangential to the
Energy Technology Data Exchange (ETDEWEB)
Lim, Hojun [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Owen, Steven J. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Abdeljawad, Fadi F. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Hanks, Byron [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Battaile, Corbett Chandler [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
2015-09-01
In order to better incorporate microstructures in continuum scale models, we use a novel finite element (FE) meshing technique to generate three-dimensional polycrystalline aggregates from a phase field grain growth model of grain microstructures. The proposed meshing technique creates hexahedral FE meshes that capture smooth interfaces between adjacent grains. Three dimensional realizations of grain microstructures from the phase field model are used in crystal plasticity-finite element (CP-FE) simulations of polycrystalline a -iron. We show that the interface conformal meshes significantly reduce artificial stress localizations in voxelated meshes that exhibit the so-called "wedding cake" interfaces. This framework provides a direct link between two mesoscale models - phase field and crystal plasticity - and for the first time allows mechanics simulations of polycrystalline materials using three-dimensional hexahedral finite element meshes with realistic topological features.
Matrix model approximations of fuzzy scalar field theories and their phase diagrams
Energy Technology Data Exchange (ETDEWEB)
Tekel, Juraj [Department of Theoretical Physics, Faculty of Mathematics, Physics and Informatics, Comenius University, Mlynska Dolina, Bratislava, 842 48 (Slovakia)
2015-12-29
We present an analysis of two different approximations to the scalar field theory on the fuzzy sphere, a nonperturbative and a perturbative one, which are both multitrace matrix models. We show that the former reproduces a phase diagram with correct features in a qualitative agreement with the previous numerical studies and that the latter gives a phase diagram with features not expected in the phase diagram of the field theory.
Magnetic islands modelled by a phase-field-crystal approach
Faghihi, Niloufar; Mkhonta, Simiso; Elder, Ken R.; Grant, Martin
2018-03-01
Using a minimal model based on the phase-field-crystal formalism, we study the coupling between the density and magnetization in ferromagnetic solids. Analytical calculations for the square phase in two dimensions are presented and the small deformation properties of the system are examined. Furthermore, numerical simulations are conducted to study the influence of an external magnetic field on various phase transitions, the anisotropic properties of the free energy functional, and the scaling behaviour of the growth of the magnetic domains in a crystalline solid. It is shown that the energy of the system can depend on the direction of the magnetic moments, with respect to the crystalline direction. Furthermore, the growth of the magnetic domains in a crystalline solid is studied and is shown that the growth of domains is in agreement with expected behaviour.
Phase field model for the study of boiling; Modele de champ de phase pour l'etude de l'ebullition
Energy Technology Data Exchange (ETDEWEB)
Ruyer, P
2006-07-15
This study concerns both the modeling and the numerical simulation of boiling flows. First we propose a review concerning nucleate boiling at high wall heat flux and focus more particularly on the current understanding of the boiling crisis. From this analysis we deduce a motivation for the numerical simulation of bubble growth dynamics. The main and remaining part of this study is then devoted to the development and analyze of a phase field model for the liquid-vapor flows with phase change. We propose a thermodynamic quasi-compressible formulation whose properties match the one required for the numerical study envisaged. The system of governing equations is a thermodynamically consistent regularization of the sharp interface model, that is the advantage of the di use interface models. We show that the thickness of the interface transition layer can be defined independently from the thermodynamic description of the bulk phases, a property that is numerically attractive. We derive the kinetic relation that allows to analyze the consequences of the phase field formulation on the model of the dissipative mechanisms. Finally we study the numerical resolution of the model with the help of simulations of phase transition in simple configurations as well as of isothermal bubble dynamics. (author)
Higgs and confinement phases in the fundamental SU(2) Higgs model: Mean field analysis
International Nuclear Information System (INIS)
Damgaard, P.H.; Heller, U.M.
1985-01-01
The phase diagram of the four-dimensional SU(2) gauge-Higgs model with Higgs field in the fundamental representation is derived by mean field techniques. When the Higgs field is allowed to fluctuate in. Magnitude, the analytic connection between Higgs and confinement phases breaks down for sufficiently small values of the quark Higgs coupling, indicating that the Higgs and confinement phases for these couplings are strictly distinct phases. (orig.)
On the stress calculation within phase-field approaches: a model for finite deformations
Schneider, Daniel; Schwab, Felix; Schoof, Ephraim; Reiter, Andreas; Herrmann, Christoph; Selzer, Michael; Böhlke, Thomas; Nestler, Britta
2017-08-01
Numerical simulations based on phase-field methods are indispensable in order to investigate interesting and important phenomena in the evolution of microstructures. Microscopic phase transitions are highly affected by mechanical driving forces and therefore the accurate calculation of the stresses in the transition region is essential. We present a method for stress calculations within the phase-field framework, which satisfies the mechanical jump conditions corresponding to sharp interfaces, although the sharp interface is represented as a volumetric region using the phase-field approach. This model is formulated for finite deformations, is independent of constitutive laws, and allows using any type of phase inherent inelastic strains.
A Comprehensive Model of the Near-Earth Magnetic Field. Phase 3
Sabaka, Terence J.; Olsen, Nils; Langel, Robert A.
2000-01-01
The near-Earth magnetic field is due to sources in Earth's core, ionosphere, magnetosphere, lithosphere, and from coupling currents between ionosphere and magnetosphere and between hemispheres. Traditionally, the main field (low degree internal field) and magnetospheric field have been modeled simultaneously, and fields from other sources modeled separately. Such a scheme, however, can introduce spurious features. A new model, designated CMP3 (Comprehensive Model: Phase 3), has been derived from quiet-time Magsat and POGO satellite measurements and observatory hourly and annual means measurements as part of an effort to coestimate fields from all of these sources. This model represents a significant advancement in the treatment of the aforementioned field sources over previous attempts, and includes an accounting for main field influences on the magnetosphere, main field and solar activity influences on the ionosphere, seasonal influences on the coupling currents, a priori characterization of ionospheric and magnetospheric influence on Earth-induced fields, and an explicit parameterization and estimation of the lithospheric field. The result of this effort is a model whose fits to the data are generally superior to previous models and whose parameter states for the various constituent sources are very reasonable.
A Navier-Stokes phase-field crystal model for colloidal suspensions.
Praetorius, Simon; Voigt, Axel
2015-04-21
We develop a fully continuous model for colloidal suspensions with hydrodynamic interactions. The Navier-Stokes Phase-Field Crystal model combines ideas of dynamic density functional theory with particulate flow approaches and is derived in detail and related to other dynamic density functional theory approaches with hydrodynamic interactions. The derived system is numerically solved using adaptive finite elements and is used to analyze colloidal crystallization in flowing environments demonstrating a strong coupling in both directions between the crystal shape and the flow field. We further validate the model against other computational approaches for particulate flow systems for various colloidal sedimentation problems.
Phase-field model of vapor-liquid-solid nanowire growth
Wang, Nan; Upmanyu, Moneesh; Karma, Alain
2018-03-01
We present a multiphase-field model to describe quantitatively nanowire growth by the vapor-liquid-solid (VLS) process. The free-energy functional of this model depends on three nonconserved order parameters that distinguish the vapor, liquid, and solid phases and describe the energetic properties of various interfaces, including arbitrary forms of anisotropic γ plots for the solid-vapor and solid-liquid interfaces. The evolution equations for those order parameters describe basic kinetic processes including the rapid (quasi-instantaneous) equilibration of the liquid catalyst to a droplet shape with constant mean curvature, the slow incorporation of growth atoms at the droplet surface, and crystallization within the droplet. The standard constraint that the sum of the phase fields equals unity and the conservation of the number of catalyst atoms, which relates the catalyst volume to the concentration of growth atoms inside the droplet, are handled via separate Lagrange multipliers. An analysis of the model is presented that rigorously maps the phase-field equations to a desired set of sharp-interface equations for the evolution of the phase boundaries under the constraint of force balance at three-phase junctions (triple points) given by the Young-Herring relation that includes torque term related to the anisotropy of the solid-liquid and solid-vapor interface excess free energies. Numerical examples of growth in two dimensions are presented for the simplest case of vanishing crystalline anisotropy and the more realistic case of a solid-liquid γ plot with cusped minima corresponding to two sets of (10 ) and (11 ) facets. The simulations reproduce many of the salient features of nanowire growth observed experimentally, including growth normal to the substrate with tapering of the side walls, transitions between different growth orientations, and crawling growth along the substrate. They also reproduce different observed relationships between the nanowire growth
Phase-Field Modeling of Polycrystalline Solidification: From Needle Crystals to Spherulites—A Review
Gránásy, László; Rátkai, László; Szállás, Attila; Korbuly, Bálint; Tóth, Gyula I.; Környei, László; Pusztai, Tamás
2014-04-01
Advances in the orientation-field-based phase-field (PF) models made in the past are reviewed. The models applied incorporate homogeneous and heterogeneous nucleation of growth centers and several mechanisms to form new grains at the perimeter of growing crystals, a phenomenon termed growth front nucleation. Examples for PF modeling of such complex polycrystalline structures are shown as impinging symmetric dendrites, polycrystalline growth forms (ranging from disordered dendrites to spherulitic patterns), and various eutectic structures, including spiraling two-phase dendrites. Simulations exploring possible control of solidification patterns in thin films via external fields, confined geometry, particle additives, scratching/piercing the films, etc. are also displayed. Advantages, problems, and possible solutions associated with quantitative PF simulations are discussed briefly.
Yu, Li-Li; Shou, Wen-De; Hui, Chun
2012-02-01
A theoretical model of focused acoustic field for a multi-annular phased array on concave spherical surface is proposed. In this model, the source boundary conditions of the spheroidal beam equation (SBE) for multi-annular phased elements are studied. Acoustic field calculated by the dynamic focusing model of SBE is compared with numerical results of the O'Neil and Khokhlov—Zabolotskaya—Kuznetsov (KZK) model, respectively. Axial dynamic focusing and the harmonic effects are presented. The results demonstrate that the dynamic focusing model of SBE is good valid for a concave multi-annular phased array with a large aperture angle in the linear or nonlinear field.
International Nuclear Information System (INIS)
Yu Lili; Shou Wende; Hui Chun
2012-01-01
A theoretical model of focused acoustic field for a multi-annular phased array on concave spherical surface is proposed. In this model, the source boundary conditions of the spheroidal beam equation (SBE) for multi-annular phased elements are studied. Acoustic field calculated by the dynamic focusing model of SBE is compared with numerical results of the O'Neil and Khokhlov-Zabolotskaya-Kuznetsov (KZK) model, respectively. Axial dynamic focusing and the harmonic effects are presented. The results demonstrate that the dynamic focusing model of SBE is good valid for a concave multi-annular phased array with a large aperture angle in the linear or nonlinear field. (electromagnetism, optics, acoustics, heat transfer, classical mechanics, and fluid dynamics)
A comprehensive model of the quiet-time, near-Earth magnetic field: phase 3
DEFF Research Database (Denmark)
Sabaka, T.J.; Olsen, Nils; Langel, R.A.
2002-01-01
been modelled simultaneously, with fields from other sources being modelled separately. Such a scheme, however, can introduce spurious features, especially when the spatial and temporal scales of the fields overlap. A new model, designated CM3 (Comprehensive Model: phase 3), is the third in a series...... of efforts to coestimate fields from all of these sources. This model has been derived from quiet-time Magsat and POGO satellite and observatory hourly means measurements for the period 1960-1985. It represents a significant advance in the treatment of the aforementioned field sources over previous attempts...... parametrization and estimation of the lithospheric field. The result is a model that describes well the 591 432 data with 16 594 parameters, implying a data-to-parameter ratio of 36, which is larger than several popular field models....
International Nuclear Information System (INIS)
Keskin, Mustafa; Canko, Osman; Deviren, Bayram
2007-01-01
We analyze, within a mean-field approach, the stationary states of the kinetic spin-32 Blume-Capel (BC) model by the Glauber-type stochastic dynamics and subject to a time-dependent oscillating external magnetic field. The dynamic phase transition (DPT) points are obtained by investigating the behavior of the dynamic magnetization as a function of temperature and as well as calculating the Liapunov exponent. Phase diagrams are constructed in the temperature and crystal-field interaction plane. We find five fundamental types of phase diagrams for the different values of the reduced magnetic field amplitude parameter (h) in which they present a disordered, two ordered phases and the coexistences phase regions. The phase diagrams also exhibit a dynamic double-critical end point for 0 5.06
Multi-GPU hybrid programming accelerated three-dimensional phase-field model in binary alloy
Directory of Open Access Journals (Sweden)
Changsheng Zhu
2018-03-01
Full Text Available In the process of dendritic growth simulation, the computational efficiency and the problem scales have extremely important influence on simulation efficiency of three-dimensional phase-field model. Thus, seeking for high performance calculation method to improve the computational efficiency and to expand the problem scales has a great significance to the research of microstructure of the material. A high performance calculation method based on MPI+CUDA hybrid programming model is introduced. Multi-GPU is used to implement quantitative numerical simulations of three-dimensional phase-field model in binary alloy under the condition of multi-physical processes coupling. The acceleration effect of different GPU nodes on different calculation scales is explored. On the foundation of multi-GPU calculation model that has been introduced, two optimization schemes, Non-blocking communication optimization and overlap of MPI and GPU computing optimization, are proposed. The results of two optimization schemes and basic multi-GPU model are compared. The calculation results show that the use of multi-GPU calculation model can improve the computational efficiency of three-dimensional phase-field obviously, which is 13 times to single GPU, and the problem scales have been expanded to 8193. The feasibility of two optimization schemes is shown, and the overlap of MPI and GPU computing optimization has better performance, which is 1.7 times to basic multi-GPU model, when 21 GPUs are used.
Energy Technology Data Exchange (ETDEWEB)
Ertaş, Mehmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Kocakaplan, Yusuf [Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.tr [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2013-12-15
Dynamic phase diagrams are presented for the kinetic spin-3/2 Blume–Capel model under a time oscillating longitudinal field by use of the effective-field theory with correlations. The dynamic equation of the average magnetization is obtained for the square lattice by utilizing the Glauber-type stochastic process. Dynamic phase diagrams are presented in the reduced temperature and the magnetic field amplitude plane. We also investigated the effect of longitudinal field frequency. Finally, the discussion and comparison of the phase diagrams are given. - Highlights: • Dynamic behaviors in the spin-3/2 Blume–Capel system is investigated by the effective-field theory based on the Glauber-type stochastic dynamics. • The dynamic phase transitions and dynamic phase diagrams are obtained. • The effects of the longitudinal field frequency on the dynamic phase diagrams of the system are investigated. • Dynamic phase diagrams exhibit several ordered phases, coexistence phase regions and several critical points as well as a re-entrant behavior.
International Nuclear Information System (INIS)
Ertaş, Mehmet; Kocakaplan, Yusuf; Keskin, Mustafa
2013-01-01
Dynamic phase diagrams are presented for the kinetic spin-3/2 Blume–Capel model under a time oscillating longitudinal field by use of the effective-field theory with correlations. The dynamic equation of the average magnetization is obtained for the square lattice by utilizing the Glauber-type stochastic process. Dynamic phase diagrams are presented in the reduced temperature and the magnetic field amplitude plane. We also investigated the effect of longitudinal field frequency. Finally, the discussion and comparison of the phase diagrams are given. - Highlights: • Dynamic behaviors in the spin-3/2 Blume–Capel system is investigated by the effective-field theory based on the Glauber-type stochastic dynamics. • The dynamic phase transitions and dynamic phase diagrams are obtained. • The effects of the longitudinal field frequency on the dynamic phase diagrams of the system are investigated. • Dynamic phase diagrams exhibit several ordered phases, coexistence phase regions and several critical points as well as a re-entrant behavior
Phase field modeling of dendritic coarsening during isothermal
Directory of Open Access Journals (Sweden)
Zhang Yutuo
2011-08-01
Full Text Available Dendritic coarsening in Al-2mol%Si alloy during isothermal solidification at 880K was investigated by phase field modeling. Three coarsening mechanisms operate in the alloy: (a melting of small dendrite arms; (b coalescence of dendrites near the tips leading to the entrapment of liquid droplets; (c smoothing of dendrites. Dendrite melting is found to be dominant in the stage of dendritic growth, whereas coalescence of dendrites and smoothing of dendrites are dominant during isothermal holding. The simulated results provide a better understanding of dendrite coarsening during isothermal solidification.
Athreya, C. N.; Mukilventhan, A.; Suwas, Satyam; Vedantam, Srikanth; Subramanya Sarma, V.
2018-04-01
The influence of the mode of deformation on recrystallisation behaviour of Ti was studied by experiments and modelling. Ti samples were deformed through torsion and rolling to the same equivalent strain of 0.5. The deformed samples were annealed at different temperatures for different time durations and the recrystallisation kinetics were compared. Recrystallisation is found to be faster in the rolled samples compared to the torsion deformed samples. This is attributed to the differences in stored energy and number of nuclei per unit area in the two modes of deformation. Considering decay in stored energy during recrystallisation, the grain boundary mobility was estimated through a mean field model. The activation energy for recrystallisation obtained from experiments matched with the activation energy for grain boundary migration obtained from mobility calculation. A multi-phase field model (with mobility estimated from the mean field model as a constitutive input) was used to simulate the kinetics, microstructure and texture evolution. The recrystallisation kinetics and grain size distributions obtained from experiments matched reasonably well with the phase field simulations. The recrystallisation texture predicted through phase field simulations compares well with experiments though few additional texture components are present in simulations. This is attributed to the anisotropy in grain boundary mobility, which is not accounted for in the present study.
Discussions on the non-equilibrium effects in the quantitative phase field model of binary alloys
International Nuclear Information System (INIS)
Zhi-Jun, Wang; Jin-Cheng, Wang; Gen-Cang, Yang
2010-01-01
All the quantitative phase field models try to get rid of the artificial factors of solutal drag, interface diffusion and interface stretch in the diffuse interface. These artificial non-equilibrium effects due to the introducing of diffuse interface are analysed based on the thermodynamic status across the diffuse interface in the quantitative phase field model of binary alloys. Results indicate that the non-equilibrium effects are related to the negative driving force in the local region of solid side across the diffuse interface. The negative driving force results from the fact that the phase field model is derived from equilibrium condition but used to simulate the non-equilibrium solidification process. The interface thickness dependence of the non-equilibrium effects and its restriction on the large scale simulation are also discussed. (cross-disciplinary physics and related areas of science and technology)
International Nuclear Information System (INIS)
Keskin, M.; Canko, O.; Temizer, U.
2007-01-01
Within a mean-field approach, the stationary states of the kinetic spin-1 Blume-Capel model in the presence of a time-dependent oscillating external magnetic field is studied. The Glauber-type stochastic dynamics is used to describe the time evolution of the system and obtain the mean-field dynamic equation of motion. The dynamic phase-transition points are calculated and phase diagrams are presented in the temperature and crystal-field interaction plane. According to the values of the magnetic field amplitude, three fundamental types of phase diagrams are found: One exhibits a dynamic tricritical point, while the other two exhibit a dynamic zero-temperature critical point
High-performance phase-field modeling
Vignal, Philippe; Sarmiento, Adel; Cortes, Adriano Mauricio; Dalcin, L.; Collier, N.; Calo, Victor M.
2015-01-01
and phase-field crystal equation will be presented, which corroborate the theoretical findings, and illustrate the robustness of the method. Results related to more challenging examples, namely the Navier-Stokes Cahn-Hilliard and a diusion-reaction Cahn-Hilliard system, will also be presented. The implementation was done in PetIGA and PetIGA-MF, high-performance Isogeometric Analysis frameworks [1, 3], designed to handle non-linear, time-dependent problems.
Phase-space quantization of field theory
International Nuclear Information System (INIS)
Curtright, T.; Zachos, C.
1999-01-01
In this lecture, a limited introduction of gauge invariance in phase-space is provided, predicated on canonical transformations in quantum phase-space. Exact characteristic trajectories are also specified for the time-propagating Wigner phase-space distribution function: they are especially simple--indeed, classical--for the quantized simple harmonic oscillator. This serves as the underpinning of the field theoretic Wigner functional formulation introduced. Scalar field theory is thus reformulated in terms of distributions in field phase-space. This is a pedagogical selection from work published and reported at the Yukawa Institute Workshop ''Gauge Theory and Integrable Models'', 26-29 January, 1999
Energy Technology Data Exchange (ETDEWEB)
Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)]. E-mail: keskin@erciyes.edu.tr; Canko, Osman [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Deviren, Bayram [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2007-06-15
We analyze, within a mean-field approach, the stationary states of the kinetic spin-32 Blume-Capel (BC) model by the Glauber-type stochastic dynamics and subject to a time-dependent oscillating external magnetic field. The dynamic phase transition (DPT) points are obtained by investigating the behavior of the dynamic magnetization as a function of temperature and as well as calculating the Liapunov exponent. Phase diagrams are constructed in the temperature and crystal-field interaction plane. We find five fundamental types of phase diagrams for the different values of the reduced magnetic field amplitude parameter (h) in which they present a disordered, two ordered phases and the coexistences phase regions. The phase diagrams also exhibit a dynamic double-critical end point for 0
Sink efficiency calculation of dislocations in irradiated materials by phase-field modelling
International Nuclear Information System (INIS)
Rouchette, Adrien
2015-01-01
The aim of this work is to develop a modelling technique for diffusion of crystallographic migrating defects in irradiated metals and absorption by sinks to better predict the microstructural evolution in those materials.The phase field technique is well suited for this problem, since it naturally takes into account the elastic effects of dislocations on point defect diffusion in the most complex cases. The phase field model presented in this work has been adapted to simulate the generation of defects by irradiation and their absorption by the dislocation cores by means of a new order parameter associated to the sink morphology. The method has first been validated in different reference cases by comparing the sink strengths obtained numerically with analytical solutions available in the literature. Then, the method has been applied to dislocations with different orientations in zirconium, taking into account the anisotropic properties of the crystal and point defects, obtained by state-of-the-art atomic calculations.The results show that the shape anisotropy of the point defects promotes the vacancy absorption by basal loops, which is consistent with the experimentally observed zirconium growth under irradiation. Finally, the rigorous investigation of the dislocation loop case proves that phase field simulations give more accurate results than analytical solutions in realistic loop density ranges. (author)
Phase diagrams of a spin-1/2 transverse Ising model with three-peak random field distribution
International Nuclear Information System (INIS)
Bassir, A.; Bassir, C.E.; Benyoussef, A.; Ez-Zahraouy, H.
1996-07-01
The effect of the transverse magnetic field on the phase diagrams structures of the Ising model in a random longitudinal magnetic field with a trimodal symmetric distribution is investigated within a finite cluster approximation. We find that a small magnetizations ordered phase (small ordered phase) disappears completely for a sufficiently large value of the transverse field or/and large value of the concentration of the disorder of the magnetic field. Multicritical behaviour and reentrant phenomena are discussed. The regions where the tricritical, reentrant phenomena and the small ordered phase persist are delimited as a function of the transverse field and the concentration p. Longitudinal magnetizations are also presented. (author). 33 refs, 6 figs
Constitutive modeling of two phase materials using the Mean Field method for homogenization
Perdahcioglu, Emin Semih; Geijselaers, Hubertus J.M.
2010-01-01
A Mean-Field homogenization framework for constitutive modeling of materials involving two distinct elastic-plastic phases is presented. With this approach it is possible to compute the macroscopic mechanical behavior of this type of materials based on the constitutive models of the constituent
Rosolen, A.; Peco, C.; Arroyo, M.
2013-01-01
We present an adaptive meshfree method to approximate phase-field models of biomembranes. In such models, the Helfrich curvature elastic energy, the surface area, and the enclosed volume of a vesicle are written as functionals of a continuous phase-field, which describes the interface in a smeared manner. Such functionals involve up to second-order spatial derivatives of the phase-field, leading to fourth-order Euler–Lagrange partial differential equations (PDE). The solutions develop sharp i...
DEFF Research Database (Denmark)
Poulsen, Stefan Othmar; Voorhees, P.W.; Lauridsen, Erik Mejdal
2012-01-01
A phase field model to study the microstructural evolution of a polycrystalline dual-phase material with conserved phase fraction has been implemented, and 2D simulations have been performed. For 2D simulations, the model predicts the cubic growth well-known for diffusion-controlled systems. Some...... interphase boundaries are found to show a persistent non-constant curvature, which seems to be a feature of multi-phase materials. Finally, it is briefly outlined how this model is to be applied to investigate microstructural evolution in duplex steel. © (2012) Trans Tech Publications, Switzerland....
A phase field model for segregation and precipitation induced by irradiation in alloys
Badillo, A.; Bellon, P.; Averback, R. S.
2015-04-01
A phase field model is introduced to model the evolution of multicomponent alloys under irradiation, including radiation-induced segregation and precipitation. The thermodynamic and kinetic components of this model are derived using a mean-field model. The mobility coefficient and the contribution of chemical heterogeneity to free energy are rescaled by the cell size used in the phase field model, yielding microstructural evolutions that are independent of the cell size. A new treatment is proposed for point defect clusters, using a mixed discrete-continuous approach to capture the stochastic character of defect cluster production in displacement cascades, while retaining the efficient modeling of the fate of these clusters using diffusion equations. The model is tested on unary and binary alloy systems using two-dimensional simulations. In a unary system, the evolution of point defects under irradiation is studied in the presence of defect clusters, either pre-existing ones or those created by irradiation, and compared with rate theory calculations. Binary alloys with zero and positive heats of mixing are then studied to investigate the effect of point defect clustering on radiation-induced segregation and precipitation in undersaturated solid solutions. Lastly, irradiation conditions and alloy parameters leading to irradiation-induced homogeneous precipitation are investigated. The results are discussed in the context of experimental results reported for Ni-Si and Al-Zn undersaturated solid solutions subjected to irradiation.
A phase field model for segregation and precipitation induced by irradiation in alloys
International Nuclear Information System (INIS)
Badillo, A; Bellon, P; Averback, R S
2015-01-01
A phase field model is introduced to model the evolution of multicomponent alloys under irradiation, including radiation-induced segregation and precipitation. The thermodynamic and kinetic components of this model are derived using a mean-field model. The mobility coefficient and the contribution of chemical heterogeneity to free energy are rescaled by the cell size used in the phase field model, yielding microstructural evolutions that are independent of the cell size. A new treatment is proposed for point defect clusters, using a mixed discrete-continuous approach to capture the stochastic character of defect cluster production in displacement cascades, while retaining the efficient modeling of the fate of these clusters using diffusion equations. The model is tested on unary and binary alloy systems using two-dimensional simulations. In a unary system, the evolution of point defects under irradiation is studied in the presence of defect clusters, either pre-existing ones or those created by irradiation, and compared with rate theory calculations. Binary alloys with zero and positive heats of mixing are then studied to investigate the effect of point defect clustering on radiation-induced segregation and precipitation in undersaturated solid solutions. Lastly, irradiation conditions and alloy parameters leading to irradiation-induced homogeneous precipitation are investigated. The results are discussed in the context of experimental results reported for Ni–Si and Al–Zn undersaturated solid solutions subjected to irradiation. (paper)
International Nuclear Information System (INIS)
Kundin, Julia; Pogorelov, Evgeny; Emmerich, Heike
2015-01-01
We have investigated the microstructure evolution during the isothermal and non-isothermal solidification of ternary Al–Cu–Ni alloys by means of a general multi-phase-field model for an arbitrary number of phases. The stability requirements for the model functions on every dual interface guarantee the absence of “ghost” phases. The aim was to generate a realistic microstructure by coupling the thermodynamic parameters of the phases and the thermodynamically consistent phase-field evolution equations. It is shown that the specially constructed thermal noise terms disturb the stability on the dual interfaces and can produce heterogeneous nucleation of product phases at energetically favorable points. Similar behavior can be observed in triple junctions where the heterogeneous nucleation of a fourth phase is more favorable. Finally, the model predicts the growth of a combined eutectic-like and peritectic-like structure that is comparable to the observed experimental microstructure in various alloys
International Nuclear Information System (INIS)
Ertaş, Mehmet; Keskin, Mustafa; Deviren, Bayram
2012-01-01
Using an effective field theory with correlations, we study a kinetic spin-5/2 Blume–Capel model with bilinear exchange interaction and single-ion crystal field on a square lattice. The effective-field dynamic equation is derived by employing the Glauber transition rates. First, the phases in the kinetic system are obtained by solving this dynamic equation. Then, the thermal behavior of the dynamic magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. Finally, we present the phase diagrams in two planes, namely (T/zJ, h 0 /zJ) and (T/zJ, D/zJ), where T absolute temperature, h 0 , the amplitude of the oscillating field, D, crystal field interaction or single-ion anisotropy constant and z denotes the nearest-neighbor sites of the central site. The phase diagrams exhibit four fundamental phases and ten mixed phases which are composed of binary, ternary and tetrad combination of fundamental phases, depending on the crystal field interaction parameter. Moreover, the phase diagrams contain a dynamic tricritical point (T), a double critical end point (B), a multicritical point (A) and zero-temperature critical point (Z). - Highlights: ► The effective-field theory is used to study the kinetic spin-5/2 Ising Blume–Capel model. ► Time variations of average order parameter have been studied to find phases in the system. ► The dynamic magnetization, hysteresis loop area and correlation have been calculated. ► The dynamic phase boundaries of the system depend on D/zJ. ► The dynamic phase diagrams are presented in the (T/zJ, h 0 /zJ) and (D/zJ, T/zJ) planes.
Energy Technology Data Exchange (ETDEWEB)
Ertas, Mehmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.tr [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Deviren, Bayram [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey)
2012-04-15
Using an effective field theory with correlations, we study a kinetic spin-5/2 Blume-Capel model with bilinear exchange interaction and single-ion crystal field on a square lattice. The effective-field dynamic equation is derived by employing the Glauber transition rates. First, the phases in the kinetic system are obtained by solving this dynamic equation. Then, the thermal behavior of the dynamic magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. Finally, we present the phase diagrams in two planes, namely (T/zJ, h{sub 0}/zJ) and (T/zJ, D/zJ), where T absolute temperature, h{sub 0}, the amplitude of the oscillating field, D, crystal field interaction or single-ion anisotropy constant and z denotes the nearest-neighbor sites of the central site. The phase diagrams exhibit four fundamental phases and ten mixed phases which are composed of binary, ternary and tetrad combination of fundamental phases, depending on the crystal field interaction parameter. Moreover, the phase diagrams contain a dynamic tricritical point (T), a double critical end point (B), a multicritical point (A) and zero-temperature critical point (Z). - Highlights: Black-Right-Pointing-Pointer The effective-field theory is used to study the kinetic spin-5/2 Ising Blume-Capel model. Black-Right-Pointing-Pointer Time variations of average order parameter have been studied to find phases in the system. Black-Right-Pointing-Pointer The dynamic magnetization, hysteresis loop area and correlation have been calculated. Black-Right-Pointing-Pointer The dynamic phase boundaries of the system depend on D/zJ. Black-Right-Pointing-Pointer The dynamic phase diagrams are presented in the (T/zJ, h{sub 0}/zJ) and (D/zJ, T/zJ) planes.
Simulation of spheroidisation of elongated Si-particle in Al-Si alloys by the phase-field model
International Nuclear Information System (INIS)
Kovacevic, I.
2008-01-01
The application of the phase-field model for spheroidisation of undissolvable particles during high-temperature treatment of alloys is pointed out. Modelling of the spheroidisation of elongated Si-particles during annealing of Al-Si alloy is elaborated in this paper. The driving force for spheroidisation is the minimization of the total free-energy of the system or the minimization of the ratio between the interface areas and the particle volumes. The spheroidisation kinetics of elongated Si-particle for binary Al-Si system during homogenisation of aluminium alloys simulated by the phase-field model is demonstrated. The influences of the interface energy and the homogenisation temperature on the spheroidisation kinetics is presented. The lack of knowledge of the interface energy anisotropy between Si-particle and the aluminium phase is the only reason for using isotropic interface energy in simulations. The thermodynamic driving force for the phase transformation of the silicon into the aluminium phase is computed from the data obtained from the JMatPro software for aluminium alloys
Effect of multiple Higgs fields on the phase structure of the SU(2)-Higgs model
International Nuclear Information System (INIS)
Wurtz, Mark; Steele, T. G.; Lewis, Randy
2009-01-01
The SU(2)-Higgs model, with a single Higgs field in the fundamental representation and a quartic self-interaction, has a Higgs region and a confinement region which are analytically connected in the parameter space of the theory; these regions thus represent a single phase. The effect of multiple Higgs fields on this phase structure is examined via Monte Carlo lattice simulations. For the case of N≥2 identical Higgs fields, there is no remaining analytic connection between the Higgs and confinement regions, at least when Lagrangian terms that directly couple different Higgs flavors are omitted. An explanation of this result in terms of enhancement from overlapping phase transitions is explored for N=2 by introducing an asymmetry in the hopping parameters of the Higgs fields. It is found that an enhancement of the phase transitions can still occur for a moderate (10%) asymmetry in the resulting hopping parameters.
Zhu, Guangpu
2018-04-17
In this paper, we consider the numerical approximation of a binary fluid-surfactant phase field model of two-phase incompressible flow. The nonlinearly coupled model consists of two Cahn-Hilliard type equations and incompressible Navier-Stokes equations. Using the Invariant Energy Quadratization (IEQ) approach, the governing system is transformed into an equivalent form, which allows the nonlinear potentials to be treated efficiently and semi-explicitly. we construct a first and a second-order time marching schemes, which are extremely efficient and easy-to-implement, for the transformed governing system. At each time step, the schemes involve solving a sequence of linear elliptic equations, and computations of phase variables, velocity and pressure are totally decoupled. We further establish a rigorous proof of unconditional energy stability for the semi-implicit schemes. Numerical results in both two and three dimensions are obtained, which demonstrate that the proposed schemes are accurate, efficient and unconditionally energy stable. Using our schemes, we investigate the effect of surfactants on droplet deformation and collision under a shear flow. The increase of surfactant concentration can enhance droplet deformation and inhibit droplet coalescence.
Zhu, Guangpu; Kou, Jisheng; Sun, Shuyu; Yao, Jun; Li, Aifen
2018-01-01
In this paper, we consider the numerical approximation of a binary fluid-surfactant phase field model of two-phase incompressible flow. The nonlinearly coupled model consists of two Cahn-Hilliard type equations and incompressible Navier-Stokes equations. Using the Invariant Energy Quadratization (IEQ) approach, the governing system is transformed into an equivalent form, which allows the nonlinear potentials to be treated efficiently and semi-explicitly. we construct a first and a second-order time marching schemes, which are extremely efficient and easy-to-implement, for the transformed governing system. At each time step, the schemes involve solving a sequence of linear elliptic equations, and computations of phase variables, velocity and pressure are totally decoupled. We further establish a rigorous proof of unconditional energy stability for the semi-implicit schemes. Numerical results in both two and three dimensions are obtained, which demonstrate that the proposed schemes are accurate, efficient and unconditionally energy stable. Using our schemes, we investigate the effect of surfactants on droplet deformation and collision under a shear flow. The increase of surfactant concentration can enhance droplet deformation and inhibit droplet coalescence.
Phase-field-crystal model for magnetocrystalline interactions in isotropic ferromagnetic solids
Faghihi, Niloufar; Provatas, Nikolas; Elder, K. R.; Grant, Martin; Karttunen, Mikko
2013-09-01
An isotropic magnetoelastic phase-field-crystal model to study the relation between morphological structure and magnetic properties of pure ferromagnetic solids is introduced. Analytic calculations in two dimensions were used to determine the phase diagram and obtain the relationship between elastic strains and magnetization. Time-dependent numerical simulations in two dimensions were used to demonstrate the effect of grain boundaries on the formation of magnetic domains. It was shown that the grain boundaries act as nucleating sites for domains of reverse magnetization. Finally, we derive a relation for coercivity versus grain misorientation in the isotropic limit.
International Nuclear Information System (INIS)
Zhang, Lijun; Stratmann, Matthias; Du, Yong; Sundman, Bo; Steinbach, Ingo
2015-01-01
A new approach to incorporate the sublattice models in the CALPHAD (CALculation of PHAse Diagram) formalism directly into the phase-field formalism is developed. In binary alloys, the sublattice models can be classified into two types (i.e., “Type I” and “Type II”), depending on whether a direct one-to-one relation between the element site fraction in the CALPHAD database and the phase concentration in the phase-field model exists (Type I), or not (Type II). For “Type II” sublattice models, the specific site fractions, corresponding to a given mole fraction, have to be established via internal relaxation between different sublattices. Internal minimization of sublattice occupancy and solute evolution during microstructure transformation leads, in general, to a solution superior to the separate solution of the individual problems. The present coupling technique is validated for Fe–C and Ni–Al alloys. Finally, the model is extended into multicomponent alloys and applied to simulate the nucleation process of VC monocarbide from austenite matrix in a steel containing vanadium
International Nuclear Information System (INIS)
Radhakrishnan, B.; Gorti, S.B.; Clarno, K.; Tonks, M.R.
2015-01-01
In this work, the phase-field method and its application to microstructure evolution in reactor fuel and clad are discussed. The examples highlight the capability of the phase-field method to capture evolution processes that are influenced by both thermal and elastic stress fields that are caused by microstructural changes in the solid-state. The challenges that need to be overcome before the technique can become predictive and material-specific are discussed. (authors)
Phase-field modelling of as-cast microstructure evolution in nickel-based superalloys
International Nuclear Information System (INIS)
Warnken, N.; Ma, D.; Drevermann, A.; Reed, R.C.; Fries, S.G.; Steinbach, I.
2009-01-01
A modelling approach is presented for the prediction of microstructure evolution during directional solidification of nickel-based superalloys. A phase-field model is coupled to CALPHAD thermodynamic and kinetic (diffusion) databases, so that a multicomponent alloy representative of those used in industrial practice can be handled. Dendritic growth and the formation of interdendritic phases in an isothermal (2-D) cross-section are simulated for a range of solidification parameters. The sensitivity of the model to changes in the solidification input parameters is investigated. It is demonstrated that the predicted patterns of microsegregation obtained from the simulations compare well to the experimental ones; moreover, an experimentally observed change in the solidification sequence is correctly predicted. The extension of the model to 3-D simulations is demonstrated. Simulations of the homogenization of the as-cast structure during heat treatment are presented.
Phase-field modelling of as-cast microstructure evolution in nickel-based superalloys
Energy Technology Data Exchange (ETDEWEB)
Warnken, N., E-mail: n.warnken@bham.ac.uk [University of Birmingham, Department of Metallurgy and Materials, Edgbaston, Birmingham B15 2TT (United Kingdom); Ma, D. [Foundry Institute of the RWTH-Aachen, Intzestr. 5, 52072 Aachen (Germany); Drevermann, A. [ACCESS e.V., Intzestr. 5, 52072 Aachen (Germany); Reed, R.C. [University of Birmingham, Department of Metallurgy and Materials, Edgbaston, Birmingham B15 2TT (United Kingdom); Fries, S.G. [SGF Consultancy, 52064 Aachen (Germany)] [ICAMS, Ruhr University Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany); Steinbach, I. [ICAMS, Ruhr University Bochum, Stiepeler Strasse 129, D-44780 Bochum (Germany)
2009-11-15
A modelling approach is presented for the prediction of microstructure evolution during directional solidification of nickel-based superalloys. A phase-field model is coupled to CALPHAD thermodynamic and kinetic (diffusion) databases, so that a multicomponent alloy representative of those used in industrial practice can be handled. Dendritic growth and the formation of interdendritic phases in an isothermal (2-D) cross-section are simulated for a range of solidification parameters. The sensitivity of the model to changes in the solidification input parameters is investigated. It is demonstrated that the predicted patterns of microsegregation obtained from the simulations compare well to the experimental ones; moreover, an experimentally observed change in the solidification sequence is correctly predicted. The extension of the model to 3-D simulations is demonstrated. Simulations of the homogenization of the as-cast structure during heat treatment are presented.
Finite-deformation phase-field chemomechanics for multiphase, multicomponent solids
Svendsen, Bob; Shanthraj, Pratheek; Raabe, Dierk
2018-03-01
The purpose of this work is the development of a framework for the formulation of geometrically non-linear inelastic chemomechanical models for a mixture of multiple chemical components diffusing among multiple transforming solid phases. The focus here is on general model formulation. No specific model or application is pursued in this work. To this end, basic balance and constitutive relations from non-equilibrium thermodynamics and continuum mixture theory are combined with a phase-field-based description of multicomponent solid phases and their interfaces. Solid phase modeling is based in particular on a chemomechanical free energy and stress relaxation via the evolution of phase-specific concentration fields, order-parameter fields (e.g., related to chemical ordering, structural ordering, or defects), and local internal variables. At the mixture level, differences or contrasts in phase composition and phase local deformation in phase interface regions are treated as mixture internal variables. In this context, various phase interface models are considered. In the equilibrium limit, phase contrasts in composition and local deformation in the phase interface region are determined via bulk energy minimization. On the chemical side, the equilibrium limit of the current model formulation reduces to a multicomponent, multiphase, generalization of existing two-phase binary alloy interface equilibrium conditions (e.g., KKS). On the mechanical side, the equilibrium limit of one interface model considered represents a multiphase generalization of Reuss-Sachs conditions from mechanical homogenization theory. Analogously, other interface models considered represent generalizations of interface equilibrium conditions consistent with laminate and sharp-interface theory. In the last part of the work, selected existing models are formulated within the current framework as special cases and discussed in detail.
Directory of Open Access Journals (Sweden)
Henrique Silva Furtado
2009-09-01
Full Text Available Numerical simulation of solute trapping during solidification, using two phase-field model for dilute binary alloys developed by Kim et al. [Phys. Rev. E, 60, 7186 (1999] and Ramirez et al. [Phys. Rev. E, 69, 05167 (2004] is presented here. The simulations on dilute Cu-Ni alloy are in good agreement with one dimensional analytic solution of sharp interface model. Simulation conducted under small solidification velocity using solid-liquid interface thickness (2λ of 8 nanometers reproduced the solute (Cu equilibrium partition coefficient. The spurious numerical solute trapping in solid phase, due to the interface thickness was negligible. A parameter used in analytical solute trapping model was determined by isothermal phase-field simulation of Ni-Cu alloy. Its application to Si-As and Si-Bi alloys reproduced results that agree reasonably well with experimental data. A comparison between the three models of solute trapping (Aziz, Sobolev and Galenko [Phys. Rev. E, 76, 031606 (2007] was performed. It resulted in large differences in predicting the solidification velocity for partition-less solidification, indicating the necessity for new and more acute experimental data.
International Nuclear Information System (INIS)
Wen, Y.H.; Lill, J.V.; Chen, S.L.; Simmons, J.P.
2010-01-01
A ternary phase-field model was developed that is linked directly to commercial CALPHAD software to provide quantitative thermodynamic driving forces. A recently available diffusion mobility database for ordered phases is also implemented to give a better description of the diffusion behavior in alloys. Because the targeted application of this model is the study of precipitation in Ni-based superalloys, a Ni-Al-Cr model alloy was constructed. A detailed description of this model is given in the paper. We have considered the misfit effects of the partitioning of the two solute elements. Transformation rules of the dual representation of the γ+γ ' microstructure by CALPHAD and by the phase field are established and the link with commercial CALPHAD software is described. Proof-of-concept tests were performed to evaluate the model and the results demonstrate that the model can qualitatively reproduce observed γ ' precipitation behavior. Uphill diffusion of Al is observed in a few diffusion couples, showing the significant influence of Cr on the chemical potential of Al. Possible applications of this model are discussed.
New mean-field calculations for the phase diagram of the Annni model
International Nuclear Information System (INIS)
Tome, T.; Salinas, S.R.A.
1987-01-01
A variational procedure, with the inclusion of some spin fluctuations, to go beyond the standard layer-by-layer mean-field calculations for the T-p phase diagram of the ANNNI model is used. The high temperature region is studied analytically. The transition lines meet smoothly at the Lifshitz point, which is an inflection point of the second-order paramagnetic border. At low temperature, these numerical resuls confirm the stability of the main commensurate phases and show a quantitative trend towards the preductions f the Monte Carlo analyses. (author) [pt
International Nuclear Information System (INIS)
Kinoshita, Takehiro; Fujiyama, Shinya; Idogaki, Toshihiro; Tokita, Masahiko
2009-01-01
The non-equilibrium phase transition in a ferromagnetic Ising model is investigated by use of a new type of effective field theory (EFT) which correctly accounts for all the single-site kinematic relations by differential operator technique. In the presence of a time dependent oscillating external field, with decrease of the temperature the system undergoes a dynamic phase transition, which is characterized by the period averaged magnetization Q, from a dynamically disordered state Q = 0 to the dynamically ordered state Q ≠ 0. The results of the dynamic phase transition point T c determined from the behavior of the dynamic magnetization and the Liapunov exponent provided by EFT are improved than that of the standard mean field theory (MFT), especially for the one dimensional lattice where the standard MFT gives incorrect result of T c = 0 even in the case of zero external field.
International Nuclear Information System (INIS)
Fattebert, J.-L.; Wickett, M.E.; Turchi, P.E.A.
2014-01-01
A numerical method for the simulation of microstructure evolution during the solidification of an alloy is presented. The approach is based on a phase-field model including a phase variable, an orientation variable given by a quaternion, the alloy composition and a uniform temperature field. Energies and diffusion coefficients used in the model rely on thermodynamic and kinetic databases in the framework of the CALPHAD methodology. The numerical approach is based on a finite volume discretization and an implicit time-stepping algorithm. Numerical results for solidification and accompanying coring effect in a Au–Ni alloy are used to illustrate the methodology
Intermittent dislocation density fluctuations in crystal plasticity from a phase-field crystal model
DEFF Research Database (Denmark)
Tarp, Jens M.; Angheluta, Luiza; Mathiesen, Joachim
2014-01-01
Plastic deformation mediated by collective dislocation dynamics is investigated in the two-dimensional phase-field crystal model of sheared single crystals. We find that intermittent fluctuations in the dislocation population number accompany bursts in the plastic strain-rate fluctuations...... propose a simple stochastic model of dislocation reaction kinetics that is able to capture these statistical properties of the dislocation density fluctuations as a function of shear rate....
International Nuclear Information System (INIS)
Zhokhov, R.N.; Kolmakov, P. B.; Zhukovsky, V.Ch.; Klimenko, K.G.
2016-01-01
In the paper there have been studied Gross-Neveu model in (2+1)-dimensional space-time with one compactified dimension in presence of external magnetic field at finite temperature. Magnetic field is directed along the uncompactified dimension that is along the axis of the cylinder on which the system lives. Chiral symmetry breaking and corresponding phase structure of the model is investigated in the leading order of (1/N) expansion
High-accuracy phase-field models for brittle fracture based on a new family of degradation functions
Sargado, Juan Michael; Keilegavlen, Eirik; Berre, Inga; Nordbotten, Jan Martin
2018-02-01
Phase-field approaches to fracture based on energy minimization principles have been rapidly gaining popularity in recent years, and are particularly well-suited for simulating crack initiation and growth in complex fracture networks. In the phase-field framework, the surface energy associated with crack formation is calculated by evaluating a functional defined in terms of a scalar order parameter and its gradients. These in turn describe the fractures in a diffuse sense following a prescribed regularization length scale. Imposing stationarity of the total energy leads to a coupled system of partial differential equations that enforce stress equilibrium and govern phase-field evolution. These equations are coupled through an energy degradation function that models the loss of stiffness in the bulk material as it undergoes damage. In the present work, we introduce a new parametric family of degradation functions aimed at increasing the accuracy of phase-field models in predicting critical loads associated with crack nucleation as well as the propagation of existing fractures. An additional goal is the preservation of linear elastic response in the bulk material prior to fracture. Through the analysis of several numerical examples, we demonstrate the superiority of the proposed family of functions to the classical quadratic degradation function that is used most often in the literature.
Energy Technology Data Exchange (ETDEWEB)
Zhang, Y.F. [Department of Physics, Suzhou University, Suzhou 215006 (China); Yan, S.L. [Department of Physics, Suzhou University, Suzhou 215006 (China); Jiangsu Key Loboratory of Film Materials, Suzhou University, Suzhou 215006 (China); CCAST (World Laboratory), PO Box 8730, Beijing 100080 (China)], E-mail: slyan@suda.edu.cn
2008-04-07
The phase diagrams and compensation behaviors of mixed spin-1/2 and spin-1 Blume-Capel model in a trimodal magnetic field are investigated in the framework of the effective field theory on simple cubic lattice. The change of negative crystal field and trimodal concentration can affect the TCP, the second-order phase and the magnetic field degeneration at ground state in T-H space. In T-D space, the trajectory of the TCP takes on the acre curve and there exist the two TCPs under certain condition. In addition to giving one or two compensation temperature points in M-T space, the mixed spin Blume-Capel model also provides one or two novel compensation magnetic field points in M-H space. Some results are not revealed in previous works.
International Nuclear Information System (INIS)
Danilov, Denis; Nestler, Britta; Guerdane, Mohammed; Teichler, Helmar
2009-01-01
Results are presented from phase-field modelling and molecular dynamics simulations concerning the relaxation dynamics in a finite-temperature two-phase crystal-liquid sample subjected to an abrupt temperature drop. Relaxation takes place by propagation of the solidification front under formation of a spatially varying concentration profile in the melt. The molecular dynamics simulations are carried out with an interatomic model appropriate for the NiZr alloy system and provide the thermophysical data required for setting up the phase-field simulations. Regarding the concentration profile and velocity of the solidification front, best agreement between the phase-field model and molecular dynamics simulation is obtained when increasing the apparent diffusion coefficients in the phase-field treatment by a factor of four against their molecular dynamics estimates.
Welland, M. J.; Tenuta, E.; Prudil, A. A.
2017-06-01
This article describes a phase-field model for an isothermal multicomponent, multiphase system which avoids implicit interfacial energy contributions by starting from a grand potential formulation. A method is developed for incorporating arbitrary forms of the equilibrium thermodynamic potentials in all phases to determine an explicit relationship between chemical potentials and species concentrations. The model incorporates variable densities between adjacent phases, defect migration, and dependence of internal pressure on object dimensions ranging from the macro- to nanoscale. A demonstrative simulation of an overpressurized nanoscopic intragranular bubble in nuclear fuel migrating to a grain boundary under kinetically limited vacancy diffusion is shown.
Phase Structure of Strong-Field Tunneling Wave Packets from Molecules.
Liu, Ming-Ming; Li, Min; Wu, Chengyin; Gong, Qihuang; Staudte, André; Liu, Yunquan
2016-04-22
We study the phase structure of the tunneling wave packets from strong-field ionization of molecules and present a molecular quantum-trajectory Monte Carlo model to describe the laser-driven dynamics of photoelectron momentum distributions of molecules. Using our model, we reproduce and explain the alignment-dependent molecular frame photoelectron spectra of strong-field tunneling ionization of N_{2} reported by M. Meckel et al. [Nat. Phys. 10, 594 (2014)]. In addition to modeling the low-energy photoelectron angular distributions quantitatively, we extract the phase structure of strong-field molecular tunneling wave packets, shedding light on its physical origin. The initial phase of the tunneling wave packets at the tunnel exit depends on both the initial transverse momentum distribution and the molecular internuclear distance. We further show that the ionizing molecular orbital has a critical effect on the initial phase of the tunneling wave packets. The phase structure of the photoelectron wave packet is a key ingredient for modeling strong-field molecular photoelectron holography, high-harmonic generation, and molecular orbital imaging.
Belmiloudi , Aziz; Rasheed , Amer
2015-01-01
In this paper we propose a numerical scheme and perform its numerical analysis devoted to an anisotropic phase-field model with convection under the influence of magnetic field for the isother-mal solidification of binary mixtures in two-dimensional geometry. Precisely, the numerical stability and error analysis of this approximation scheme which is based on mixed finite-element method are performed. The particular application of a nickelcopper (NiCu) binary alloy, with real physical paramete...
Zhang, Jingyi
Ferroelectric (FE) and closely related antiferroelectric (AFE) materials have unique electromechanical properties that promote various applications in the area of capacitors, sensors, generators (FE) and high density energy storage (AFE). These smart materials with extensive applications have drawn wide interest in the industrial and scientific world because of their reliability and tunable property. However, reliability issues changes its paradigms and requires guidance from detailed mechanism theory as the materials applications are pushed for better performance. A host of modeling work were dedicated to study the macro-structural behavior and microstructural evolution in FE and AFE material under various conditions. This thesis is focused on direct observation of domain evolution under multiphysics loading for both FE and AFE material. Landau-Devonshire time-dependent phase field models were built for both materials, and were simulated in finite element software Comsol. In FE model, dagger-shape 90 degree switched domain was observed at preexisting crack tip under pure mechanical loading. Polycrystal structure was tested under same condition, and blocking effect of the growth of dagger-shape switched domain from grain orientation difference and/or grain boundary was directly observed. AFE ceramic model was developed using two sublattice theory, this model was used to investigate the mechanism of energy efficiency increase with self-confined loading in experimental tests. Consistent results was found in simulation and careful investigation of calculation results gave confirmation that origin of energy density increase is from three aspects: self-confinement induced inner compression field as the cause of increase of critical field, fringe leak as the source of elevated saturation polarization and uneven defects distribution as the reason for critical field shifting and phase transition speed. Another important affecting aspect in polycrystalline materials is the
Elastic constants of stressed and unstressed materials in the phase-field crystal model
Wang, Zi-Le; Huang, Zhi-Feng; Liu, Zhirong
2018-04-01
A general procedure is developed to investigate the elastic response and calculate the elastic constants of stressed and unstressed materials through continuum field modeling, particularly the phase-field crystal (PFC) models. It is found that for a complete description of system response to elastic deformation, the variations of all the quantities of lattice wave vectors, their density amplitudes (including the corresponding anisotropic variation and degeneracy breaking), the average atomic density, and system volume should be incorporated. The quantitative and qualitative results of elastic constant calculations highly depend on the physical interpretation of the density field used in the model, and also importantly, on the intrinsic pressure that usually pre-exists in the model system. A formulation based on thermodynamics is constructed to account for the effects caused by constant pre-existing stress during the homogeneous elastic deformation, through the introducing of a generalized Gibbs free energy and an effective finite strain tensor used for determining the elastic constants. The elastic properties of both solid and liquid states can be well produced by this unified approach, as demonstrated by an analysis for the liquid state and numerical evaluations for the bcc solid phase. The numerical calculations of bcc elastic constants and Poisson's ratio through this method generate results that are consistent with experimental conditions, and better match the data of bcc Fe given by molecular dynamics simulations as compared to previous work. The general theory developed here is applicable to the study of different types of stressed or unstressed material systems under elastic deformation.
Aland, Sebastian; Lowengrub, John; Voigt, Axel
2012-10-01
Colloid particles that are partially wetted by two immiscible fluids can become confined to fluid-fluid interfaces. At sufficiently high volume fractions, the colloids may jam and the interface may crystallize. The fluids together with the interfacial colloids form an emulsion with interesting material properties and offer an important route to new soft materials. A promising approach to simulate these emulsions was presented in Aland et al. [Phys. Fluids 23, 062103 (2011)], where a Navier-Stokes-Cahn-Hilliard model for the macroscopic two-phase fluid system was combined with a surface phase-field-crystal model for the microscopic colloidal particles along the interface. Unfortunately this model leads to spurious velocities which require very fine spatial and temporal resolutions to accurately and stably simulate. In this paper we develop an improved Navier-Stokes-Cahn-Hilliard-surface phase-field-crystal model based on the principles of mass conservation and thermodynamic consistency. To validate our approach, we derive a sharp interface model and show agreement with the improved diffuse interface model. Using simple flow configurations, we show that the new model has much better properties and does not lead to spurious velocities. Finally, we demonstrate the solid-like behavior of the crystallized interface by simulating the fall of a solid ball through a colloid-laden multiphase fluid.
Phase-field modeling of Mn-Ni-Si precipitate behavior on the bcc-Fe matrix
International Nuclear Information System (INIS)
Chang, Kun Ok; Kwon, Jun Hyun
2016-01-01
The formation of Mn-Ni-Si precipitate (hereafter MNS precipitate) is widely accepted by one of the main reasons of late stage hardening and embrittlement of Reactor Pressure Vessel (RPV) during nuclear power plant (NPP) operation. Since MNS precipitate is not considered in current regulatory model, this late stage hardening can be a limiting factor for life extension of nuclear power plants up to 80 or more years. The stability of the MNS precipitate was investigated from the thermodynamic view point and they concluded that MNS precipitate is a stable phase even with very little Cu contents, and they assessed UW1 thermodynamic database which can predict the thermodynamic stability of MNS precipitate at operating temperature of NPP ( ∼ 290 .deg. C). Based on the non-classical nucleation theory, we performed the phase-field modeling of nucleation and growth of MNS precipitate. The microstructure evolution of Mn-Ni-Cu precipitate has been simulated using the phase-field method and their approaches are focused on a role of the Cu contents. Also, a role of the interstitial loop on the nucleation and growth kinetics of MNS precipitate was analyzed.
Dynamic phase transition in the kinetic spin-2 Blume-Emery-Griffiths model in an oscillating field
International Nuclear Information System (INIS)
Ertas, Mehmet; Canko, Osman; Keskin, Mustafa
2008-01-01
We extend our recent paper [M. Keskin, O. Canko, M. Ertas, J. Exp. Theor. Phys. (Sov. Phys. JETP) 105 (2007) 1190.] to present a study, within a mean-field approach, the stationary states of the kinetic spin-2 Blume-Emery-Griffiths model in the presence of a time-dependent oscillating magnetic field by using the Glauber-type of stochastic dynamics. We found 20 fundamental types of dynamic phase diagrams where exhibit more complex and richer phase diagrams than our recent paper. Especially, the obtained dynamic phase diagrams show the dynamic triple, quadruple and dynamic double critical end points besides dynamic tricritical points that depending on interaction parameters. The phase diagrams also exhibit a disordered (d) and the ferromagnetic-2 (f 2 ) phases, and the f 2 +d, f 2 +fq, fq+d, f 2 +f 1 +fq and f 2 +fq+d, where f 1 are fq the ferromagnetic-1 and ferroquadrupolar or simply quadrupolar phases respectively, coexistence phase regions that strongly depend on interaction parameters
Dynamic phase transition in the kinetic spin-2 Blume-Emery-Griffiths model in an oscillating field
Ertaş, Mehmet; Canko, Osman; Keskin, Mustafa
We extend our recent paper [M. Keskin, O. Canko, M. Ertaş, J. Exp. Theor. Phys. (Sov. Phys. JETP) 105 (2007) 1190.] to present a study, within a mean-field approach, the stationary states of the kinetic spin-2 Blume-Emery-Griffiths model in the presence of a time-dependent oscillating magnetic field by using the Glauber-type of stochastic dynamics. We found 20 fundamental types of dynamic phase diagrams where exhibit more complex and richer phase diagrams than our recent paper. Especially, the obtained dynamic phase diagrams show the dynamic triple, quadruple and dynamic double critical end points besides dynamic tricritical points that depending on interaction parameters. The phase diagrams also exhibit a disordered ( d) and the ferromagnetic-2 ( f2) phases, and the f2+ d, f2+ fq, fq+ d, f2+ f1+ fq and f2+ fq+ d, where f1 are fq the ferromagnetic-1 and ferroquadrupolar or simply quadrupolar phases respectively, coexistence phase regions that strongly depend on interaction parameters.
Rezaei Mianroodi, Jaber; Svendsen, Bob
2015-04-01
The purpose of the current work is the development of a phase field model for dislocation dissociation, slip and stacking fault formation in single crystals amenable to determination via atomistic or ab initio methods in the spirit of computational material design. The current approach is based in particular on periodic microelasticity (Wang and Jin, 2001; Bulatov and Cai, 2006; Wang and Li, 2010) to model the strongly non-local elastic interaction of dislocation lines via their (residual) strain fields. These strain fields depend in turn on phase fields which are used to parameterize the energy stored in dislocation lines and stacking faults. This energy storage is modeled here with the help of the "interface" energy concept and model of Cahn and Hilliard (1958) (see also Allen and Cahn, 1979; Wang and Li, 2010). In particular, the "homogeneous" part of this energy is related to the "rigid" (i.e., purely translational) part of the displacement of atoms across the slip plane, while the "gradient" part accounts for energy storage in those regions near the slip plane where atomic displacements deviate from being rigid, e.g., in the dislocation core. Via the attendant global energy scaling, the interface energy model facilitates an atomistic determination of the entire phase field energy as an optimal approximation of the (exact) atomistic energy; no adjustable parameters remain. For simplicity, an interatomic potential and molecular statics are employed for this purpose here; alternatively, ab initio (i.e., DFT-based) methods can be used. To illustrate the current approach, it is applied to determine the phase field free energy for fcc aluminum and copper. The identified models are then applied to modeling of dislocation dissociation, stacking fault formation, glide and dislocation reactions in these materials. As well, the tensile loading of a dislocation loop is considered. In the process, the current thermodynamic picture is compared with the classical mechanical
An energy-stable time-integrator for phase-field models
Vignal, Philippe
2016-12-27
We introduce a provably energy-stable time-integration method for general classes of phase-field models with polynomial potentials. We demonstrate how Taylor series expansions of the nonlinear terms present in the partial differential equations of these models can lead to expressions that guarantee energy-stability implicitly, which are second-order accurate in time. The spatial discretization relies on a mixed finite element formulation and isogeometric analysis. We also propose an adaptive time-stepping discretization that relies on a first-order backward approximation to give an error-estimator. This error estimator is accurate, robust, and does not require the computation of extra solutions to estimate the error. This methodology can be applied to any second-order accurate time-integration scheme. We present numerical examples in two and three spatial dimensions, which confirm the stability and robustness of the method. The implementation of the numerical schemes is done in PetIGA, a high-performance isogeometric analysis framework.
An energy-stable time-integrator for phase-field models
Vignal, Philippe; Collier, N.; Dalcin, Lisandro; Brown, D.L.; Calo, V.M.
2016-01-01
We introduce a provably energy-stable time-integration method for general classes of phase-field models with polynomial potentials. We demonstrate how Taylor series expansions of the nonlinear terms present in the partial differential equations of these models can lead to expressions that guarantee energy-stability implicitly, which are second-order accurate in time. The spatial discretization relies on a mixed finite element formulation and isogeometric analysis. We also propose an adaptive time-stepping discretization that relies on a first-order backward approximation to give an error-estimator. This error estimator is accurate, robust, and does not require the computation of extra solutions to estimate the error. This methodology can be applied to any second-order accurate time-integration scheme. We present numerical examples in two and three spatial dimensions, which confirm the stability and robustness of the method. The implementation of the numerical schemes is done in PetIGA, a high-performance isogeometric analysis framework.
Dynamic phase transition in the kinetic spin-3/2 Blume-Emery-Griffiths model in an oscillating field
Energy Technology Data Exchange (ETDEWEB)
Canko, Osman; Deviren, Bayram; Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2006-07-26
The dynamic phase transitions are studied, within a mean-field approach, in the kinetic Blume-Emery-Griffiths model under the presence of a time varying (sinusoidal) magnetic field by using the Glauber-type stochastic dynamics. The behaviour of the time-dependence of the order parameters and the behaviour of the average order parameters in a period, which is also called the dynamic order parameters, as a function of reduced temperature, are investigated. The nature (continuous and discontinuous) of transition is characterized by studying the average order parameters in a period. The dynamic phase transition points are obtained and the phase diagrams are presented in the reduced magnetic field amplitude and reduced temperature plane. The phase diagrams exhibit one, two, or three dynamic tricritical points and a dynamic double critical end point, and besides a disordered and two ordered phases, seven coexistence phase regions exist, which strongly depend on interaction parameters. We also calculate the Liapunov exponent to verify the stability of solutions and the dynamic phase transition points.
Dynamic phase transition in the kinetic spin-3/2 Blume-Emery-Griffiths model in an oscillating field
International Nuclear Information System (INIS)
Canko, Osman; Deviren, Bayram; Keskin, Mustafa
2006-01-01
The dynamic phase transitions are studied, within a mean-field approach, in the kinetic Blume-Emery-Griffiths model under the presence of a time varying (sinusoidal) magnetic field by using the Glauber-type stochastic dynamics. The behaviour of the time-dependence of the order parameters and the behaviour of the average order parameters in a period, which is also called the dynamic order parameters, as a function of reduced temperature, are investigated. The nature (continuous and discontinuous) of transition is characterized by studying the average order parameters in a period. The dynamic phase transition points are obtained and the phase diagrams are presented in the reduced magnetic field amplitude and reduced temperature plane. The phase diagrams exhibit one, two, or three dynamic tricritical points and a dynamic double critical end point, and besides a disordered and two ordered phases, seven coexistence phase regions exist, which strongly depend on interaction parameters. We also calculate the Liapunov exponent to verify the stability of solutions and the dynamic phase transition points
Rigorous derivation of porous-media phase-field equations
Schmuck, Markus; Kalliadasis, Serafim
2017-11-01
The evolution of interfaces in Complex heterogeneous Multiphase Systems (CheMSs) plays a fundamental role in a wide range of scientific fields such as thermodynamic modelling of phase transitions, materials science, or as a computational tool for interfacial flow studies or material design. Here, we focus on phase-field equations in CheMSs such as porous media. To the best of our knowledge, we present the first rigorous derivation of error estimates for fourth order, upscaled, and nonlinear evolution equations. For CheMs with heterogeneity ɛ, we obtain the convergence rate ɛ 1 / 4 , which governs the error between the solution of the new upscaled formulation and the solution of the microscopic phase-field problem. This error behaviour has recently been validated computationally in. Due to the wide range of application of phase-field equations, we expect this upscaled formulation to allow for new modelling, analytic, and computational perspectives for interfacial transport and phase transformations in CheMSs. This work was supported by EPSRC, UK, through Grant Nos. EP/H034587/1, EP/L027186/1, EP/L025159/1, EP/L020564/1, EP/K008595/1, and EP/P011713/1 and from ERC via Advanced Grant No. 247031.
The random field Blume-Capel model revisited
Santos, P. V.; da Costa, F. A.; de Araújo, J. M.
2018-04-01
We have revisited the mean-field treatment for the Blume-Capel model under the presence of a discrete random magnetic field as introduced by Kaufman and Kanner (1990). The magnetic field (H) versus temperature (T) phase diagrams for given values of the crystal field D were recovered in accordance to Kaufman and Kanner original work. However, our main goal in the present work was to investigate the distinct structures of the crystal field versus temperature phase diagrams as the random magnetic field is varied because similar models have presented reentrant phenomenon due to randomness. Following previous works we have classified the distinct phase diagrams according to five different topologies. The topological structure of the phase diagrams is maintained for both H - T and D - T cases. Although the phase diagrams exhibit a richness of multicritical phenomena we did not found any reentrant effect as have been seen in similar models.
Miehe, C; Teichtmeister, S; Aldakheel, F
2016-04-28
This work outlines a novel variational-based theory for the phase-field modelling of ductile fracture in elastic-plastic solids undergoing large strains. The phase-field approach regularizes sharp crack surfaces within a pure continuum setting by a specific gradient damage modelling. It is linked to a formulation of gradient plasticity at finite strains. The framework includes two independent length scales which regularize both the plastic response as well as the crack discontinuities. This ensures that the damage zones of ductile fracture are inside of plastic zones, and guarantees on the computational side a mesh objectivity in post-critical ranges. © 2016 The Author(s).
Lang, Johannes; Frank, Bernhard; Halimeh, Jad C.
2018-05-01
We construct the finite-temperature dynamical phase diagram of the fully connected transverse-field Ising model from the vantage point of two disparate concepts of dynamical criticality. An analytical derivation of the classical dynamics and exact diagonalization simulations are used to study the dynamics after a quantum quench in the system prepared in a thermal equilibrium state. The different dynamical phases characterized by the type of nonanalyticities that emerge in an appropriately defined Loschmidt-echo return rate directly correspond to the dynamical phases determined by the spontaneous breaking of Z2 symmetry in the long-time steady state. The dynamical phase diagram is qualitatively different depending on whether the initial thermal state is ferromagnetic or paramagnetic. Whereas the former leads to a dynamical phase diagram that can be directly related to its equilibrium counterpart, the latter gives rise to a divergent dynamical critical temperature at vanishing final transverse-field strength.
Aldakheel, Fadi; Wriggers, Peter; Miehe, Christian
2017-12-01
The modeling of failure in ductile materials must account for complex phenomena at the micro-scale, such as nucleation, growth and coalescence of micro-voids, as well as the final rupture at the macro-scale, as rooted in the work of Gurson (J Eng Mater Technol 99:2-15, 1977). Within a top-down viewpoint, this can be achieved by the combination of a micro-structure-informed elastic-plastic model for a porous medium with a concept for the modeling of macroscopic crack discontinuities. The modeling of macroscopic cracks can be achieved in a convenient way by recently developed continuum phase field approaches to fracture, which are based on the regularization of sharp crack discontinuities, see Miehe et al. (Comput Methods Appl Mech Eng 294:486-522, 2015). This avoids the use of complex discretization methods for crack discontinuities, and can account for complex crack patterns. In this work, we develop a new theoretical and computational framework for the phase field modeling of ductile fracture in conventional elastic-plastic solids under finite strain deformation. It combines modified structures of Gurson-Tvergaard-Needelman GTN-type plasticity model outlined in Tvergaard and Needleman (Acta Metall 32:157-169, 1984) and Nahshon and Hutchinson (Eur J Mech A Solids 27:1-17, 2008) with a new evolution equation for the crack phase field. An important aspect of this work is the development of a robust Explicit-Implicit numerical integration scheme for the highly nonlinear rate equations of the enhanced GTN model, resulting with a low computational cost strategy. The performance of the formulation is underlined by means of some representative examples, including the development of the experimentally observed cup-cone failure mechanism.
A phase-field and electron microscopy study of phase separation in Fe-Cr alloys
Energy Technology Data Exchange (ETDEWEB)
Hedstroem, Peter, E-mail: pheds@kth.se [Materials Science and Engineering, KTH (Royal Institute of Technology), SE-100 44 Stockholm (Sweden); Baghsheikhi, Saeed [Materials Science and Engineering, KTH (Royal Institute of Technology), SE-100 44 Stockholm (Sweden); Liu, Ping [Sandvik Materials Technology, R and D Centre, SE-81181 Sandviken (Sweden); Odqvist, Joakim [Materials Science and Engineering, KTH (Royal Institute of Technology), SE-100 44 Stockholm (Sweden); Sandvik Materials Technology, R and D Centre, SE-81181 Sandviken (Sweden)
2012-02-01
Highlights: Black-Right-Pointing-Pointer Experimental characterization and Phase-field modeling of phase separation in Fe-Cr. Black-Right-Pointing-Pointer Transition from particle-like to spinodal-like structure observed. Black-Right-Pointing-Pointer Structural evolution generates increased hardness. Black-Right-Pointing-Pointer Results in agreement with recent thermodynamic description. Black-Right-Pointing-Pointer Quantitative kinetic modeling must include thermal noise and improved kinetic data. - Abstract: Phase separation in the binary Fe-Cr system, the basis for the entire stainless steel family, is considered responsible for the low temperature embrittlement in ferritic, martensitic and duplex stainless steels. These steels are often used in load-bearing applications with considerable service time at elevated temperature. Thus, understanding the effect of microstructure on mechanical properties and predicting dynamics of phase separation are key issues. In the present work, experimental evaluation of structure and mechanical properties in binary Fe-Cr alloys as well as phase-field modeling, using a new thermodynamic description of Fe-Cr, is conducted. A significant hardening evolution with time is found for alloys aged between 400 and 550 Degree-Sign C, and it can be attributed to phase separation. The decomposed structure changed with increasing Cr content at 500 Degree-Sign C, with a more particle-like structure at 25 wt% Cr and a more spinodal-like structure at 30 wt% Cr. The observed transition of structure agrees with the thermodynamically predicted spinodal, although the transition is expected to be gradual. The phase-field simulations qualitatively agree with experiments. However, to enable accurate quantitative predictions, the diffusional mobilities must be evaluated further and thermal fluctuations as well as 3D diffusion fields must be properly accounted for.
An adaptive time-stepping strategy for solving the phase field crystal model
International Nuclear Information System (INIS)
Zhang, Zhengru; Ma, Yuan; Qiao, Zhonghua
2013-01-01
In this work, we will propose an adaptive time step method for simulating the dynamics of the phase field crystal (PFC) model. The numerical simulation of the PFC model needs long time to reach steady state, and then large time-stepping method is necessary. Unconditionally energy stable schemes are used to solve the PFC model. The time steps are adaptively determined based on the time derivative of the corresponding energy. It is found that the use of the proposed time step adaptivity cannot only resolve the steady state solution, but also the dynamical development of the solution efficiently and accurately. The numerical experiments demonstrate that the CPU time is significantly saved for long time simulations
Dynamic phase transition in the kinetic spin-2 Blume-Emery-Griffiths model in an oscillating field
Energy Technology Data Exchange (ETDEWEB)
Ertas, Mehmet [Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Canko, Osman [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)], E-mail: keskin@erciyes.edu.tr
2008-06-15
We extend our recent paper [M. Keskin, O. Canko, M. Ertas, J. Exp. Theor. Phys. (Sov. Phys. JETP) 105 (2007) 1190.] to present a study, within a mean-field approach, the stationary states of the kinetic spin-2 Blume-Emery-Griffiths model in the presence of a time-dependent oscillating magnetic field by using the Glauber-type of stochastic dynamics. We found 20 fundamental types of dynamic phase diagrams where exhibit more complex and richer phase diagrams than our recent paper. Especially, the obtained dynamic phase diagrams show the dynamic triple, quadruple and dynamic double critical end points besides dynamic tricritical points that depending on interaction parameters. The phase diagrams also exhibit a disordered (d) and the ferromagnetic-2 (f{sub 2}) phases, and the f{sub 2}+d, f{sub 2}+fq, fq+d, f{sub 2}+f{sub 1}+fq and f{sub 2}+fq+d, where f{sub 1} are fq the ferromagnetic-1 and ferroquadrupolar or simply quadrupolar phases respectively, coexistence phase regions that strongly depend on interaction parameters.
A fracture-controlled path-following technique for phase-field modeling of brittle fracture
Singh, N.; Verhoosel, C.V.; De Borst, R.; Van Brummelen, E.H.
2016-01-01
In the phase-field description of brittle fracture, the fracture-surface area can be expressed as a functional of the phase field (or damage field). In this work we study the applicability of this explicit expression as a (non-linear) path-following constraint to robustly track the equilibrium path
Quantum phase transition of the transverse-field quantum Ising model on scale-free networks.
Yi, Hangmo
2015-01-01
I investigate the quantum phase transition of the transverse-field quantum Ising model in which nearest neighbors are defined according to the connectivity of scale-free networks. Using a continuous-time quantum Monte Carlo simulation method and the finite-size scaling analysis, I identify the quantum critical point and study its scaling characteristics. For the degree exponent λ=6, I obtain results that are consistent with the mean-field theory. For λ=4.5 and 4, however, the results suggest that the quantum critical point belongs to a non-mean-field universality class. Further simulations indicate that the quantum critical point remains mean-field-like if λ>5, but it continuously deviates from the mean-field theory as λ becomes smaller.
Energy Technology Data Exchange (ETDEWEB)
Ertaş, Mehmet, E-mail: mehmetertas@erciyes.edu.tr; Keskin, Mustafa
2015-03-01
By using the path probability method (PPM) with point distribution, we study the dynamic phase transitions (DPTs) in the Blume–Emery–Griffiths (BEG) model under an oscillating external magnetic field. The phases in the model are obtained by solving the dynamic equations for the average order parameters and a disordered phase, ordered phase and four mixed phases are found. We also investigate the thermal behavior of the dynamic order parameters to analyze the nature dynamic transitions as well as to obtain the DPT temperatures. The dynamic phase diagrams are presented in three different planes in which exhibit the dynamic tricritical point, double critical end point, critical end point, quadrupole point, triple point as well as the reentrant behavior, strongly depending on the values of the system parameters. We compare and discuss the dynamic phase diagrams with dynamic phase diagrams that were obtained within the Glauber-type stochastic dynamics based on the mean-field theory. - Highlights: • Dynamic magnetic behavior of the Blume–Emery–Griffiths system is investigated by using the path probability method. • The time variations of average magnetizations are studied to find the phases. • The temperature dependence of the dynamic magnetizations is investigated to obtain the dynamic phase transition points. • We compare and discuss the dynamic phase diagrams with dynamic phase diagrams that were obtained within the Glauber-type stochastic dynamics based on the mean-field theory.
International Nuclear Information System (INIS)
Ertaş, Mehmet; Keskin, Mustafa
2015-01-01
By using the path probability method (PPM) with point distribution, we study the dynamic phase transitions (DPTs) in the Blume–Emery–Griffiths (BEG) model under an oscillating external magnetic field. The phases in the model are obtained by solving the dynamic equations for the average order parameters and a disordered phase, ordered phase and four mixed phases are found. We also investigate the thermal behavior of the dynamic order parameters to analyze the nature dynamic transitions as well as to obtain the DPT temperatures. The dynamic phase diagrams are presented in three different planes in which exhibit the dynamic tricritical point, double critical end point, critical end point, quadrupole point, triple point as well as the reentrant behavior, strongly depending on the values of the system parameters. We compare and discuss the dynamic phase diagrams with dynamic phase diagrams that were obtained within the Glauber-type stochastic dynamics based on the mean-field theory. - Highlights: • Dynamic magnetic behavior of the Blume–Emery–Griffiths system is investigated by using the path probability method. • The time variations of average magnetizations are studied to find the phases. • The temperature dependence of the dynamic magnetizations is investigated to obtain the dynamic phase transition points. • We compare and discuss the dynamic phase diagrams with dynamic phase diagrams that were obtained within the Glauber-type stochastic dynamics based on the mean-field theory
Modeling of microstructure evolution in direct metal laser sintering: A phase field approach
Nandy, Jyotirmoy; Sarangi, Hrushikesh; Sahoo, Seshadev
2017-02-01
Direct Metal Laser Sintering (DMLS) is a new technology in the field of additive manufacturing, which builds metal parts in a layer by layer fashion directly from the powder bed. The process occurs within a very short time period with rapid solidification rate. Slight variations in the process parameters may cause enormous change in the final build parts. The physical and mechanical properties of the final build parts are dependent on the solidification rate which directly affects the microstructure of the material. Thus, the evolving of microstructure plays a vital role in the process parameters optimization. Nowadays, the increase in computational power allows for direct simulations of microstructures during materials processing for specific manufacturing conditions. In this study, modeling of microstructure evolution of Al-Si-10Mg powder in DMLS process was carried out by using a phase field approach. A MATLAB code was developed to solve the set of phase field equations, where simulation parameters include temperature gradient, laser scan speed and laser power. The effects of temperature gradient on microstructure evolution were studied and found that with increase in temperature gradient, the dendritic tip grows at a faster rate.
Phase field modelling of dynamic thermal fracture in the context of irradiation damage
Schlüter, Alexander; Müller, Ralf; Tomut, Marilena; Trautmann , Christina; Weick, Helmut; Plate, Carolin
2015-01-01
This work presents a continuum mechanics approach to model fracturing processes in brittle materials that are subjected to rapidly applied high-temperature gradients. Such a type of loading typically occurs when a solid is exposed to an intense high-energy particle beam that deposits a large amount of energy into a small sample volume. Given the rapid energy deposition leading to a fast temperature increase, dynamic effects have to be considered. Our existing phase field model for dynamic fracture is thus extended in a way that allows modelling of thermally induced fracture. A finite element scheme is employed to solve the governing partial differential equations numerically. Finally, the functionality of our model is illustrated by two examples.
Superfluid and insulating phases in an interacting-boson model: mean-field theory and the RPA
International Nuclear Information System (INIS)
Sheshadri, K.; Pandit, R.; Krishnamurthy, H.R.; Ramakrishnan, T.V.
1993-01-01
The bosonic Hubbard model is studied via a simple mean-field theory. At zero temperature, in addition to yielding a phase diagram that is qualitatively correct, namely a superfluid phase for non-integer fillings and a Mott transition from a superfluid to an insulating phase for integer fillings, this theory gives results that are in good agreement with Monte Carlo simulations. In particular, the superfluid fraction obtained as a function of the interaction strength U for both integer and non-integer fillings is close to the simulation results. In all phases the excitation spectra are obtained by using the random phase approximation (RPA): the spectrum has a gap in the insulating phase and is gapless (and linear at small wave vectors) in the superfluid phase. Analytic results are presented in the limits of large U and small superfluid density. Finite-temperature phase diagrams and the Mott-insulator-normal-phase crossover are also described. (orig.)
Phase field approaches of bone remodeling based on TIP
Ganghoffer, Jean-François; Rahouadj, Rachid; Boisse, Julien; Forest, Samuel
2016-01-01
The process of bone remodeling includes a cycle of repair, renewal, and optimization. This adaptation process, in response to variations in external loads and chemical driving factors, involves three main types of bone cells: osteoclasts, which remove the old pre-existing bone; osteoblasts, which form the new bone in a second phase; osteocytes, which are sensing cells embedded into the bone matrix, trigger the aforementioned sequence of events. The remodeling process involves mineralization of the bone in the diffuse interface separating the marrow, which contains all specialized cells, from the newly formed bone. The main objective advocated in this contribution is the setting up of a modeling and simulation framework relying on the phase field method to capture the evolution of the diffuse interface between the new bone and the marrow at the scale of individual trabeculae. The phase field describes the degree of mineralization of this diffuse interface; it varies continuously between the lower value (no mineral) and unity (fully mineralized phase, e.g. new bone), allowing the consideration of a diffuse moving interface. The modeling framework is the theory of continuous media, for which field equations for the mechanical, chemical, and interfacial phenomena are written, based on the thermodynamics of irreversible processes. Additional models for the cellular activity are formulated to describe the coupling of the cell activity responsible for bone production/resorption to the kinetics of the internal variables. Kinetic equations for the internal variables are obtained from a pseudo-potential of dissipation. The combination of the balance equations for the microforce associated to the phase field and the kinetic equations lead to the Ginzburg-Landau equation satisfied by the phase field with a source term accounting for the dissipative microforce. Simulations illustrating the proposed framework are performed in a one-dimensional situation showing the evolution of
Energy Technology Data Exchange (ETDEWEB)
Ertaş, Mehmet, E-mail: mehmetertas@erciyes.edu.tr; Keskin, Mustafa
2015-08-15
Herein we study the dynamic phase transition properties for the mixed spin-(1/2, 1) Ising model on a square lattice under a time-dependent magnetic field by means of the effective-field theory (EFT) with correlations based on Glauber dynamics. We present the dynamic phase diagrams in the reduced magnetic field amplitude and reduced temperature plane and find that the phase diagrams exhibit dynamic tricitical behavior, multicritical and zero-temperature critical points as well as reentrant behavior. We also investigate the influence of frequency (ω) and observe that for small values of ω the mixed phase disappears, but for high values it appears and the system displays reentrant behavior as well as a critical end point. - Highlights: • Dynamic behaviors of a ferrimagnetic mixed spin (1/2, 1) Ising system are studied. • We examined the effects of the Hamiltonian parameters on the dynamic behaviors. • The phase diagrams are obtained in (T-h) plane. • The dynamic phase diagrams exhibit the dynamic tricritical and reentrant behaviors.
International Nuclear Information System (INIS)
Ertaş, Mehmet; Keskin, Mustafa
2015-01-01
Herein we study the dynamic phase transition properties for the mixed spin-(1/2, 1) Ising model on a square lattice under a time-dependent magnetic field by means of the effective-field theory (EFT) with correlations based on Glauber dynamics. We present the dynamic phase diagrams in the reduced magnetic field amplitude and reduced temperature plane and find that the phase diagrams exhibit dynamic tricitical behavior, multicritical and zero-temperature critical points as well as reentrant behavior. We also investigate the influence of frequency (ω) and observe that for small values of ω the mixed phase disappears, but for high values it appears and the system displays reentrant behavior as well as a critical end point. - Highlights: • Dynamic behaviors of a ferrimagnetic mixed spin (1/2, 1) Ising system are studied. • We examined the effects of the Hamiltonian parameters on the dynamic behaviors. • The phase diagrams are obtained in (T-h) plane. • The dynamic phase diagrams exhibit the dynamic tricritical and reentrant behaviors
Czech Academy of Sciences Publication Activity Database
DeSimone, A.; Kružík, Martin
2013-01-01
Roč. 8, č. 2 (2013), s. 481-499 ISSN 1556-1801 R&D Projects: GA ČR(CZ) GAP201/12/0671 Institutional support: RVO:67985556 Keywords : hysteresis * shape memory Subject RIV: BA - General Mathematics Impact factor: 0.952, year: 2013 http://library.utia.cas.cz/separaty/2013/MTR/kruzik-domain patterns and hysteresis in phase-transforming solids analysis and numerical simulations of a sharp interface dissipative model via phase-field approximation.pdf
Dislocations via incompatibilities in phase-field models of microstructure evolution
Czech Academy of Sciences Publication Activity Database
Gröger, Roman; Marchand, B.; Lookman, T.
2016-01-01
Roč. 94, č. 5 (2016), 054105-1-054105-13 ISSN 2469-9950 R&D Projects: GA ČR(CZ) GA16-13797S; GA MŠk(CZ) LQ1601 Grant - others:Marie Curie Actions(CZ) 247705 MesoPhysDel Institutional support: RVO:68081723 Keywords : dislocation * incompatibility * phase field * Nye tensor * phase transition Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 3.836, year: 2016
Dynamic of Ising model with transverse field for two coupled sublattices in disordered phase
International Nuclear Information System (INIS)
Sa Motta, C.E.H. de.
1984-02-01
The dynamics of the two coupled sublattices tridimensional Ising model in a transverse field was studied by means of a continued fraction expansion for coupled operators. The static Correlation Functions necessary for studying the dynamics were calculated with the Green's Functions Method in the Random Phase Approximation (RPA). The spectral function was calculated in the region T c → . (Author) [pt
El-Amin, Mohamed; Saad, Adel; Salama, Amgad; Sun, Shuyu
2017-01-01
In this paper, the magnetic nanoparticles are injected into a water-oil, two-phase system under the influence of an external permanent magnetic field. We lay down the mathematical model and provide a set of numerical exercises of hypothetical cases to show how an external magnetic field can influence the transport of nanoparticles in the proposed two-phase system in porous media. We treat the water-nanoparticles suspension as a miscible mixture, whereas it is immiscible with the oil phase. The magnetization properties, the density, and the viscosity of the ferrofluids are obtained based on mixture theory relationships. In the mathematical model, the phase pressure contains additional term to account for the extra pressures due to fluid magnetization effect and the magnetostrictive effect. As a proof of concept, the proposed model is applied on a countercurrent imbibition flow system in which both the displacing and the displaced fluids move in opposite directions. Physical variables, including waternanoparticles suspension saturation, nanoparticles concentration, and pore wall/throat concentrations of deposited nanoparticles, are investigated under the influence of the magnetic field. Two different locations of the magnet are studied numerically, and variations in permeability and porosity are considered.
El-Amin, Mohamed
2017-08-28
In this paper, the magnetic nanoparticles are injected into a water-oil, two-phase system under the influence of an external permanent magnetic field. We lay down the mathematical model and provide a set of numerical exercises of hypothetical cases to show how an external magnetic field can influence the transport of nanoparticles in the proposed two-phase system in porous media. We treat the water-nanoparticles suspension as a miscible mixture, whereas it is immiscible with the oil phase. The magnetization properties, the density, and the viscosity of the ferrofluids are obtained based on mixture theory relationships. In the mathematical model, the phase pressure contains additional term to account for the extra pressures due to fluid magnetization effect and the magnetostrictive effect. As a proof of concept, the proposed model is applied on a countercurrent imbibition flow system in which both the displacing and the displaced fluids move in opposite directions. Physical variables, including waternanoparticles suspension saturation, nanoparticles concentration, and pore wall/throat concentrations of deposited nanoparticles, are investigated under the influence of the magnetic field. Two different locations of the magnet are studied numerically, and variations in permeability and porosity are considered.
Energy Technology Data Exchange (ETDEWEB)
Temizer, Umuet [Department of Physics, Bozok University, 66100 Yozgat (Turkey); Kantar, Ersin [Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)], E-mail: keskin@erciyes.edu.tr; Canko, Osman [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2008-06-15
We study, within a mean-field approach, the stationary states of the kinetic Blume-Emery-Griffiths model with repulsive biquadratic coupling under the presence of a time-varying (sinusoidal) magnetic field. We employ the Glauber-type stochastic dynamics to construct set of dynamic equations of motion. The behavior of the time dependence of the order parameters and the behavior of the average order parameters in a period, which is also called the dynamic order parameters, as functions of the reduced temperature are investigated. The dynamic phase transition points are calculated and phase diagrams are presented in the reduced magnetic field amplitude and reduced temperature plane. The dynamical transition from one regime to the other can be of first- or second order depending on the region in the phase diagram. According to the values of the crystal field interaction or single-ion anisotropy constant and biquadratic exchange constant, we find 20 fundamental types of phase diagrams which exhibit many dynamic critical points, such as tricritical points, zero-temperature critical points, double critical end points, critical end point, triple point and multicritical point. Moreover, besides a disordered and ordered phases, seven coexistence phase regions exist in the system.
Directory of Open Access Journals (Sweden)
Jose Luiz Boldrini
2003-11-01
Full Text Available We study the existence and regularity of weak solutions of a phase field type model for pure material solidification in presence of natural convection. We assume that the non-stationary solidification process occurs in a two dimensional bounded domain. The governing equations of the model are the phase field equation coupled with a nonlinear heat equation and a modified Navier-Stokes equation. These equations include buoyancy forces modelled by Boussinesq approximation and a Carman-Koseny term to model the flow in mushy regions. Since these modified Navier-Stokes equations only hold in the non-solid regions, which are not known a priori, we have a free boundary-value problem.
International Nuclear Information System (INIS)
Lahey, Richard T.; Drew, Donald A.
2001-01-01
This paper reviews the state-of-the-art in the prediction of multidimensional multiphase flow and heat transfer phenomena using a four field, two-fluid model. It is shown that accurate mechanistic computational fluid dynamic (CFD) predictions are possible for a wide variety of adiabatic and diabatic flows using this computational model. In particular, the model is able to predict the bubbly air/water upflow data of Serizawa (Serizawa, A., 1974. Fluid dynamic characteristics of two-phase flow. Ph.D. thesis, (Nuclear Engineering), Kyoto University, Japan), the downflow data of Wang et al. (Wang, S.K., Lee, S.J., Lahey Jr., R.T., Jones, O.C., 1987. 3-D turbulence structure and phase distribution measurements in bubbly two-phase flows. Int. J. Multiphase Flow 13 (3), 327-343), the isosceles triangle upflow data of Lopez de Bertodano et al. (Lopez de Bertodano, M., Lahey Jr., R.T., Jones, O.C., 1994b. Phase distribution in bubbly two-phase flow in vertical ducts. Int. J. Multiphase Flow 20 (5), 805-818), the heated annular R-113 subcooled boiling data of Velidandala, et al. (Velidandla, V., Pulta, S., Roy, P., Kaira, S.P., 1995. Velocity field in turbulent subcooled boiling flow. ASME Preprint HTD-314, 107-123) and the R-113 CHF data of Hino and Ueda (Hino, R., Ueda, T., 1985. Studies on heat transfer and flow characteristics in subcooled boiling-part 2, flow characteristics. Int. J. Multiphase Flow 11, 283-297). It can also predict external two-phase flows, such as those for spreading two-phase jets (Bonetto, F., Lahey Jr., R.T., 1993. An experimental study on air carryunder due to a plunging liquid jet. Int. J. Multiphase Flow 19 (2), 281-294) and multiphase flows around the hull of naval surface ships (Carrica, P.M., Bonetto, F., Drew, D.A., Lahey, R.T., 1999. A polydispersed model for bubbly two-phase flow around a surface ship. Int. J. Multiphase Flow 25 (2), 257-305)
de Klerk, N.J.J.; Vasileiadis, A.; Smith, Raymond B.; Bazant, Martin Z.; Wagemaker, M.
2017-01-01
The improvement of Li-ion battery performance requires development of models that capture the essential physics and chemistry in Li-ion battery electrode materials. Phase-field modeling has recently been shown to have this ability, providing new opportunities to gain understanding of these complex
Three-dimensional phase-field simulations of directional solidification
Plapp, Mathis
2007-05-01
The phase-field method has become the method of choice for simulating microstructural pattern formation during solidification. One of its main advantages is that time-dependent three-dimensional simulations become feasible, which makes it possible to address long-standing questions of pattern stability and pattern selection. Here, a brief introduction to the phase-field model and its implementation is given, and its capabilities are illustrated by examples taken from the directional solidification of binary alloys. In particular, the morphological stability of hexagonal cellular arrays and of eutectic lamellar patterns is investigated.
Antisite Defects of the L12 Structure Determined by the Phase Field Microelasticity Model
International Nuclear Information System (INIS)
Jing, Zhang; Zheng, Chen; Yan-Li, Lu; Yong-Xin, Wang; Yan, Zhao
2009-01-01
A phase field microelasticity simulation is performed to examine the antisite defect of L1 2 -Ni 3 Al in Ni 75 Al 5.3 V 19.7 ternary alloy. Combinimg strain energy with the phase field model leads to an atom configuration change as time proceeds. For the Ni sublattice, the antisite defect Al Ni , the equilibrium occupancy probability (OP) of which declines, precedes Ni Ni and V Ni in reaching equilibrium; subsequently, Ni Ni and V Ni present a phenomenon of symmetrical rise and decline individually. Similarly, for the Al sublattice, the antisite defect Ni Al , the OP of which eventually rises, takes fewer time steps than Al Ai and V Al to attain equilibrium. Thereafter, Al Al rises while V Al declines symmetrically at the axes of the Ni Al MAI curve. Furthermore, the OP for the Al sublattice is much more sensitive to strain energy than that for the Ni sublattice. (condensed matter: structure, mechanical and thermal properties)
International Nuclear Information System (INIS)
Shing Lo, Tak; Karma, Alain; Plapp, Mathis
2001-01-01
During the directional solidification of peritectic alloys, two stable solid phases (parent and peritectic) grow competitively into a metastable liquid phase of larger impurity content than either solid phase. When the parent or both solid phases are morphologically unstable, i.e., for a small temperature gradient/growth rate ratio (G/v p ), one solid phase usually outgrows and covers the other phase, leading to a cellular-dendritic array structure closely analogous to the one formed during monophase solidification of a dilute binary alloy. In contrast, when G/v p is large enough for both phases to be morphologically stable, the formation of the microstructure becomes controlled by a subtle interplay between the nucleation and growth of the two solid phases. The structures that have been observed in this regime (in small samples where convection effects are suppressed) include alternate layers (bands) of the parent and peritectic phases perpendicular to the growth direction, which are formed by alternate nucleation and lateral spreading of one phase onto the other as proposed in a recent model [R. Trivedi, Metall. Mater. Trans. A 26, 1 (1995)], as well as partially filled bands (islands), where the peritectic phase does not fully cover the parent phase which grows continuously. We develop a phase-field model of peritectic solidification that incorporates nucleation processes in order to explore the formation of these structures. Simulations of this model shed light on the morphology transition from islands to bands, the dynamics of spreading of the peritectic phase on the parent phase following nucleation, which turns out to be characterized by a remarkably constant acceleration, and the types of growth morphology that one might expect to observe in large samples under purely diffusive growth conditions
Simulations of stress-induced twinning and de-twinning: A phase field model
International Nuclear Information System (INIS)
Hu Shenyang; Henager, Chuck H.; Chen Longqing
2010-01-01
Twinning in certain metals or under certain conditions is a major plastic deformation mode. Here we present a phase field model to describe twin formation and evolution in a polycrystalline fcc metal under loading and unloading. The model assumes that twin nucleation, growth and de-twinning is a process of partial dislocation nucleation and slip on successive habit planes. Stacking fault energies, energy pathways (γ surfaces), critical shear stresses for the formation of stacking faults and dislocation core energies are used to construct the thermodynamic model. The simulation results demonstrate that the model is able to predict the nucleation of twins and partial dislocations, as well as the morphology of the twin nuclei, and to reasonably describe twin growth and interaction. The twin microstructures at grain boundaries are in agreement with experimental observation. It was found that de-twinning occurs during unloading in the simulations, however, a strong dependence of twin structure evolution on loading history was observed.
Derivation of the phase field equations from the thermodynamic extremal principle
International Nuclear Information System (INIS)
Svoboda, J.; Fischer, F.D.; McDowell, D.L.
2012-01-01
Thermodynamics employs quantities that characterize the state of the system and provides driving forces for system evolution. These quantities can be applied by means of the thermodynamic extremal principle to obtain models and consequently constitutive equations for the evolution of the thermodynamic systems. The phase field method is a promising tool for simulation of the microstructure evolution in complex systems but introduces several parameters that are not standard in thermodynamics. The purpose of this paper is to show how the phase field method equations can be derived from the thermodynamic extremal principle, allowing the common treatment of the phase field parameters together with standard thermodynamic parameters in future applications. Fixed values of the phase field parameters may, however, not guarantee fixed values of thermodynamic parameters. Conditions are determined, for which relatively stable values of the thermodynamic parameters are guaranteed during phase field method simulations of interface migration. Finally, analytical relations between the thermodynamic and phase field parameters are found and verified for these simulations. A slight dependence of the thermodynamic parameters on the driving force is determined for the cases examined.
Electric field tuning of phase separation in manganite thin films
Lourembam, James; Wu, Jianchun; Ding, Junfeng; Lin, Weinan; Wu, Tao
2014-01-01
In this paper, we investigate the electric field effect on epitaxial Pr0.65(Ca0.75Sr0.25)0.35MnO3 thin films in electric double-layer transistors. Different from the conventional transistors with semiconducting channels, the sub(micrometer)-scale phase separation in the manganite channels is expected to result in inhomogeneous distribution of mobile carriers and local enhancement of electric field. The field effect is much larger in the low-temperature phase separation region compared to that in the high-temperature polaron transport region. Further enhancement of electroresistance is achieved by applying a magnetic field, and a 250% modulation of resistance is observed at 80 K, equivalent to an increase of the ferromagnetic metallic phase fraction by 0.51%, as estimated by the general effective medium model. Our results illustrate the complementary nature of electric and magnetic field effects in phase-separated manganites, providing insights on such novel electronic devices based on complex oxides.
Electric field tuning of phase separation in manganite thin films
Lourembam, James
2014-01-29
In this paper, we investigate the electric field effect on epitaxial Pr0.65(Ca0.75Sr0.25)0.35MnO3 thin films in electric double-layer transistors. Different from the conventional transistors with semiconducting channels, the sub(micrometer)-scale phase separation in the manganite channels is expected to result in inhomogeneous distribution of mobile carriers and local enhancement of electric field. The field effect is much larger in the low-temperature phase separation region compared to that in the high-temperature polaron transport region. Further enhancement of electroresistance is achieved by applying a magnetic field, and a 250% modulation of resistance is observed at 80 K, equivalent to an increase of the ferromagnetic metallic phase fraction by 0.51%, as estimated by the general effective medium model. Our results illustrate the complementary nature of electric and magnetic field effects in phase-separated manganites, providing insights on such novel electronic devices based on complex oxides.
Two applications of Berry's phase in fermionic field theory
International Nuclear Information System (INIS)
Goff, W.E.
1989-01-01
When quantized fermions are coupled to a background field, nontrivial effects may arise due to the geometry and/or topology of the space of background field configurations. In this thesis, two examples of Berry's geometrical phase in a fermionic sea are studied: the anomalous commutator in gauge field theory and the intrinsic orbital angular momentum in superfluid 3 He-A. Chapter 1 is a brief introduction. Chapter 2 reviews Berry's Phase and several toy models. Effective actions are calculated for two models in gradient expansions and the role of a geometric term is discussed. Chapter 3 investigates the anomalous commutator in the generators of gauge symmetry in field theory. Using an idea introduced by Sonoda, the Berry phase of the vacuum state is found to be the sum of the Berry phases of the individual states in the sea plus a piece due to the infinite nature of the Dirac sea. The latter is the anomalous commutator. Also found is a relative minus sign between the commutator of the total gauge symmetry generators and the commutator of the fermionic charge generators. Examples are given. In Chapter 4, a geometric way of deriving the intrinsic orbital angular momentum term in the 3 He-A equations of motion is presented. Homogeneous, adiabatically evolving textures at zero temperature are found to pick up a nonzero groundstate Berry phase, where the ground state is taken to be a filled sea of Bogoliubov quasiparticles. Interpreting the phase as a Wess-Zumino effective action for the condensate provides a geometric origin for the intrinsic angular momentum. The idea of a ground-state phase is then extended to other gap functions and a more general result is obtained. Chapter 5 concludes with a discussion of the possibility of unifying the two problems in a more general framework and directions for further work
Field theory of absorbing phase transitions with a non-diffusive conserved field
International Nuclear Information System (INIS)
Pastor-Satorras, R.; Vespignani, A.
2000-04-01
We investigate the critical behavior of a reaction-diffusion system exhibiting a continuous absorbing-state phase transition. The reaction-diffusion system strictly conserves the total density of particles, represented as a non-diffusive conserved field, and allows an infinite number of absorbing configurations. Numerical results show that it belongs to a wide universality class that also includes stochastic sandpile models. We derive microscopically the field theory representing this universality class. (author)
International Nuclear Information System (INIS)
Ertas, Mehmet; Keskin, Mustafa; Deviren, Bayram
2010-01-01
The dynamic phase transitions are studied in the spin-2 Ising model under a time-dependent oscillating magnetic field by using the effective-field theory with correlations. The effective-field dynamic equation is derived by employing the Glauber transition rates and the phases in the system are obtained by solving this dynamic equation. The nature (first- or second-order) of the dynamic phase transition is characterized by investigating the thermal behavior of the dynamic order parameter and the dynamic phase transition temperatures are obtained. The dynamic phase diagrams are presented in (T/zJ, h/zJ) plane.
Phase structure of (φ4)3 field theory at finite temperature
International Nuclear Information System (INIS)
Efimov, G.V.
1992-01-01
Phase structure of φ 4 field theory in the space-time R 3 is investigated at arbitrary coupling constant and temperature. The critical values of the coupling constant and temperature, corresponding to the phase transitions in the system, are calculated by the canonical transformation method within formalism of thermo field dynamics. The Hamiltonians describing the system in each phase are obtained straightforwardly. Comparison with the two-dimensional case shows a crucial influence of higher order renormalization on the phase structure of the model. 13 refs.; 5 figs
Non-uniform chiral phase in effective chiral quark models
International Nuclear Information System (INIS)
Sadzikowski, M.; Broniowski, W.
2000-01-01
We analyze the phase diagram in effective chiral quark models (the Nambu-Jona-Lasinio model, the σ-model with quarks) and show that at the mean-field level a phase with a periodically-modulated chiral fields separates the usual phases with broken and restored chiral symmetry. A possible signal of such a phase is the production of multipion jets travelling in opposite directions, with individual pions having momenta of the order of several hundred MeV. This signal can be interpreted in terms of disoriented chiral condensates. (author)
A strong electroweak phase transition from the inflaton field
Energy Technology Data Exchange (ETDEWEB)
Tenkanen, Tommi; Tuominen, Kimmo [Department of Physics, University of Helsinki, P.O. Box 64, FI-00014, Helsinki (Finland); Helsinki Institute of Physics, P.O. Box 64, FI-00014, Helsinki (Finland); Vaskonen, Ville [Helsinki Institute of Physics, P.O. Box 64, FI-00014, Helsinki (Finland); Department of Physics, University of Jyvaskyla, P.O.Box 35 (YFL), FI-40014 University of Jyvaskyla (Finland)
2016-09-22
We study a singlet scalar extension of the Standard Model. The singlet scalar is coupled non-minimally to gravity and assumed to drive inflation, and also couple sufficiently strongly with the SM Higgs field in order to provide for a strong first order electroweak phase transition. Requiring the model to describe inflation successfully, be compatible with the LHC data, and yield a strong first order electroweak phase transition, we identify the regions of the parameter space where the model is viable. We also include a singlet fermion with scalar coupling to the singlet scalar to probe the sensitivity of the constraints on additional degrees of freedom and their couplings in the singlet sector. We also comment on the general feasibility of these fields to act as dark matter.
Accelerating large-scale phase-field simulations with GPU
Directory of Open Access Journals (Sweden)
Xiaoming Shi
2017-10-01
Full Text Available A new package for accelerating large-scale phase-field simulations was developed by using GPU based on the semi-implicit Fourier method. The package can solve a variety of equilibrium equations with different inhomogeneity including long-range elastic, magnetostatic, and electrostatic interactions. Through using specific algorithm in Compute Unified Device Architecture (CUDA, Fourier spectral iterative perturbation method was integrated in GPU package. The Allen-Cahn equation, Cahn-Hilliard equation, and phase-field model with long-range interaction were solved based on the algorithm running on GPU respectively to test the performance of the package. From the comparison of the calculation results between the solver executed in single CPU and the one on GPU, it was found that the speed on GPU is enormously elevated to 50 times faster. The present study therefore contributes to the acceleration of large-scale phase-field simulations and provides guidance for experiments to design large-scale functional devices.
Stochastic-field cavitation model
International Nuclear Information System (INIS)
Dumond, J.; Magagnato, F.; Class, A.
2013-01-01
Nonlinear phenomena can often be well described using probability density functions (pdf) and pdf transport models. Traditionally, the simulation of pdf transport requires Monte-Carlo codes based on Lagrangian “particles” or prescribed pdf assumptions including binning techniques. Recently, in the field of combustion, a novel formulation called the stochastic-field method solving pdf transport based on Eulerian fields has been proposed which eliminates the necessity to mix Eulerian and Lagrangian techniques or prescribed pdf assumptions. In the present work, for the first time the stochastic-field method is applied to multi-phase flow and, in particular, to cavitating flow. To validate the proposed stochastic-field cavitation model, two applications are considered. First, sheet cavitation is simulated in a Venturi-type nozzle. The second application is an innovative fluidic diode which exhibits coolant flashing. Agreement with experimental results is obtained for both applications with a fixed set of model constants. The stochastic-field cavitation model captures the wide range of pdf shapes present at different locations
Stochastic-field cavitation model
Dumond, J.; Magagnato, F.; Class, A.
2013-07-01
Nonlinear phenomena can often be well described using probability density functions (pdf) and pdf transport models. Traditionally, the simulation of pdf transport requires Monte-Carlo codes based on Lagrangian "particles" or prescribed pdf assumptions including binning techniques. Recently, in the field of combustion, a novel formulation called the stochastic-field method solving pdf transport based on Eulerian fields has been proposed which eliminates the necessity to mix Eulerian and Lagrangian techniques or prescribed pdf assumptions. In the present work, for the first time the stochastic-field method is applied to multi-phase flow and, in particular, to cavitating flow. To validate the proposed stochastic-field cavitation model, two applications are considered. First, sheet cavitation is simulated in a Venturi-type nozzle. The second application is an innovative fluidic diode which exhibits coolant flashing. Agreement with experimental results is obtained for both applications with a fixed set of model constants. The stochastic-field cavitation model captures the wide range of pdf shapes present at different locations.
Phase-Field simulation of phase decomposition in Fe-Cr-Co alloy under an external magnetic field
Koyama, Toshiyuki; Onodera, Hidehiro
2004-07-01
Phase decomposition during isothermal aging of a Fe-Cr-Co ternary alloy under an external magnetic field is simulated based on the phase-field method. In this simulation, since the Gibbs energy available from the thermodynamic CALPHAD database of the equilibrium phase diagram is employed as a chemical free energy, the present calculation provides the quantitative microstructure changes directly linked to the phase diagram. The simulated microstructure evolution demonstrates that the lamella like microstructure elongated along the external magnetic field is evolved with the progress of aging. The morphological and temporal developments of the simulated microstructures are in good agreement with experimental results that have been obtained for this alloy system.
Investigating heterogeneous nucleation in peritectic materials via the phase-field method
International Nuclear Information System (INIS)
Emmerich, Heike; Siquieri, Ricardo
2006-01-01
Here we propose a phase-field approach to investigate the influence of convection on peritectic growth as well as the heterogeneous nucleation kinetics of peritectic systems. For this purpose we derive a phase-field model for peritectic growth taking into account fluid flow in the melt, which is convergent to the underlying sharp interface problem in the thin interface limit (Karma and Rappel 1996 Phys. Rev. E 53 R3017). Moreover, we employ our new phase-field model to study the heterogeneous nucleation kinetics of peritectic material systems. Our approach is based on a similar approach towards homogeneous nucleation in Granasy et al (2003 Interface and Transport Dynamics (Springer Lecture Notes in Computational Science and Engineering vol 32) ed Emmerich et al (Berlin: Springer) p 190). We applied our model successfully to extend the nucleation rate predicted by classical nucleation theory for an additional morphological term relevant for peritectic growth. Further applications to understand the mechanisms and consequences of heterogeneous nucleation kinetics in more detail are discussed
Energy Technology Data Exchange (ETDEWEB)
Cavalcanti, E.; Castro, E.; Malbouisson, A.P.C. [Centro Brasileiro de Pesquisas Fisicas/MCTI, Rio de Janeiro, RJ (Brazil); Linhares, C.A. [Universidade do Estado do Rio de Janeiro, Instituto de Fisica, Rio de Janeiro, RJ (Brazil)
2017-10-15
A scalar model is built, as a quantum field theory defined on a toroidal topology, to describe a phase transition in films subjected to periodic boundary conditions and influenced by an external and constant magnetic field. Criticality is studied and the relations between the critical temperature, the film thickness, the magnetic field strength and the chemical potential are investigated. Since the model describes a second-order phase transition a comparison with the Ginzburg-Landau theory is made. (orig.)
International Nuclear Information System (INIS)
Oum, G.; Thuinet, L.; Legris, A.
2015-07-01
A phase-field (PF) model was developed within the framework of homogeneous and heterogeneous elasticity theory to study the precipitation of ζ-hydride in zirconium. By coupling crystal plasticity to PF we show that plastic strain participates in lowering the transformation stresses, and therefore induces changes in nucleation, growth and morphology evolution of the precipitates. (authors)
Phase separation in fluids exposed to spatially periodic external fields.
Vink, R L C; Archer, A J
2012-03-01
When a fluid is confined within a spatially periodic external field, the liquid-vapor transition is replaced by a different transition called laser-induced condensation (LIC) [Götze et al., Mol. Phys. 101, 1651 (2003)]. In d=3 dimensions, the periodic field induces an additional phase, characterized by large density modulations along the field direction. At the triple point, all three phases (modulated, vapor, and liquid) coexist. At temperatures slightly above the triple point and for low (high) values of the chemical potential, two-phase coexistence between the modulated phase and the vapor (liquid) is observed; by increasing the temperature further, both coexistence regions terminate in critical points. In this paper, we reconsider LIC using the Ising model to resolve a number of open issues. To be specific, we (1) determine the universality class of the LIC critical points and elucidate the nature of the correlations along the field direction, (2) present a mean-field analysis to show how the LIC phase diagram changes as a function of the field wavelength and amplitude, (3) develop a simulation method by which the extremely low tension of the interface between modulated and vapor or liquid phase can be measured, (4) present a finite-size scaling analysis to accurately extract the LIC triple point from finite-size simulation data, and (5) consider the fate of LIC in d=2 dimensions.
RETRAN nonequilibrium two-phase flow model for operational transient analyses
International Nuclear Information System (INIS)
Paulsen, M.P.; Hughes, E.D.
1982-01-01
The field balance equations, flow-field models, and equation of state for a nonequilibrium two-phase flow model for RETRAN are given. The differential field balance model equations are: (1) conservation of mixture mass; (2) conservation of vapor mass; (3) balance of mixture momentum; (4) a dynamic-slip model for the velocity difference; and (5) conservation of mixture energy. The equation of state is formulated such that the liquid phase may be subcooled, saturated, or superheated. The vapor phase is constrained to be at the saturation state. The dynamic-slip model includes wall-to-phase and interphase momentum exchanges. A mechanistic vapor generation model is used to describe vapor production under bulk subcooling conditions. The speed of sound for the mixture under nonequilibrium conditions is obtained from the equation of state formulation. The steady-state and transient solution methods are described
Phase-field-based lattice Boltzmann modeling of large-density-ratio two-phase flows
Liang, Hong; Xu, Jiangrong; Chen, Jiangxing; Wang, Huili; Chai, Zhenhua; Shi, Baochang
2018-03-01
In this paper, we present a simple and accurate lattice Boltzmann (LB) model for immiscible two-phase flows, which is able to deal with large density contrasts. This model utilizes two LB equations, one of which is used to solve the conservative Allen-Cahn equation, and the other is adopted to solve the incompressible Navier-Stokes equations. A forcing distribution function is elaborately designed in the LB equation for the Navier-Stokes equations, which make it much simpler than the existing LB models. In addition, the proposed model can achieve superior numerical accuracy compared with previous Allen-Cahn type of LB models. Several benchmark two-phase problems, including static droplet, layered Poiseuille flow, and spinodal decomposition are simulated to validate the present LB model. It is found that the present model can achieve relatively small spurious velocity in the LB community, and the obtained numerical results also show good agreement with the analytical solutions or some available results. Lastly, we use the present model to investigate the droplet impact on a thin liquid film with a large density ratio of 1000 and the Reynolds number ranging from 20 to 500. The fascinating phenomena of droplet splashing is successfully reproduced by the present model and the numerically predicted spreading radius exhibits to obey the power law reported in the literature.
Kim, Jinyong; Luo, Gang; Wang, Chao-Yang
2017-10-01
3D fine-mesh flow-fields recently developed by Toyota Mirai improved water management and mass transport in proton exchange membrane (PEM) fuel cell stacks, suggesting their potential value for robust and high-power PEM fuel cell stack performance. In such complex flow-fields, Forchheimer's inertial effect is dominant at high current density. In this work, a two-phase flow model of 3D complex flow-fields of PEMFCs is developed by accounting for Forchheimer's inertial effect, for the first time, to elucidate the underlying mechanism of liquid water behavior and mass transport inside 3D complex flow-fields and their adjacent gas diffusion layers (GDL). It is found that Forchheimer's inertial effect enhances liquid water removal from flow-fields and adds additional flow resistance around baffles, which improves interfacial liquid water and mass transport. As a result, substantial improvements in high current density cell performance and operational stability are expected in PEMFCs with 3D complex flow-fields, compared to PEMFCs with conventional flow-fields. Higher current density operation required to further reduce PEMFC stack cost per kW in the future will necessitate optimizing complex flow-field designs using the present model, in order to efficiently remove a large amount of product water and hence minimize the mass transport voltage loss.
Dynamics of a quantum two-level system under the action of phase-diffusion field
Energy Technology Data Exchange (ETDEWEB)
Sobakinskaya, E.A. [Institute for Physics of Microstructures of RAS, Nizhny Novgorod, 603950 (Russian Federation); Pankratov, A.L., E-mail: alp@ipm.sci-nnov.ru [Institute for Physics of Microstructures of RAS, Nizhny Novgorod, 603950 (Russian Federation); Vaks, V.L. [Institute for Physics of Microstructures of RAS, Nizhny Novgorod, 603950 (Russian Federation)
2012-01-09
We study a behavior of quantum two-level system, interacting with noisy phase-diffusion field. The dynamics is shown to split into two regimes, determined by the coherence time of the phase-diffusion field. For both regimes we present a model of quantum system behavior and discuss possible applications of the obtained effect for spectroscopy. In particular, the obtained analytical formula for the macroscopic polarization demonstrates that the phase-diffusion field does not affect the absorption line shape, which opens up an intriguing possibility of noisy spectroscopy, based on broadband sources with Lorentzian line shape. -- Highlights: ► We study dynamics of quantum system interacting with noisy phase-diffusion field. ► At short times the phase-diffusion field induces polarization in the quantum system. ► At long times the noise leads to polarization decay and heating of a quantum system. ► Simple model of interaction is derived. ► Application of the described effects for spectroscopy is discussed.
Energy Technology Data Exchange (ETDEWEB)
Rao Weifeng [Department of Materials Science and Engineering, Rutgers University, 607 Taylor Road, Piscataway, NJ 08854 (United States); Khachaturyan, Armen G., E-mail: khach@jove.rutgers.edu [Department of Materials Science and Engineering, Rutgers University, 607 Taylor Road, Piscataway, NJ 08854 (United States)
2011-06-15
A phase field theory of proper displacive transformations is developed to address the microstructure evolution and its response to applied fields in decomposing and martensitic systems. The theory is based on the explicit equation for the non-equilibrium free energy function of the transformation strain obtained by a consistent separation of the total strain into transformation and elastic strains. The transformation strain is considered to be a relaxing long-range order parameter evolving in accordance with the system energetics rather than as a fixed material constant used in the conventional Eshelby theory of coherent inclusions. The elastic strain is defined as a coherency strain recovering the crystal lattice compatibility. The obtained free energy function of the transformation strain leads to the concepts of structural anisotropy and directional flexibility of low symmetry phases. The formulated vector model of displacive transformation makes apparent a similarity between proper displacive transformation and ferromagnetic/ferroelectric transformation and, in particular, a similarity between the structural anisotropy and magnetic/polar anisotropy of ferromagnetic/ferroelectric materials. It even predicts the feasibility of a glass-like structural state with unlimited directional flexibility of the transformation strain that is conceptually similar to a ferromagnetic glass. The thermodynamics of the equilibrium between low symmetry phases and the thermodynamic conditions leading to the formation of adaptive states are formulated.
International Nuclear Information System (INIS)
Frohlich, J.
1976-01-01
We prove that a Symanzik--Nelson positive quantum field theory, i.e., a quantum field theory derived from a Euclidean field theory, has a unique decomposition into pure phases which preserves Symanzik--Nelson positivity and Poincare covariance. We derive useful sufficient conditions for the breakdown of an internal symmetry of such a theory in its pure phases, for the self-adjointness and nontrivially (in the sense of Borchers classes) of its quantum fields, and the existence of time-ordered and retarded products. All these general results are then applied to the P (phi) 2 and the phi 3 4 quantum field models
Phase field modeling of twinning in indentation of transparent crystals
International Nuclear Information System (INIS)
Clayton, J D; Knap, J
2011-01-01
Continuum phase field theory is applied to study elastic twinning in calcite and sapphire single crystals subjected to indentation loading by wedge-shaped indenters. An order parameter is associated with the magnitude of stress-free twinning shear. Geometrically linear and nonlinear theories are implemented and compared, the latter incorporating neo-Hookean elasticity. Equilibrium configurations of deformed and twinned crystals are attained numerically via direct energy minimization. Results are in qualitative agreement with experimental observations: a long thin twin forms asymmetrically under one side of the indenter, the tip of the twin is sharp and the length of the twin increases with increasing load. Qualitatively similar results are obtained using isotropic and anisotropic elastic constants, though the difference between isotropic and anisotropic results is greater in sapphire than in calcite. Similar results are also obtained for nanometer-scale specimens and millimeter-scale specimens. Indentation forces are greater in the nonlinear model than the linear model because of the increasing tangent bulk modulus with increasing pressure in the former. Normalized relationships between twin length and indentation force are similar for linear and nonlinear theories at both nanometer and millimeter scales. Twin morphologies are similar for linear and nonlinear theories for indentation with a 90° wedge. However, in the nonlinear model, indentation with a 120° wedge produces a lamellar twin structure between the indenter and the long sharp primary twin. This complex microstructure is not predicted by the linear theory
Phase-space analysis of the Schwinger effect in inhomogeneous electromagnetic fields
Kohlfürst, Christian
2018-05-01
Schwinger pair production in spatially and temporally inhomogeneous electric and magnetic fields is studied. The focus is on the particle phase-space distribution within a high-intensity few-cycle pulse. Accurate numerical solutions of a quantum kinetic theory (DHW formalism) are presented in momentum space and, with the aid of coarse-graining techniques, in a mixed spatial-momentum representation. Additionally, signatures of the carrier-envelope phase as well as spin-field interactions are discussed on the basis of a trajectory-based model taking into account instantaneous pair production and relativistic single-particle dynamics. Although our simple semi-classical single-particle model cannot describe every aspect of the particle production process (quantum interferences), essential features such as spin-field interactions are captured.
Constitutive modeling of multiphase materials including phase transformations
Perdahcioglu, Emin Semih; Geijselaers, Hubertus J.M.; Khan, A.S.; Meredith, C; Farrokh, B
2011-01-01
A constitutive model is developed for materials involving two or more different phases in their microstructure such as DP (Dual Phase) or TRIP (TRansformation Induced Plasticity) steels. Homogenization of the response of the phases is achieved by the Mean-Field method. One of the phases in TRIP
A Cosserat crystal plasticity and phase field theory for grain boundary migration
Ask, Anna; Forest, Samuel; Appolaire, Benoit; Ammar, Kais; Salman, Oguz Umut
2018-06-01
The microstructure evolution due to thermomechanical treatment of metals can largely be described by viscoplastic deformation, nucleation and grain growth. These processes take place over different length and time scales which present significant challenges when formulating simulation models. In particular, no overall unified field framework exists to model concurrent viscoplastic deformation and recrystallization and grain growth in metal polycrystals. In this work a thermodynamically consistent diffuse interface framework incorporating crystal viscoplasticity and grain boundary migration is elaborated. The Kobayashi-Warren-Carter (KWC) phase field model is extended to incorporate the full mechanical coupling with material and lattice rotations and evolution of dislocation densities. The Cosserat crystal plasticity theory is shown to be the appropriate framework to formulate the coupling between phase field and mechanics with proper distinction between bulk and grain boundary behaviour.
Nonequilibrium Physics and Phase-Field Modeling of Multiphase Flow in Porous Media
Energy Technology Data Exchange (ETDEWEB)
Juanes, Ruben [Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States)
2016-09-01
The overarching goal of this project was to develop a new continuum theory of multiphase flow in porous media. The theory follows a phase-field modeling approach, and therefore has a sound thermodynamical basis. It is a phenomenological theory in the sense that its formulation is driven by macroscopic phenomena, such as viscous instabilities during multifluid displacement. The research agenda was organized around a set of hypothesis on hitherto unexplained behavior of multiphase flow. All these hypothesis are nontrivial, and testable. Indeed, a central aspect of the project was testing each hypothesis by means of carefully-designed laboratory experiments, therefore probing the validity of the proposed theory. The proposed research places an emphasis on the fundamentals of flow physics, but is motivated by important energy-driven applications in earth sciences, as well as microfluidic technology.
Phase field simulations of ice crystal growth in sugar solutions
Sman, Van Der R.G.M.
2016-01-01
We present the first model ever, that describes explicitly ice crystal growth in a sugar solution during freezing. This 2-D model uses the phase field method, supplemented with realistic, and predictive theories on the thermodynamics and (diffusion) kinetics of this food system. We have to make
An investigation of subchannel analysis models for single-phase and two-phase flow
Energy Technology Data Exchange (ETDEWEB)
Hwang, Dae Hyun
1996-01-01
The governing equations and lateral transport modelings of subchannel analysis code, which is the most widely used tool for the analysis of thermal hydraulics fields in reactor cores, have been thoroughly investigated in this study. The procedure for the derivation of subchannel integral balance equations from the local instantaneous phase equations was investigated by stages. The characteristics of governing equations according to the treatment of phase velocity were studies, and the equations based on the drift-flux equilibrium formulation have been derived. Turbulent mixing and void drift modeling, which affect considerably to the accuracy of subchannel analysis code, have been reviewed. In addition, some representative modelings of single-phase and two-phase turbulent mixing models have been introduced. (author). 5 tabs., 4 figs., 16 refs.
Phase diagram and tricritical behavior of an metamagnet in uniform and random fields
International Nuclear Information System (INIS)
Liang Yaqiu; Wei Guozhu; Xu Xiaojuan; Song Guoli
2010-01-01
A two-sublattice Ising metamagnet in both uniform and random fields is studied within the mean-field approach based on Bogoliubov's inequality for the Gibbs free energy. We show that the qualitative features of the phase diagrams are dependent on the parameters of the model and the uniform field values. The tricritical point and reentrant phenomenon can be observed on the phase diagram. The reentrance is due to the competition between uniform and random interactions.
Dual-scale phase-field simulation of Mg-Al alloy solidification
International Nuclear Information System (INIS)
Monas, A; Shchyglo, O; Tegeler, M; Steinbach, I; Höche, D
2015-01-01
Phase-field simulations of the nucleation and growth of primary α-Mg phase as well as secondary, β-phase of a Mg-Al alloy are presented. The nucleation model for α- and β-Mg phases is based on the “free growth model” by Greer et al.. After the α-Mg phase solidification we study a divorced eutectic growth of α- and β-Mg phases in a zoomed in melt channel between α-phase dendrites. The simulated cooling curves and final microstructures of α-grains are compared with experiments. In order to further enhance the resolution of the interdendritic region a high-performance computing approach has been used allowing significant simulation speed gain when using supercomputing facilities. (paper)
International Nuclear Information System (INIS)
Tanaka, Nobuatsu; Maseguchi, Ryo; Ogawara, Takuya
2008-01-01
This study is concerned with improvement of numerical code called CRIMSON (Civa RefIned Multiphase SimulatiON), which has been developed to evaluate multi-phase flow behaviors based on the recent CFD (computational fluid dynamics) technologies. The CRIMSON employs a finite-volume method combined with the high order interpolation scheme, CIVA (cubic-interpolation with area/volume coordinates). The CRIMSON solves gas-liquid two phases by a unified scheme of CUP (combined unified procedure). The conventional CIVA method has two problems of interface blurring in long-term calculation and non-conservativeness. In this study, the problems were solved by introducing the ideas of the level set method and the phase field method. We verified out method by applying it to some popular benchmark problems of single bubble rising and collapse of water column problems. (author)
Application of Phase-Field Techniques to Hydraulically- and Deformation-Induced Fracture.
Energy Technology Data Exchange (ETDEWEB)
Culp, David [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Miller, Nathan [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Schweizer, Laura [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
2017-08-01
Phase-field techniques provide an alternative approach to fracture problems which mitigate some of the computational expense associated with tracking the crack interface and the coalescence of individual fractures. The technique is extended to apply to hydraulically driven fracture such as would occur during fracking or CO_{2} sequestration. Additionally, the technique is applied to a stainless steel specimen used in the Sandia Fracture Challenge. It was found that the phase-field model performs very well, at least qualitatively, in both deformation-induced fracture and hydraulically-induced fracture, though spurious hourglassing modes were observed during coupled hydralically-induced fracture. Future work would include performing additional quantitative benchmark tests and updating the model as needed.
Phase-field simulation study of the migration of recrystallization boundaries
DEFF Research Database (Denmark)
Moelans, Nele; Godfrey, Andy; Zhang, Yubin
2013-01-01
We present simulation results based on a phase-field model that describes the local migration of recrystallization boundaries into varying deformation energy fields. An important finding from the simulations is that the overall migration rate of the recrystallization front can be considerably...... amplitudes, however, the velocity scales with the maximum of the deformation energy density along the variation, resulting in a considerably larger velocity than that obtained from standard recrystallization models. The shape of the migrating grain boundary greatly depends on the local characteristics...... of the varying stored deformation energy field. For different deformation energy fields, the simulation results are in good qualitative agreement with experiments and add information which cannot be directly derived from experiments....
Coherent cancellation of geometric phase for the OH molecule in external fields
Bhattacharya, M.; Marin, S.; Kleinert, M.
2014-05-01
The OH molecule in its ground state presents a versatile platform for precision measurement and quantum information processing. These applications vitally depend on the accurate measurement of transition energies between the OH levels. Significant sources of systematic errors in these measurements are shifts based on the geometric phase arising from the magnetic and electric fields used for manipulating OH. In this article, we present these geometric phases for fields that vary harmonically in time, as in the Ramsey technique. Our calculation of the phases is exact within the description provided by our recent analytic solution of an effective Stark-Zeeman Hamiltonian for the OH ground state. This Hamiltonian has been shown to model experimental data accurately. We find that the OH geometric phases exhibit rich structure as a function of the field rotation rate. Remarkably, we find rotation rates where the geometric phase accumulated by a specific state is zero, or where the relative geometric phase between two states vanishes. We expect these findings to be of importance to precision experiments on OH involving time-varying fields. More specifically, our analysis quantitatively characterizes an important item in the error budget for precision spectroscopy of ground-state OH.
Second order phase transition in two dimensional sine-Gordon field theory - lattice model
International Nuclear Information System (INIS)
Babu Joseph, K.; Kuriakose, V.C.
1978-01-01
Two dimensional sine-Gordon (SG) field theory on a lattice is studied using the single-site basis variational method of Drell and others. The nature of the phase transition associated with the spontaneous symmetry breakdown in a SG field system is clarified to be of second order. A generalisation is offered for a SG-type field theory in two dimensions with a potential of the form [cossup(n)((square root of lambda)/m)phi-1].(author)
Berry phase of primordial scalar and tensor perturbations in single-field inflationary models
Balajany, Hamideh; Mehrafarin, Mohammad
2018-06-01
In the framework of the single-field slow-roll inflation, we derive the Hamiltonian of the linear primordial scalar and tensor perturbations in the form of time-dependent harmonic oscillator Hamiltonians. We find the invariant operators of the resulting Hamiltonians and use their eigenstates to calculate the adiabatic Berry phase for sub-horizon modes in terms of the Lewis-Riesenfeld phase. We conclude by discussing the discrepancy in the results of Pal et al. (2013) [21] for these Berry phases, which is resolved to yield agreement with our results.
Phase-field simulation of lenticular martensite and inheritance of the accommodation dislocations
Directory of Open Access Journals (Sweden)
Kundin Julia
2015-01-01
Full Text Available A phase-field simulation is performed to study the substructure evolution of lenticular martensite in TRIP steels. The evolution of martensitic phase variants and dislocations is calculated by a coupled phase-field micro-elasticity model. The simulations at isothermal conditions show that during the phase transformation, the accommodation dislocations evolving in the austenite are inherited by the martensitic phase and cause the further evolution of a single martensitic variant in the direction of the dislocation slip. As a result of the interaction, a change of the growth mode from twining to slip can be observed in accordance to the substructure formation of lenticular martensite. This interaction between the dislocations and martensitic phase depends on dislocation slip systems and the orientation of the martensitic variants as well as on the energy barriers for the phase transformation and for the dislocation motion.
Diffuse-interface model for rapid phase transformations in nonequilibrium systems.
Galenko, Peter; Jou, David
2005-04-01
A thermodynamic approach to rapid phase transformations within a diffuse interface in a binary system is developed. Assuming an extended set of independent thermodynamic variables formed by the union of the classic set of slow variables and the space of fast variables, we introduce finiteness of the heat and solute diffusive propagation at the finite speed of the interface advancing. To describe transformations within the diffuse interface, we use the phase-field model which allows us to follow steep but smooth changes of phase within the width of the diffuse interface. Governing equations of the phase-field model are derived for the hyperbolic model, a model with memory, and a model of nonlinear evolution of transformation within the diffuse interface. The consistency of the model is proved by the verification of the validity of the condition of positive entropy production and by outcomes of the fluctuation-dissipation theorem. A comparison with existing sharp-interface and diffuse-interface versions of the model is given.
Field-oriented control of five-phase induction motor with open-end stator winding
Directory of Open Access Journals (Sweden)
Listwan Jacek
2016-09-01
Full Text Available The mathematical model of the five-phase squirrel-cage induction motor and the system of the dual five-phase voltage source inverter have been presented. The control methods and control systems of the field-oriented control of the five-phase induction motor with an open-end stator winding are described. The structures of the direct fieldoriented control system (DFOC and the Indirect Field-oriented control system (IFOC with PI controllers in outer and inner control loops are analyzed. A method of space vector modulation used to control the system of the dual five-phase voltage source inverter has been discussed. The results of simulation studies of the field-oriented control methods are presented. Comparative analysis of the simulation results was carried out.
Directory of Open Access Journals (Sweden)
Ru-wei Geng
2017-11-01
Full Text Available The mechanical properties of metal components are determined by the solidification behaviour and microstructure. A quantitative phase field model is used to investigate the microstructure evolution of fused-coating additive manufacturing, by which to improve the quality of deposition. During the fused-coating process, the molten metal in a crucible flows out of a nozzle and then reaches the substrate. The solidification happens at the moment when the molten metal comes into contact with substrate moving in three-dimensional space. The macroscopic heat transfer model of fused-coating is established to get the temperature field considered as the initial temperature boundary conditions in the phase field model. The numerical and experimental results show that the morphology of grains varies with different solidification environments. Columnar grains are observed during the early period at the bottom of fused-coating layer and the equiaxed grains appear subsequently ahead of the columnar grains. Columnar dendrites phase field simulations about the grains morphology and solute distribution are conducted considering the solidification environments. The simulation results are in good agreement with experimental results.
International Nuclear Information System (INIS)
Faber, M.; Ivanov, A.N.
2001-01-01
We investigate the equivalence between Thirring model and sine-Gordon model in the chirally broken phase of the Thirring model. This is unlike all other available approaches where the fermion fields of the Thirring model were quantized in the chiral symmetric phase. In the path integral approach we show that the bosonized version of the massless Thirring model is described by a quantum field theory of a massless scalar field and exactly solvable, and the massive Thirring model bosonizes to the sine-Gordon model with a new relation between the coupling constants. We show that the non-perturbative vacuum of the chirally broken phase in the massless Thirring model can be described in complete analogy with the BCS ground state of superconductivity. The Mermin-Wagner theorem and Coleman's statement concerning the absence of Goldstone bosons in the 1+1-dimensional quantum field theories are discussed. We investigate the current algebra in the massless Thirring model and give a new value of the Schwinger term. We show that the topological current in the sine-Gordon model coincides with the Noether current responsible for the conservation of the fermion number in the Thirring model. This allows one to identify the topological charge in the sine-Gordon model with the fermion number. (orig.)
Model of electric field-induced charge disordering in praseodymium manganites
International Nuclear Information System (INIS)
Lapinskas, S.; Tornau, E.E.; Semiconductor Physics Inst., Vilnius
2001-01-01
We propose a model for an electric field-driven transition from the ordered NaCl-type phase to the disordered phase. Such a transition might be a prototype of charge disordering transition observed in Pr 1-c Ca c MnO 3 . We assume the lattice-gas model and hopping conductivity of charge carriers. The solution of this model, performed by the Monte Carlo method, demonstrates that considerably high electric field can disorder well-ordered phases. The comparison with the data for charge disordering in Pr 1-c Ca c MnO 3 shows that required fields are much too high. We analyze the obtained results trying to determine a possible scenario for conductivity in Pr 1-c Ca c MnO 3 . (orig.)
Energy Technology Data Exchange (ETDEWEB)
Deviren, Şeyma Akkaya, E-mail: sadeviren@nevsehir.edu.tr [Department of Science Education, Education Faculty, Nevsehir Hacı Bektaş Veli University, 50300 Nevşehir (Turkey); Deviren, Bayram [Department of Physics, Nevsehir Hacı Bektaş Veli University, 50300 Nevsehir (Turkey)
2016-03-15
The dynamic phase transitions and dynamic phase diagrams are studied, within a mean-field approach, in the kinetic Ising model on the Shastry-Sutherland lattice under the presence of a time varying (sinusoidal) magnetic field by using the Glauber-type stochastic dynamics. The time-dependence behavior of order parameters and the behavior of average order parameters in a period, which is also called the dynamic order parameters, as a function of temperature, are investigated. Temperature dependence of the dynamic magnetizations, hysteresis loop areas and correlations are investigated in order to characterize the nature (first- or second-order) of the dynamic phase transitions as well as to obtain the dynamic phase transition temperatures. We present the dynamic phase diagrams in the magnetic field amplitude and temperature plane. The phase diagrams exhibit a dynamic tricritical point and reentrant phenomena. The phase diagrams also contain paramagnetic (P), Néel (N), Collinear (C) phases, two coexistence or mixed regions, (N+C) and (N+P), which strongly depend on interaction parameters. - Highlights: • Dynamic magnetization properties of spin-1/2 Ising model on SSL are investigated. • Dynamic magnetization, hysteresis loop area, and correlation have been calculated. • The dynamic phase diagrams are constructed in (T/|J|, h/|J|) plane. • The phase diagrams exhibit a dynamic tricritical point and reentrant phenomena.
Phase-field model for deposition process of platinum nanoparticles on carbon substrate
International Nuclear Information System (INIS)
Yamakawa, S; Hyodo, S; Okazaki-Maeda, K; Kohyama, M
2008-01-01
Platinum supported on a carbon carrier is widely used as a catalyst for polymer electrolyte membrane fuel cells. The catalytic activity is significantly affected by the size distribution and morphologies of the platinum particles. The objective of this study is to extend the phase-field approach to describe the formation process of platinum particles onto the substrate. The microstructural evolution of a nanoparticle was represented by the temporal evolution of the field variables related to the platinum concentration, long-range crystallographic ordering and phase transition. First-principles calculations were performed in order to estimate the interaction energies between several different types of platinum clusters and a graphene sheet. The platinum density profile concentrated over the substrate surface led to the formation of three-dimensional islands in accordance with the Volmer-Weber mode of growth. The size distributions of the platinum particles were sensitive to the heterogeneity of the substrate surface and to the competitive nucleation and growth processes
Phase diagram and topological phases in the triangular lattice Kitaev-Hubbard model
Li, Kai; Yu, Shun-Li; Gu, Zhao-Long; Li, Jian-Xin
2016-09-01
We study the half-filled Hubbard model on a triangular lattice with spin-dependent Kitaev-like hopping. Using the variational cluster approach, we identify five phases: a metallic phase, a non-coplanar chiral magnetic order, a 120° magnetic order, a nonmagnetic insulator (NMI), and an interacting Chern insulator (CI) with a nonzero Chern number. The transition from CI to NMI is characterized by the change of the charge gap from an indirect band gap to a direct Mott gap. Based on the slave-rotor mean-field theory, the NMI phase is further suggested to be a gapless Mott insulator with a spinon Fermi surface or a fractionalized CI with nontrivial spinon topology, depending on the strength of the Kitaev-like hopping. Our work highlights the rising field in which interesting phases emerge from the interplay between band topology and Mott physics.
On Affine Fusion and the Phase Model
Directory of Open Access Journals (Sweden)
Mark A. Walton
2012-11-01
Full Text Available A brief review is given of the integrable realization of affine fusion discovered recently by Korff and Stroppel. They showed that the affine fusion of the su(n Wess-Zumino-Novikov-Witten (WZNW conformal field theories appears in a simple integrable system known as the phase model. The Yang-Baxter equation leads to the construction of commuting operators as Schur polynomials, with noncommuting hopping operators as arguments. The algebraic Bethe ansatz diagonalizes them, revealing a connection to the modular S matrix and fusion of the su(n WZNW model. The noncommutative Schur polynomials play roles similar to those of the primary field operators in the corresponding WZNW model. In particular, their 3-point functions are the su(n fusion multiplicities. We show here how the new phase model realization of affine fusion makes obvious the existence of threshold levels, and how it accommodates higher-genus fusion.
A phase-field simulation study of irregular grain boundary migration during recrystallization
DEFF Research Database (Denmark)
Moelans, N.; Zhang, Yubin; Godfrey, A.
2015-01-01
We present simulation results based on a phase-field model that describes the migration of recrystallization boundaries into spatially varying deformation energy fields. Energy fields with 2-dimensional variations representing 2 sets of dislocation boundaries lying at equal, but opposite, angles......, highly asymmetrical protrusions and retrusions can develop on the migrating recrystallization front resulting in a migration velocity considerably larger than that expected from standard recrystallization models. It is also seen that, when the wavelength of the variations in a deformation microstructure...
DEFF Research Database (Denmark)
Gammelmark, Søren; Mølmer, Klaus
2011-01-01
We investigate the thermodynamics of a combined Dicke and Ising model that exhibits a rich phenomenology arising from the second-order and quantum phase transitions from the respective models. The partition function is calculated using mean-field theory, and the free energy is analyzed in detail...... to determine the complete phase diagram of the system. The analysis reveals both first- and second-order Dicke phase transitions into a super-radiant state, and the cavity mean field in this regime acts as an effective magnetic field, which restricts the Ising chain dynamics to parameter ranges away from...... the Ising phase transition. Physical systems with first-order phase transitions are natural candidates for metrology and calibration purposes, and we apply filter theory to show that the sensitivity of the physical system to temperature and external fields reaches the 1/N Heisenberg limit....
Picosecond Electric-Field-Induced Threshold Switching in Phase-Change Materials.
Zalden, Peter; Shu, Michael J; Chen, Frank; Wu, Xiaoxi; Zhu, Yi; Wen, Haidan; Johnston, Scott; Shen, Zhi-Xun; Landreman, Patrick; Brongersma, Mark; Fong, Scott W; Wong, H-S Philip; Sher, Meng-Ju; Jost, Peter; Kaes, Matthias; Salinga, Martin; von Hoegen, Alexander; Wuttig, Matthias; Lindenberg, Aaron M
2016-08-05
Many chalcogenide glasses undergo a breakdown in electronic resistance above a critical field strength. Known as threshold switching, this mechanism enables field-induced crystallization in emerging phase-change memory. Purely electronic as well as crystal nucleation assisted models have been employed to explain the electronic breakdown. Here, picosecond electric pulses are used to excite amorphous Ag_{4}In_{3}Sb_{67}Te_{26}. Field-dependent reversible changes in conductivity and pulse-driven crystallization are observed. The present results show that threshold switching can take place within the electric pulse on subpicosecond time scales-faster than crystals can nucleate. This supports purely electronic models of threshold switching and reveals potential applications as an ultrafast electronic switch.
Mean field theory of dynamic phase transitions in ferromagnets
International Nuclear Information System (INIS)
Idigoras, O.; Vavassori, P.; Berger, A.
2012-01-01
We have studied the second order dynamic phase transition (DPT) of the two-dimensional kinetic Ising model by means of numerical calculations. While it is well established that the order parameter Q of the DPT is the average magnetization per external field oscillation cycle, the possible identity of the conjugate field has been addressed only recently. In this work, we demonstrate that our entire set of numerical data is fully consistent with the applied bias field H b being the conjugate field of order parameter Q. For this purpose, we have analyzed the Q(H b )-dependence and we have found that it follows the expected power law behavior with the same critical exponent as the mean field equilibrium case.
Microsegregation in multicomponent alloy analysed by quantitative phase-field model
International Nuclear Information System (INIS)
Ohno, M; Takaki, T; Shibuta, Y
2015-01-01
Microsegregation behaviour in a ternary alloy system has been analysed by means of quantitative phase-field (Q-PF) simulations with a particular attention directed at an influence of tie-line shift stemming from different liquid diffusivities of the solute elements. The Q-PF model developed for non-isothermal solidification in multicomponent alloys with non-zero solid diffusivities was applied to analysis of microsegregation in a ternary alloy consisting of fast and slow diffusing solute elements. The accuracy of the Q-PF simulation was first verified by performing the convergence test of segregation ratio with respect to the interface thickness. From one-dimensional analysis, it was found that the microsegregation of slow diffusing element is reduced due to the tie-line shift. In two-dimensional simulations, the refinement of microstructure, viz., the decrease of secondary arms spacing occurs at low cooling rates due to the formation of diffusion layer of slow diffusing element. It yields the reductions of degrees of microsegregation for both the fast and slow diffusing elements. Importantly, in a wide range of cooling rates, the degree of microsegregation of the slow diffusing element is always lower than that of the fast diffusing element, which is entirely ascribable to the influence of tie-line shift. (paper)
Phase field simulation of grain growth in porous uranium dioxide
International Nuclear Information System (INIS)
Ahmed, Karim; Pakarinen, Janne; Allen, Todd; El-Azab, Anter
2014-01-01
Graphical abstract: Display Omitted -- Abstract: A novel phase field model has been developed to investigate grain growth in porous polycrystalline UO 2 . Based on a system of Cahn–Hilliard and Allen–Cahn equations, the model takes into consideration both the curvature driven grain boundary motion and pore migration by surface diffusion. As such, the model accounts for the interaction between pore and grain boundary kinetics, which tends to retard the growth process. The phase field model parameters are found in terms of measurable material properties. Hence, quantitative results that can be compared with experiments were obtained. The model has been used to investigate the effect of porosity on the kinetics of grain growth in UO 2 . It is found that, as the amount of porosity increases, grain growth in UO 2 gradually changes from boundary controlled growth to pore controlled growth. For high porosity levels, the grain growth completely stops after a short evolution time. It is also found that the inhomogeneous distribution of pores leads to abnormal grain growth even without taking into account the anisotropy in grain boundary energy and mobility. The effects of porosity, temperature and initial microstructure on grain growth were thoroughly investigated. The model predictions are in good agreement with published experimental results of grain growth in UO 2
DEFF Research Database (Denmark)
Berning, Torsten; Odgaard, Madeleine; Kær, Søren Knudsen
2010-01-01
This work presents a study of multi-phase flow through the cathode side of a polymer electrolyte membrane fuel cell employing an interdigitated flow field plate. A previously published model has been extended in order to account for phase change kinetics, and a comparison between the interdigitated...... flow field design and a conventional straight channel design has been conducted. It is found that the parasitic pressure drop in the interdigitated design is in the range of a few thousand Pa and could be reduced to a few hundred Pa by choosing diffusion media with high in-plane permeability....... In the interdigitated design more product water is carried out of the cell in the vapor phase compared to the straight channel design which indicates that liquid water management might be less problematic. This effect also leads to the finding that in the interdigitated design more waste heat is carried out of the cell...
TCE field-scale simulation using immobile-mobile waste phase model
International Nuclear Information System (INIS)
Hamm, L.L.; Aleman, S.E.; Shadday, M.A.
1997-01-01
Groundwater contamination resulting from releases of chlorinated volatile organic compounds into the environment is commonplace. Industrial solvents, such as trichloroethylene (TCE), were historically released into top soils as a means of disposal. At numerous sites nationwide, cleanup efforts are underway. To evaluate the benefits associated with proposed remediation alternatives, flow and transport modeling is playing an ever increasing role. In many situations site characterization of contaminant source terms is very sketchy, resulting in a lack of necessary data to develop a reliable source term model directly from a database. As such, investigators are forced into an approach of estimating the source term in an inverse modeling fashion. Field-scale attempts are made here to predict the fate and transport of TCE under various remediation alternatives. Under a no action scenario, inverse modeling to establish the source term is performed where comparison to field measurements are made
Phase separation of superconducting phases in the Penson–Kolb–Hubbard model
International Nuclear Information System (INIS)
Kapcia, Konrad Jerzy; Czart, Wojciech Robert; Ptok, Andrzej
2016-01-01
In this paper, we determine the phase diagrams (for T = 0 as well as T > 0) of the Penson–Kolb–Hubbard model for two dimensional square lattice within Hartree–Fock mean-field theory focusing on an investigation of superconducting phases and on a possibility of the occurrence of the phase separation. We obtain that the phase separation, which is a state of coexistence of two different superconducting phases (with s- and η-wave symmetries), occurs in definite ranges of the electron concentration. In addition, increasing temperature can change the symmetry of the superconducting order parameter (from η-wave into s-wave). The system considered exhibits also an interesting multicritical behaviour including bicritical points. The relevance of the results to experiments for real materials is also discussed. (author)
Phase Separation of Superconducting Phases in the Penson-Kolb-Hubbard Model
Jerzy Kapcia, Konrad; Czart, Wojciech Robert; Ptok, Andrzej
2016-04-01
In this paper, we determine the phase diagrams (for T = 0 as well as T > 0) of the Penson-Kolb-Hubbard model for two dimensional square lattice within Hartree-Fock mean-field theory focusing on an investigation of superconducting phases and on a possibility of the occurrence of the phase separation. We obtain that the phase separation, which is a state of coexistence of two different superconducting phases (with s- and η-wave symmetries), occurs in definite ranges of the electron concentration. In addition, increasing temperature can change the symmetry of the superconducting order parameter (from η-wave into s-wave). The system considered exhibits also an interesting multicritical behaviour including bicritical points. The relevance of the results to experiments for real materials is also discussed.
A Three-Dimensional Pore-Scale Model for Non-Wetting Phase Mobilization with Ferrofluid
Wang, N.; Prodanovic, M.
2017-12-01
Ferrofluid, a stable dispersion of paramagnetic nanoparticles in water, can generate a distributed pressure difference across the phase interface in an immiscible two-phase flow under an external magnetic field. In water-wet porous media, this non-uniform pressure difference may be used to mobilize the non-wetting phase, e.g. oil, trapped in the pores. Previous numerical work by Soares et al. of two-dimensional single-pore model showed enhanced non-wetting phase recovery with water-based ferrofluid under certain magnetic field directions and decreased recovery under other directions. However, the magnetic field selectively concentrates in the high magnetic permeability ferrofluid which fills the small corners between the non-wetting phase and the solid wall. The magnetic field induced pressure is proportional to the square of local magnetic field strength and its normal component, and makes a significant impact on the non-wetting phase deformation. The two-dimensional model omitted the effect of most of these corners and is not sufficient to compute the magnetic-field-induced pressure difference or to predict the non-wetting blob deformation. Further, it is not clear that 3D effects on magnetic field in an irregular geometry can be approximated in 2D. We present a three-dimensional immiscible two-phase flow model to simulate the deformation of a non-wetting liquid blob in a single pore filled with a ferrofluid under a uniform external magnetic field. The ferrofluid is modeled as a uniform single phase because the nanoparticles are 104 times smaller than the pore. The open source CFD solver library OpenFOAM is used for the simulations based on the volume of fluid method. Simulations are performed in a converging-diverging channel model on different magnetic field direction, different initial oil saturations, and different pore shapes. Results indicate that the external magnetic field always stretches the non-wetting blob away from the solid channel wall. A magnetic
Turchi, Patrice E. A.; Fattebert, Jean-Luc; Dorr, Milo R.; Wickett, Michael E.; Belak, James F.
2011-03-01
We describe an algorithm for the numerical solution of a phase-field model (PFM) of microstructure evolution in alloys using physical parameters from thermodynamic (CALPHAD) and kinetic databases. The coupled system of PFM equations includes a local order parameter, a quaternion representation of local crystal orientation and a species composition parameter. Time evolution of microstructures and alloy composition is obtained using an implicit time integration of the system. Physical parameters in databases can be obtained either through experiment or first-principles calculations. Application to coring studies and microstructure evolution of Au-Ni will be presented. Prepared by LLNL under Contract DE-AC52-07NA27344
Three-dimensional two-phase mass transport model for direct methanol fuel cells
International Nuclear Information System (INIS)
Yang, W.W.; Zhao, T.S.; Xu, C.
2007-01-01
A three-dimensional (3D) steady-state model for liquid feed direct methanol fuel cells (DMFC) is presented in this paper. This 3D mass transport model is formed by integrating five sub-models, including a modified drift-flux model for the anode flow field, a two-phase mass transport model for the porous anode, a single-phase model for the polymer electrolyte membrane, a two-phase mass transport model for the porous cathode, and a homogeneous mist-flow model for the cathode flow field. The two-phase mass transport models take account the effect of non-equilibrium evaporation/ condensation at the gas-liquid interface. A 3D computer code is then developed based on the integrated model. After being validated against the experimental data reported in the literature, the code was used to investigate numerically transport behaviors at the DMFC anode and their effects on cell performance
Zero-field-cooled/field-cooled magnetization study of Dendrimer model
Energy Technology Data Exchange (ETDEWEB)
Arejdal, M., E-mail: arejdal.achdad@gmail.com [Laboratory of Magnetism and Physics of High Energies, Department of Physics, L.M.P.H.E (URAC-12), Faculty of Sciences, Mohammed V University, Rabat (Morocco); Bahmad, L. [Laboratory of Magnetism and Physics of High Energies, Department of Physics, L.M.P.H.E (URAC-12), Faculty of Sciences, Mohammed V University, Rabat (Morocco); Benyoussef, A. [Hassan II Academy of Science and Technology, Rabat (Morocco)
2017-01-01
Being motivated by Dendrimer model with mixed spins σ=3 and S=7/2, we investigated the magnetic nanoparticle system in this study. We analyzed and discussed the ground-state phase diagrams and the stable phases. Then, we elaborated and explained the magnetic properties of the system by using Monte Carlo Simulations (MCS) in the framework of the Ising model. In this way, we determined the blocking temperature, which is deduced through studying the partial-total magnetization and susceptibility as a function of the temperature, and we established the effects of both the exchange coupling interaction and the crystal field on the hysteresis loop.
Winczek, J.; Makles, K.; Gucwa, M.; Gnatowska, R.; Hatala, M.
2017-08-01
In the paper, the model of the thermal and structural strain calculation in a steel element during single-pass SAW surfacing is presented. The temperature field is described analytically assuming a bimodal volumetric model of heat source and a semi-infinite body model of the surfaced (rebuilt) workpiece. The electric arc is treated physically as one heat source. Part of the heat is transferred by the direct impact of the electric arc, while another part of the heat is transferred to the weld by the melted material of the electrode. Kinetics of phase transformations during heating is limited by temperature values at the beginning and at the end of austenitic transformation, while the progress of phase transformations during cooling is determined on the basis of TTT-welding diagramand JMA-K law for diffusive transformations, and K-M law for martensitic transformation. Totalstrains equal to the sum ofthermaland structuralstrainsinduced by phasetransformationsin weldingcycle.
Random matrix models for phase diagrams
International Nuclear Information System (INIS)
Vanderheyden, B; Jackson, A D
2011-01-01
We describe a random matrix approach that can provide generic and readily soluble mean-field descriptions of the phase diagram for a variety of systems ranging from quantum chromodynamics to high-T c materials. Instead of working from specific models, phase diagrams are constructed by averaging over the ensemble of theories that possesses the relevant symmetries of the problem. Although approximate in nature, this approach has a number of advantages. First, it can be useful in distinguishing generic features from model-dependent details. Second, it can help in understanding the 'minimal' number of symmetry constraints required to reproduce specific phase structures. Third, the robustness of predictions can be checked with respect to variations in the detailed description of the interactions. Finally, near critical points, random matrix models bear strong similarities to Ginsburg-Landau theories with the advantage of additional constraints inherited from the symmetries of the underlying interaction. These constraints can be helpful in ruling out certain topologies in the phase diagram. In this Key Issues Review, we illustrate the basic structure of random matrix models, discuss their strengths and weaknesses, and consider the kinds of system to which they can be applied.
Deviren, Bayram; Keskin, Mustafa; Canko, Osman
2008-03-01
We extend our recent paper [O. Canko, B. Deviren, M. Keskin, J. Phys.: Condens. Mater 118 (2006) 6635] to present a study, within a mean-field approach, the stationary states of the kinetic spin-3/2 Blume-Emery-Griffiths model with repulsive biquadratic interaction under the presence of a time varying (sinusoidal) magnetic field. We found that the dynamic phase diagrams of the present work exhibit more complex, richer and more topological different types of phase diagrams than our recent paper. Especially, the obtained dynamic phase diagrams show the ferrimagnetic ( i) phase in addition to the ferromagnetic ±3/2 ( f), ferromagnetic ±1/2 ( f), antiquadrupolar or staggered ( a) and disordered ( d) phases, and the f+i, f+d, i+d, f+i+d, a+d and/or f+i+a coexistence regions in addition to the f+f, f+d, f+a, f+d and/or f+a+d coexistence regions, depending on interaction parameters. Moreover, the phase diagrams exhibit dynamic zero-temperature critical, critical end, double critical end, multicritical, and/or pentacritical special points in addition to the dynamic tricritical, double critical end point, triple, quadruple and/or tetracritical special points that depending on the interaction parameters.
Dark-field electron holography for the measurement of geometric phase
International Nuclear Information System (INIS)
Hytch, M.J.; Houdellier, F.; Huee, F.; Snoeck, E.
2011-01-01
The genesis, theoretical basis and practical application of the new electron holographic dark-field technique for mapping strain in nanostructures are presented. The development places geometric phase within a unified theoretical framework for phase measurements by electron holography. The total phase of the transmitted and diffracted beams is described as a sum of four contributions: crystalline, electrostatic, magnetic and geometric. Each contribution is outlined briefly and leads to the proposal to measure geometric phase by dark-field electron holography (DFEH). The experimental conditions, phase reconstruction and analysis are detailed for off-axis electron holography using examples from the field of semiconductors. A method for correcting for thickness variations will be proposed and demonstrated using the phase from the corresponding bright-field electron hologram. -- Highlights: → Unified description of phase measurements in electron holography. → Detailed description of dark-field electron holography for geometric phase measurements. → Correction procedure for systematic errors due to thickness variations.
Kinetic Ising model in a time-dependent oscillating external magnetic field: effective-field theory
International Nuclear Information System (INIS)
Deviren, Bayram; Canko, Osman; Keskin, Mustafa
2010-01-01
Recently, Shi et al. [2008 Phys. Lett. A 372 5922] have studied the dynamical response of the kinetic Ising model in the presence of a sinusoidal oscillating field and presented the dynamic phase diagrams by using an effective-field theory (EFT) and a mean-field theory (MFT). The MFT results are in conflict with those of the earlier work of Tomé and de Oliveira, [1990 Phys. Rev. A 41 4251]. We calculate the dynamic phase diagrams and find that our results are similar to those of the earlier work of Tomé and de Oliveira; hence the dynamic phase diagrams calculated by Shi et al. are incomplete within both theories, except the low values of frequencies for the MFT calculation. We also investigate the influence of external field frequency (ω) and static external field amplitude (h 0 ) for both MFT and EFT calculations. We find that the behaviour of the system strongly depends on the values of ω and h 0 . (general)
Visualization of velocity field and phase distribution in gas-liquid two-phase flow by NMR imaging
International Nuclear Information System (INIS)
Matsui, G.; Monji, H.; Obata, J.
2004-01-01
NMR imaging has been applied in the field of fluid mechanics, mainly single phase flow, to visualize the instantaneous flow velocity field. In the present study, NMR imaging was used to visualize simultaneously both the instantaneous phase structure and velocity field of gas-liquid two-phase flow. Two methods of NMR imaging were applied. One is useful to visualize both the one component of liquid velocity and the phase distribution. This method was applied to horizontal two-phase flow and a bubble rising in stagnant oil. It was successful in obtaining some pictures of velocity field and phase distribution on the cross section of the pipe. The other is used to visualize a two-dimensional velocity field. This method was applied to a bubble rising in a stagnant water. The velocity field was visualized after and before the passage of a bubble at the measuring cross section. Furthermore, the distribution of liquid velocity was obtained. (author)
Quantification of source-term profiles from near-field geochemical models
International Nuclear Information System (INIS)
McKinley, I.G.
1985-01-01
A geochemical model of the near-field is described which quantitatively treats the processes of engineered barrier degradation, buffering of aqueous chemistry by solid phases, nuclide solubilization and transport through the near-field and release to the far-field. The radionuclide source-terms derived from this model are compared with those from a simpler model used for repository safety analysis. 10 refs., 2 figs., 2 tabs
Quantum mechanical force fields for condensed phase molecular simulations
Giese, Timothy J.; York, Darrin M.
2017-09-01
Molecular simulations are powerful tools for providing atomic-level details into complex chemical and physical processes that occur in the condensed phase. For strongly interacting systems where quantum many-body effects are known to play an important role, density-functional methods are often used to provide the model with the potential energy used to drive dynamics. These methods, however, suffer from two major drawbacks. First, they are often too computationally intensive to practically apply to large systems over long time scales, limiting their scope of application. Second, there remain challenges for these models to obtain the necessary level of accuracy for weak non-bonded interactions to obtain quantitative accuracy for a wide range of condensed phase properties. Quantum mechanical force fields (QMFFs) provide a potential solution to both of these limitations. In this review, we address recent advances in the development of QMFFs for condensed phase simulations. In particular, we examine the development of QMFF models using both approximate and ab initio density-functional models, the treatment of short-ranged non-bonded and long-ranged electrostatic interactions, and stability issues in molecular dynamics calculations. Example calculations are provided for crystalline systems, liquid water, and ionic liquids. We conclude with a perspective for emerging challenges and future research directions.
Direct imaging of phase objects enables conventional deconvolution in bright field light microscopy.
Directory of Open Access Journals (Sweden)
Carmen Noemí Hernández Candia
Full Text Available In transmitted optical microscopy, absorption structure and phase structure of the specimen determine the three-dimensional intensity distribution of the image. The elementary impulse responses of the bright field microscope therefore consist of separate absorptive and phase components, precluding general application of linear, conventional deconvolution processing methods to improve image contrast and resolution. However, conventional deconvolution can be applied in the case of pure phase (or pure absorptive objects if the corresponding phase (or absorptive impulse responses of the microscope are known. In this work, we present direct measurements of the phase point- and line-spread functions of a high-aperture microscope operating in transmitted bright field. Polystyrene nanoparticles and microtubules (biological polymer filaments serve as the pure phase point and line objects, respectively, that are imaged with high contrast and low noise using standard microscopy plus digital image processing. Our experimental results agree with a proposed model for the response functions, and confirm previous theoretical predictions. Finally, we use the measured phase point-spread function to apply conventional deconvolution on the bright field images of living, unstained bacteria, resulting in improved definition of cell boundaries and sub-cellular features. These developments demonstrate practical application of standard restoration methods to improve imaging of phase objects such as cells in transmitted light microscopy.
Radiation phase of a dipole field
International Nuclear Information System (INIS)
Shunovsky, A.S.
1998-01-01
In the case of a dipole electromagnetic radiation, the operator of the 'radiation phase' is defined. It is shown that this operator has a discrete spectrum with eigenvalues, lying in the segment [0,2π]. Some properties of the radiation phase and polarization are discussed. Seventy years of investigation of the problem of quantum phase led to the conclusion that there is no unique quantum variable, determining universally the measured phase properties of electromagnetic radiation. The operator constructions, describing cosine and sine of the phase, could be different schemes of measurement. This fact has accurately been confirmed by a number of recent experiments. Thus, it seems to be quite plausible that the quantum phase properties of an electromagnetic radiation are determined by interaction photons with a macroscopic detecting device. It is pertinent to ask the following question. Are the quantum phase properties of radiation completely determined by such an interaction or the photons have their own inherent phase properties which might be measured even if they are modified by interaction with a detecting device? The universally recognized fact is that the vacuum state of field is degenerated with respect to phase. If a quantum radiation has its inherent phase properties, it means that the degeneration is taken off in the process of generation which is an interaction of the vacuum field with excited states of atoms or molecules. By virtue of this picture proposed in, what all one can expect is that the inherent quantum phase properties of radiation are completely determined by a source via the conservation laws, describing the generation process. Even in this way, it seems to determine a unique quantum phase of radiation. As a matter of fact, there are two conservation laws, admitting a nontrivial angular dependence
Effective-field theory on the kinetic Ising model
International Nuclear Information System (INIS)
Shi Xiaoling; Wei Guozhu; Li Lin
2008-01-01
As an analytical method, the effective-field theory (EFT) is used to study the dynamical response of the kinetic Ising model in the presence of a sinusoidal oscillating field. The effective-field equations of motion of the average magnetization are given for the square lattice (Z=4) and the simple cubic lattice (Z=6), respectively. The dynamic order parameter, the hysteresis loop area and the dynamic correlation are calculated. In the field amplitude h 0 /ZJ-temperature T/ZJ plane, the phase boundary separating the dynamic ordered and the disordered phase has been drawn, and the dynamical tricritical point has been observed. We also make the compare results of EFT with that given by using the mean field theory (MFT)
Two Populations Mean-Field Monomer-Dimer Model
Alberici, Diego; Mingione, Emanuele
2018-04-01
A two populations mean-field monomer-dimer model including both hard-core and attractive interactions between dimers is considered. The pressure density in the thermodynamic limit is proved to satisfy a variational principle. A detailed analysis is made in the limit of one population is much smaller than the other and a ferromagnetic mean-field phase transition is found.
Wang, Dan; Du, Haoyuan; Wang, Linxiang; Melnik, Roderick
2018-05-01
The fully coupled thermo-electro-mechanical properties of nanoscale ferroelectric actuators are investigated by a phase field model. Firstly, the thermal effect is incorporated into the commonly-used phase field model for ferroelectric materials in a thermodynamic consistent way and the governing equation for the temperature field is derived. Afterwards, the modified model is numerically implemented to study a selected prototype of the ferroelectric actuators, where strain associated with electric field-induced non-180° domain switching is employed. The temperature variation and energy flow in the actuation process are presented, which enhances our understanding of the working mechanism of the actuators. Furthermore, the influences of the input voltage frequency and the thermal boundary condition on the temperature variation are demonstrated and carefully discussed in the context of thermal management for real applications.
A novel phase-sensitive scanning near-field optical microscope
International Nuclear Information System (INIS)
Wu Xiao-Yu; Lin Sun; Tan Qiao-Feng; Wang Jia
2015-01-01
Phase is one of the most important parameters of electromagnetic waves. It is the phase distribution that determines the propagation, reflection, refraction, focusing, divergence, and coupling features of light, and further affects the intensity distribution. In recent years, the designs of surface plasmon polariton (SPP) devices have mostly been based on the phase modulation and manipulation. Here we demonstrate a phase sensitive multi-parameter heterodyne scanning near-field optical microscope (SNOM) with an aperture probe in the visible range, with which the near field optical phase and amplitude distributions can be simultaneously obtained. A novel architecture combining a spatial optical path and a fiber optical path is employed for stability and flexibility. Two kinds of typical nano-photonic devices are tested with the system. With the phase-sensitive SNOM, the phase and amplitude distributions of any nano-optical field and localized field generated with any SPP nano-structures and irregular phase modulation surfaces can be investigated. The phase distribution and the interference pattern will help us to gain a better understanding of how light interacts with SPP structures and how SPP waves generate, localize, convert, and propagate on an SPP surface. This will be a significant guidance on SPP nano-structure design and optimization. (paper)
Virgo, Simon; Ankit, Kumar; Nestler, Britta; Urai, Janos L.
2016-04-01
Crack-seal veins form in a complex interplay of coupled thermal, hydraulic, mechanical and chemical processes. Their formation and cyclic growth involves brittle fracturing and dilatancy, phases of increased fluid flow and the growth of crystals that fill the voids and reestablish the mechanical strength. Existing numerical models of vein formation focus on selected aspects of the coupled process. Until today, no model exists that is able to use a realistic representation of the fracturing AND sealing processes, simultaneously. To address this challenge, we propose the bidirectional coupling of two numerical methods that have proven themselves as very powerful to model the fundamental processes acting in crack-seal systems: Phase-field and the Discrete Element Method (DEM). The phase-field Method was recently successfully extended to model the precipitation of quartz crystals from an aqueous solution and applied to model the sealing of a vein over multiple opening events (Ankit et al., 2013; Ankit et al., 2015a; Ankit et al., 2015b). The advantage over former, purely kinematic approaches is that in phase-field, the crystal growth is modeled based on thermodynamic and kinetic principles. Different driving forces for microstructure evolution, such as chemical bulk free energy, interfacial energy, elastic strain energy and different transport processes, such as mass diffusion and advection, can be coupled and the effect on the evolution process can be studied in 3D. The Discrete Element Method was already used in several studies to model the fracturing of rocks and the incremental growth of veins by repeated fracturing (Virgo et al., 2013; Virgo et al., 2014). Materials in DEM are represented by volumes of packed spherical particles and the response to the material to stress is modeled by interaction of the particles with their nearest neighbours. For rocks, in 3D, the method provides a realistic brittle failure behaviour. Exchange Routines are being developed that
Energy Technology Data Exchange (ETDEWEB)
Hashino, Katsuya, E-mail: hashino@jodo.sci.u-toyama.ac.jp [Department of Physics, University of Toyama, 3190 Gofuku, Toyama 930-8555 (Japan); Kakizaki, Mitsuru, E-mail: kakizaki@sci.u-toyama.ac.jp [Department of Physics, University of Toyama, 3190 Gofuku, Toyama 930-8555 (Japan); Kanemura, Shinya, E-mail: kanemu@sci.u-toyama.ac.jp [Department of Physics, University of Toyama, 3190 Gofuku, Toyama 930-8555 (Japan); Ko, Pyungwon, E-mail: pko@kias.re.kr [School of Physics, KIAS, Seoul 02455 (Korea, Republic of); Matsui, Toshinori, E-mail: matsui@kias.re.kr [School of Physics, KIAS, Seoul 02455 (Korea, Republic of)
2017-03-10
We calculate the spectrum of gravitational waves originated from strongly first order electroweak phase transition in the extended Higgs model with a real singlet scalar field. In order to calculate the bubble nucleation rate, we perform a two-field analysis and evaluate bounce solutions connecting the true and the false vacua using the one-loop effective potential at finite temperatures. Imposing the Sakharov condition of the departure from thermal equilibrium for baryogenesis, we survey allowed regions of parameters of the model. We then investigate the gravitational waves produced at electroweak bubble collisions in the early Universe, such as the sound wave, the bubble wall collision and the plasma turbulence. We find that the strength at the peak frequency can be large enough to be detected at future space-based gravitational interferometers such as eLISA, DECIGO and BBO. Predicted deviations in the various Higgs boson couplings are also evaluated at the zero temperature, and are shown to be large enough too. Therefore, in this model strongly first order electroweak phase transition can be tested by the combination of the precision study of various Higgs boson couplings at the LHC, the measurement of the triple Higgs boson coupling at future lepton colliders and the shape of the spectrum of gravitational wave detectable at future gravitational interferometers.
Discrete phase space based on finite fields
International Nuclear Information System (INIS)
Gibbons, Kathleen S.; Hoffman, Matthew J.; Wootters, William K.
2004-01-01
The original Wigner function provides a way of representing in phase space the quantum states of systems with continuous degrees of freedom. Wigner functions have also been developed for discrete quantum systems, one popular version being defined on a 2Nx2N discrete phase space for a system with N orthogonal states. Here we investigate an alternative class of discrete Wigner functions, in which the field of real numbers that labels the axes of continuous phase space is replaced by a finite field having N elements. There exists such a field if and only if N is a power of a prime; so our formulation can be applied directly only to systems for which the state-space dimension takes such a value. Though this condition may seem limiting, we note that any quantum computer based on qubits meets the condition and can thus be accommodated within our scheme. The geometry of our NxN phase space also leads naturally to a method of constructing a complete set of N+1 mutually unbiased bases for the state space
Phase retrieval in near-field measurements by array synthesis
DEFF Research Database (Denmark)
Wu, Jian; Larsen, Flemming Holm
1991-01-01
The phase retrieval problem in near-field antenna measurements is formulated as an array synthesis problem. As a test case, a particular synthesis algorithm has been used to retrieve the phase of a linear array......The phase retrieval problem in near-field antenna measurements is formulated as an array synthesis problem. As a test case, a particular synthesis algorithm has been used to retrieve the phase of a linear array...
International Nuclear Information System (INIS)
Shi, San-Qiang; Xiao, Zhihua
2015-01-01
A temperature dependent, quantitative free energy functional was developed for the modeling of hydride precipitation in zirconium alloys within a phase field scheme. The model takes into account crystallographic variants of hydrides, interfacial energy between hydride and matrix, interfacial energy between hydrides, elastoplastic hydride precipitation and interaction with externally applied stress. The model is fully quantitative in real time and real length scale, and simulation results were compared with limited experimental data available in the literature with a reasonable agreement. The work calls for experimental and/or theoretical investigations of some of the key material properties that are not yet available in the literature
International Nuclear Information System (INIS)
Dahmen, Bernd
1994-01-01
A systematic method to obtain strong coupling expansions for scattering quantities in hamiltonian lattice field theories is presented. I develop the conceptual ideas for the case of the hamiltonian field theory analogue of the Ising model, in d space and one time dimension. The main result is a convergent series representation for the scattering states and the transition matrix. To be explicit, the special cases of d=1 and d=3 spatial dimensions are discussed in detail. I compute the next-to-leading order approximation for the phase shifts. The application of the method to investigate low-energy scattering phenomena in lattice gauge theory and QCD is proposed. ((orig.))
Three-dimensional phase-field simulation on the deformation of metallic glass nanowires
International Nuclear Information System (INIS)
Zhang, H.Y.; Zheng, G.P.
2014-01-01
Highlights: • 3D phase-field modeling is developed to investigate the deformation of MG nanowires. • The surface defects significantly affect the mechanical properties of nanowires. • Multiple shear bands are initiated from the surfaces of nanowires with D < 50 nm. - Abstract: It is very challenging to investigate the deformation mechanisms in micro- and nano-scale metallic glasses with diameters below several hundred nanometers using the atomistic simulation or the experimental approaches. In this work, we develop the fully three-dimensional phase-field model to bridge this gap and investigate the sample size effects on the deformation behaviors of metallic glass nanowires. The initial deformation defects on the surface are found to significantly affect the mechanical strength and deformation mode of nanowires. The improved ductility of metallic glass nanowires could be related with the multiple shear bands initiated from the nanowire surfaces
Energy Technology Data Exchange (ETDEWEB)
Aminfar, Habib, E-mail: hh_aminfar@tabrizu.ac.i [Faculty of Mechanical Engineering, University of Tabriz, Tabriz (Iran, Islamic Republic of); Mohammadpourfard, Mousa, E-mail: Mohammadpour@azaruniv.ed [Department of Mechanical Engineering, Azarbaijan University of Tarbiat Moallem, Tabriz, P.O. Box 53751-71379 (Iran, Islamic Republic of); Narmani Kahnamouei, Yousef, E-mail: Narmani87@ms.tabrizu.ac.i [Faculty of Mechanical Engineering, University of Tabriz, Tabriz (Iran, Islamic Republic of)
2011-08-15
In this paper, results of applying a non-uniform magnetic field on a ferrofluid (kerosene and 4 vol% Fe{sub 3}O{sub 4}) flow in a vertical tube have been reported. The hydrodynamics and thermal behavior of the flow are investigated numerically using the two phase mixture model and the control volume technique. Two positive and negative magnetic field gradients have been examined. Based on the obtained results the Nusselt number can be controlled externally using the magnetic field with different intensity and gradients. It is concluded that the magnetic field with negative gradient acts similar to Buoyancy force and augments the Nusselt number, while the magnetic field with positive gradient decreases it. Also with the negative gradient of the magnetic field, pumping power increases and vice versa for the positive gradient case. - Highlights: We model hydrothermal behavior of a ferrofluid flow using two phase mixture model. Various external non-uniform magnetic fields were implemented in a vertical tube. Nusselt number can be controlled using the magnetic field with different gradients. The magnetic field is more effective in low Reynolds numbers. Heat transfer enhancement using the magnetic field needs high pumping power.
Lindell, Rebecca S.; Sommer, Steven R.
2004-09-01
The Lunar Phases Concept Inventory (LPCI) is a twenty-item multiple-choice inventory developed to aid instructors in assessing the mental models their students utilize when answering questions concerning phases of the moon. Based upon an in-depth qualitative investigation of students' understanding of lunar phases, the LPCI was designed to take advantage of the innovative model analysis theory to probe the different dimensions of students' mental models of lunar phases. As part of a national field test, pre-instructional LPCI data was collected for over 750 students from multiple post-secondary institutions across the United States and Canada. Application of model analysis theory to this data set allowed researchers to probe the different mental models of lunar phases students across the country utilize prior to instruction. Results of this analysis display strikingly similar results for the different institutions, suggesting a potential underlying cognitive framework.
Phase-space representation of non-classical behaviour of scalar wave-fields
International Nuclear Information System (INIS)
Canas-Cardona, Gustavo; Castaneda, Roman; Vinck-Posada, Herbert
2011-01-01
The modelling of optical fields by using radiant and virtual point sources for the spatial coherence wavelets in the phase-space representation evidences some effects, conventionally attributed to non-classical correlations of light, although such type of correlations are not explicitly included in the model. Specifically, a light state is produced that has similar morphology to the Wigner Distribution Function of the well-known quantum Schroedinger cat and squeezed states.
Directory of Open Access Journals (Sweden)
Katsuya Hashino
2017-03-01
Full Text Available We calculate the spectrum of gravitational waves originated from strongly first order electroweak phase transition in the extended Higgs model with a real singlet scalar field. In order to calculate the bubble nucleation rate, we perform a two-field analysis and evaluate bounce solutions connecting the true and the false vacua using the one-loop effective potential at finite temperatures. Imposing the Sakharov condition of the departure from thermal equilibrium for baryogenesis, we survey allowed regions of parameters of the model. We then investigate the gravitational waves produced at electroweak bubble collisions in the early Universe, such as the sound wave, the bubble wall collision and the plasma turbulence. We find that the strength at the peak frequency can be large enough to be detected at future space-based gravitational interferometers such as eLISA, DECIGO and BBO. Predicted deviations in the various Higgs boson couplings are also evaluated at the zero temperature, and are shown to be large enough too. Therefore, in this model strongly first order electroweak phase transition can be tested by the combination of the precision study of various Higgs boson couplings at the LHC, the measurement of the triple Higgs boson coupling at future lepton colliders and the shape of the spectrum of gravitational wave detectable at future gravitational interferometers.
Energy Technology Data Exchange (ETDEWEB)
Lai Wei, E-mail: laiwei@msu.ed [Department of Chemical Engineering and Materials Science, Michigan State University, East Lansing, MI 48824 (United States); Ciucci, Francesco [Heidelberg Graduate School of Mathematical and Computational Methods for the Sciences, University of Heidelberg, INF 368 D - 69120 Heidelberg (Germany)
2010-12-15
Thermodynamics and kinetics of phase transformation in intercalation battery electrodes are investigated by phenomenological models which include a mean-field lattice-gas thermodynamic model and a generalized Poisson-Nernst-Planck equation set based on linear irreversible thermodynamics. The application of modeling to a porous intercalation electrode leads to a hierarchical equivalent circuit with elements of explicit physical meanings. The equivalent circuit corresponding to the intercalation particle of planar, cylindrical and spherical symmetry is reduced to a diffusion equation with concentration dependent diffusivity. The numerical analysis of the diffusion equation suggests the front propagation behavior during phase transformation. The present treatment is also compared with the conventional moving boundary and phase field approaches.
Two-phase regime in the magnetic field-temperature phase diagram of a type-II superconductor
International Nuclear Information System (INIS)
Adams, L.L.A.; Halterman, Klaus; Valls, Oriol T.; Goldman, A.M.
2004-01-01
The magnetic field and temperature dependencies of the magnetic moments of superconducting crystals of V 3 Si have been studied. In a constant magnetic field and at temperatures somewhat below the superconducting transition temperature, the moments are hysteretic in temperature. However, the magnetic moment-magnetic field isotherms are reversible and exhibit features that formally resemble the pressure-volume isotherms of the liquid-gas transition. This suggests the existence of a first-order phase transition, a two-phase regime, and a critical point in the superconducting phase diagram. The two phases are disordered vortex configurations with the same magnetization, but with different vortex densities. The entropy change, determined from the data using the Clausius-Clapeyron equation, is consistent with estimates based on the difference in the vortex densities of the two phases
Two-phase regime in the magnetic field-temperature phase diagram of a type-II superconductor
Energy Technology Data Exchange (ETDEWEB)
Adams, L.L.A.; Halterman, Klaus; Valls, Oriol T.; Goldman, A.M
2004-01-01
The magnetic field and temperature dependencies of the magnetic moments of superconducting crystals of V{sub 3}Si have been studied. In a constant magnetic field and at temperatures somewhat below the superconducting transition temperature, the moments are hysteretic in temperature. However, the magnetic moment-magnetic field isotherms are reversible and exhibit features that formally resemble the pressure-volume isotherms of the liquid-gas transition. This suggests the existence of a first-order phase transition, a two-phase regime, and a critical point in the superconducting phase diagram. The two phases are disordered vortex configurations with the same magnetization, but with different vortex densities. The entropy change, determined from the data using the Clausius-Clapeyron equation, is consistent with estimates based on the difference in the vortex densities of the two phases.
Phase transitions in a lattice population model
International Nuclear Information System (INIS)
Windus, Alastair; Jensen, Henrik J
2007-01-01
We introduce a model for a population on a lattice with diffusion and birth/death according to 2A→3A and A→Φ for a particle A. We find that the model displays a phase transition from an active to an absorbing state which is continuous in 1 + 1 dimensions and of first-order in higher dimensions in agreement with the mean field equation. For the (1 + 1)-dimensional case, we examine the critical exponents and a scaling function for the survival probability and show that it belongs to the universality class of directed percolation. In higher dimensions, we look at the first-order phase transition by plotting a histogram of the population density and use the presence of phase coexistence to find an accurate value for the critical point in 2 + 1 dimensions
Modeling Phase-transitions Using a High-performance, Isogeometric Analysis Framework
Vignal, Philippe
2014-06-06
In this paper, we present a high-performance framework for solving partial differential equations using Isogeometric Analysis, called PetIGA, and show how it can be used to solve phase-field problems. We specifically chose the Cahn-Hilliard equation, and the phase-field crystal equation as test cases. These two models allow us to highlight some of the main advantages that we have access to while using PetIGA for scientific computing.
Xu, Xianmin; Wang, Xiaoping
2010-01-01
In this paper, the equilibrium behavior of an immiscible two phase fluid on a rough surface is studied from a phase field equation derived from minimizing the total free energy of the system. When the size of the roughness becomes small, we derive the effective boundary condition for the equation by the multiple scale expansion homogenization technique. The Wenzel and Cassie equations for the apparent contact angles on the rough surfaces are then derived from the effective boundary condition. The homogenization results are proved rigorously by the F-convergence theory. © 2010 Society for Industrial and Applied Mathematics.
Self-consistent Random Phase Approximation applied to a schematic model of the field theory
International Nuclear Information System (INIS)
Bertrand, Thierry
1998-01-01
The self-consistent Random Phase Approximation (SCRPA) is a method allowing in the mean-field theory inclusion of the correlations in the ground and excited states. It has the advantage of not violating the Pauli principle in contrast to RPA, that is based on the quasi-bosonic approximation; in addition, numerous applications in different domains of physics, show a possible variational character. However, the latter should be formally demonstrated. The first model studied with SCRPA is the anharmonic oscillator in the region where one of its symmetries is spontaneously broken. The ground state energy is reproduced by SCRPA more accurately than RPA, with no violation of the Ritz variational principle, what is not the case for the latter approximation. The success of SCRPA is the the same in case of ground state energy for a model mixing bosons and fermions. At the transition point the SCRPA is correcting RPA drastically, but far from this region the correction becomes negligible, both methods being of similar precision. In the deformed region in the case of RPA a spurious mode occurred due to the microscopical character of the model.. The SCRPA may also reproduce this mode very accurately and actually it coincides with an excitation in the exact spectrum
A cavitation model based on Eulerian stochastic fields
Magagnato, F.; Dumond, J.
2013-12-01
Non-linear phenomena can often be described using probability density functions (pdf) and pdf transport models. Traditionally the simulation of pdf transport requires Monte-Carlo codes based on Lagrangian "particles" or prescribed pdf assumptions including binning techniques. Recently, in the field of combustion, a novel formulation called the stochastic-field method solving pdf transport based on Eulerian fields has been proposed which eliminates the necessity to mix Eulerian and Lagrangian techniques or prescribed pdf assumptions. In the present work, for the first time the stochastic-field method is applied to multi-phase flow and in particular to cavitating flow. To validate the proposed stochastic-field cavitation model, two applications are considered. Firstly, sheet cavitation is simulated in a Venturi-type nozzle. The second application is an innovative fluidic diode which exhibits coolant flashing. Agreement with experimental results is obtained for both applications with a fixed set of model constants. The stochastic-field cavitation model captures the wide range of pdf shapes present at different locations.
Energy Technology Data Exchange (ETDEWEB)
Jamshidian, M., E-mail: jamshidian@cc.iut.ac.ir [Department of Mechanical Engineering, Isfahan University of Technology, Isfahan 84156-83111 (Iran, Islamic Republic of); Institute of Structural Mechanics, Bauhaus-University Weimar, Marienstrasse 15, 99423 Weimar (Germany); Thamburaja, P., E-mail: prakash.thamburaja@gmail.com [Department of Mechanical & Materials Engineering, Universiti Kebangsaan Malaysia (UKM), Bangi 43600 (Malaysia); Rabczuk, T., E-mail: timon.rabczuk@tdt.edu.vn [Division of Computational Mechanics, Ton Duc Thang University, Ho Chi Minh City (Viet Nam); Faculty of Civil Engineering, Ton Duc Thang University, Ho Chi Minh City (Viet Nam)
2016-12-15
A previously-developed finite-deformation- and crystal-elasticity-based constitutive theory for stressed grain growth in cubic polycrystalline bodies has been augmented to include a description of excess surface energy and grain-growth stagnation mechanisms through the use of surface effect state variables in a thermodynamically-consistent manner. The constitutive theory was also implemented into a multiscale coupled finite-element and phase-field computational framework. With the material parameters in the constitutive theory suitably calibrated, our three-dimensional numerical simulations show that the constitutive model is able to accurately predict the experimentally-determined evolution of crystallographic texture and grain size statistics in polycrystalline copper thin films deposited on polyimide substrate and annealed at high-homologous temperatures. In particular, our numerical analyses show that the broad texture transition observed in the annealing experiments of polycrystalline thin films is caused by grain growth stagnation mechanisms. - Graphical abstract: - Highlights: • Developing a theory for stressed grain growth in polycrystalline thin films. • Implementation into a multiscale coupled finite-element and phase-field framework. • Quantitative reproduction of the experimental grain growth data by simulations. • Revealing the cause of texture transition to be due to the stagnation mechanisms.
Possibility of the field-induced spin-nematic phase in LiCuVO4
International Nuclear Information System (INIS)
Hagiwara, M; Fujita, T; Yamaguchi, H; Kimura, S; Omura, K; Svistov, L E; Smirnov, A I; Prokofiev, A; Honda, Z
2011-01-01
We report on the magnetization of the frustrated S = 1/2 chain compound LiCuVO 4 . In addition to the transition from a planar spiral to a spin modulated structure observed recently by NMR, another transition was observed just below the saturation field. This magnetic phase could be a spin nematic, namely a condensation of two magnon bound states, phase which was predicted theoretically in the S = 1/2 linear chain model with the nearest neighbor ferromagnetic and the next nearest neighbor antiferromagnetic exchange interactions. The slope of magnetization in this phase is in good agreement with a calculated one in a realistic quasi 2-dimensional model (M. E. Zhitomirsky and H. Tsunetsugu, Europhys. Lett. 92 37001 (2010)). We compare the observed phase diagram with a numerically calculated one and discuss the possibility of the spin nematic phase.
Convergence to stationary solutions for a parabolic-hyperbolic phase-field system
Czech Academy of Sciences Publication Activity Database
Grasselli, M.; Petzeltová, Hana; Schimperna, G.
2006-01-01
Roč. 5, č. 4 (2006), s. 827-838 ISSN 1534-0392 R&D Projects: GA AV ČR(CZ) IAA1019302 Institutional research plan: CEZ:AV0Z10190503 Keywords : phase-field models * convergence to stationary solutions * Łojasiewicz-Simon inequality Subject RIV: BA - General Mathematics Impact factor: 0.857, year: 2006
Magnetic Fields at First Order Phase Transition: A Threat to Electroweak Baryogenesis
De Simone, Andrea; Quiros, Mariano; Riotto, Antonio
2011-01-01
The generation of the observed baryon asymmetry may have taken place during the electroweak phase transition, thus involving physics testable at LHC, a scenario dubbed electroweak baryogenesis. In this paper we point out that the magnetic field which is produced in the bubbles of a first order phase transition endangers the baryon asymmetry produced in the bubble walls. The reason being that the produced magnetic field couples to the sphaleron magnetic moment and lowers the sphaleron energy; this strengthens the sphaleron transitions inside the bubbles and triggers a more effective wash out of the baryon asymmetry. We apply this scenario to the Minimal Supersymmetric extension of the Standard Model (MSSM) where, in the absence of a magnetic field, successful electroweak baryogenesis requires the lightest CP-even Higgs and the right-handed stop masses to be lighter than about 127 GeV and 120 GeV, respectively. We show that even for moderate values of the magnetic field, the Higgs mass required to preserve the ...
Nestler, B.; Danilov, D.; Galenko, P.
2005-07-01
A phase-field model for non-isothermal solidification in multicomponent systems [SIAM J. Appl. Math. 64 (3) (2004) 775-799] consistent with the formalism of classic irreversible thermodynamics is used for numerical simulations of crystal growth in a pure material. The relation of this approach to the phase-field model by Bragard et al. [Interface Science 10 (2-3) (2002) 121-136] is discussed. 2D and 3D simulations of dendritic structures are compared with the analytical predictions of the Brener theory [Journal of Crystal Growth 99 (1990) 165-170] and with recent experimental measurements of solidification in pure nickel [Proceedings of the TMS Annual Meeting, March 14-18, 2004, pp. 277-288; European Physical Journal B, submitted for publication]. 3D morphology transitions are obtained for variations in surface energy and kinetic anisotropies at different undercoolings. In computations, we investigate the convergence behaviour of a standard phase-field model and of its thin interface extension at different undercoolings and at different ratios between the diffuse interface thickness and the atomistic capillary length. The influence of the grid anisotropy is accurately analyzed for a finite difference method and for an adaptive finite element method in comparison.
Dimensional reduction of the Standard Model coupled to a new singlet scalar field
Energy Technology Data Exchange (ETDEWEB)
Brauner, Tomáš [Faculty of Science and Technology, University of Stavanger,N-4036 Stavanger (Norway); Tenkanen, Tuomas V.I. [Department of Physics and Helsinki Institute of Physics,P.O. Box 64, FI-00014 University of Helsinki (Finland); Tranberg, Anders [Faculty of Science and Technology, University of Stavanger,N-4036 Stavanger (Norway); Vuorinen, Aleksi [Department of Physics and Helsinki Institute of Physics,P.O. Box 64, FI-00014 University of Helsinki (Finland); Weir, David J. [Faculty of Science and Technology, University of Stavanger,N-4036 Stavanger (Norway); Department of Physics and Helsinki Institute of Physics,P.O. Box 64, FI-00014 University of Helsinki (Finland)
2017-03-01
We derive an effective dimensionally reduced theory for the Standard Model augmented by a real singlet scalar. We treat the singlet as a superheavy field and integrate it out, leaving an effective theory involving only the Higgs and SU(2){sub L}×U(1){sub Y} gauge fields, identical to the one studied previously for the Standard Model. This opens up the possibility of efficiently computing the order and strength of the electroweak phase transition, numerically and nonperturbatively, in this extension of the Standard Model. Understanding the phase diagram is crucial for models of electroweak baryogenesis and for studying the production of gravitational waves at thermal phase transitions.
On the phase transition nature in compressible Ising models
International Nuclear Information System (INIS)
Ota, A.T.
1985-01-01
The phase transition phenomenon is analysed in a compressible ferromagnetic Ising model at null field, through the mean-field approximation. The model studied is d-dimensional under the magnetic point of view and one-dimensional under the elastic point of view. This is achieved keeping the compressive interactions among the ions and rejecting annealing forces completely. The exchange parameter J is linear and the elastic potential quadratic in relation to the microscopic shifts of the lattice. In the one-dimensional case, this model shows no phase transition. In the two-dimensional case, the role of the S i spin of the i-the ion is crucial: a) for spin 1/2 the transitions are of second order; b) for spin 1, desides the second order transitions there is a three-critical point and a first-order transitions line. (L.C.) [pt
Models and correlations of the DEBRIS Late-Phase Melt Progression Model
International Nuclear Information System (INIS)
Schmidt, R.C.; Gasser, R.D.
1997-09-01
The DEBRIS Late Phase Melt Progression Model is an assembly of models, embodied in a computer code, which is designed to treat late-phase melt progression in dry rubble (or debris) regions that can form as a consequence of a severe core uncover accident in a commercial light water nuclear reactor. The approach is fully two-dimensional, and incorporates a porous medium modeling framework together with conservation and constitutive relationships to simulate the time-dependent evolution of such regions as various physical processes act upon the materials. The objective of the code is to accurately model these processes so that the late-phase melt progression that would occur in different hypothetical severe nuclear reactor accidents can be better understood and characterized. In this report the models and correlations incorporated and used within the current version of DEBRIS are described. These include the global conservation equations solved, heat transfer and fission heating models, melting and refreezing models (including material interactions), liquid and solid relocation models, gas flow and pressure field models, and the temperature and compositionally dependent material properties employed. The specific models described here have been used in the experiment design analysis of the Phebus FPT-4 debris-bed fission-product release experiment. An earlier DEBRIS code version was used to analyze the MP-1 and MP-2 late-phase melt progression experiments conducted at Sandia National Laboratories for the US Nuclear Regulatory Commission
Non-cyclic phases for neutrino oscillations in quantum field theory
International Nuclear Information System (INIS)
Blasone, Massimo; Capolupo, Antonio; Celeghini, Enrico; Vitiello, Giuseppe
2009-01-01
We show the presence of non-cyclic phases for oscillating neutrinos in the context of quantum field theory. Such phases carry information about the non-perturbative vacuum structure associated with the field mixing. By subtracting the condensate contribution of the flavor vacuum, the previously studied quantum mechanics geometric phase is recovered.
The U(1) Higgs model in an external electromagnetic field
International Nuclear Information System (INIS)
Damgaard, P.H.; Heller, U.M.
1988-01-01
An external electromagnetic field is coupled to the lattice-regularized U(1) Higgs model. We study the phase diagram of this model by both analytical and numerical techniques for different values of the external field strength tensor. The results are compared with expectations based on the analogy with superconducting systems, as described by the phenomenological Ginzburg-Landau theory. (orig.)
Phase Diagram of a Simple Model for Fractional Topological Insulator
Chen, Hua; Yang, Kun
2012-02-01
We study a simple model of two species of (or spin-1/2) fermions with short-range intra-species repulsion in the presence of opposite (effetive) magnetic field, each at filling factor 1/3. In the absence of inter-species interaction, the ground state is simply two copies of the 1/3 Laughlin state, with opposite chirality. Due to the overall time-reversal symmetry, this is a fractional topological insulator. We show this phase is stable against moderate inter-species interactions. However strong enough inter-species repulsion leads to phase separation, while strong enough inter-species attraction drives the system into a superfluid phase. We obtain the phase diagram through exact diagonalization caluclations. Nature of the fractional topological insluator-superfluid phase transition is discussed using an appropriate Chern-Simons-Ginsburg-Landau effective field theory.
Three-dimensional numerical modeling of turbulent single-phase and two-phase flow in curved pipes
International Nuclear Information System (INIS)
Xin, R.C.; Dong, Z.F.; Ebadian, M.A.
1996-01-01
In this study, three-dimensional single-phase and two-phase flows in curved pipes have been investigated numerically. Two different pipe configurations were computed. When the results of the single-phase flow simulation were compared with the experimental data, a fairly good agreement was achieved. A flow-developing process has been suggested in single-phase flow, in which the turbulence is stronger near the outer tube wall than near the inner tube wall. For two-phase flow, the Eulerian multiphase model was used to simulate the phase distribution of a three-dimensional gas-liquid bubble flow in curved pipe. The RNG/κ-ε turbulence model was used to determine the turbulence field. An inlet gas void fraction of 5 percent was simulated. The gas phase effects on the liquid phase flow velocity have been examined by comparing the results of single-phase flow and two-phase flow. The findings show that for the downward flow in the U bend, the gas concentrates at the inner portion of the cross section at φ = π/18 - π/6 in most cases. The results of the phase distribution simulation are compared to experimental observations qualitatively and topologically
Degenerate four-wave mixing with the phase diffusion field
International Nuclear Information System (INIS)
Anderson, M.H.; Chen, CE.; Elliott, D.S.; Cooper, J.; Smith, S.J.
1993-01-01
We report measurements of the effect of laser fluctuations on a strong-field degenerate four-wave mixing interaction, carried out in a nearly Doppler-free, two-level system using a single laser with statistically well-defined phase fluctuations. The counterpropagating pump beams and the probe beam, each split from this phase-noise-modulated source, were fully correlated. The nonlinear medium was an optically-pumped diffuse beam of atomic sodium. By time-delaying the probe with respect to the pump beams, the composite field becomes non-Markovian. Four-wave mixing results in the generation of a phase-conjugate beam anti-parallel to the probe beam. With the laser field spectrum nearly Lorentzian in shape, and with a field linewidth greater (and, for comparison, much narrower) than the natural linewidth of the sodium, we measured the intensity of the phase-conjugate beam as the pump and probe beams were tuned through the D2 resonance, as a function of intensity of die pump beam (up to intensities several times the saturation intensity), and for varying delay between the pump and probe fields. This experiment provides a cleaner measurement of this interaction than any previously available
The dilute random field Ising model by finite cluster approximation
International Nuclear Information System (INIS)
Benyoussef, A.; Saber, M.
1987-09-01
Using the finite cluster approximation, phase diagrams of bond and site diluted three-dimensional simple cubic Ising models with a random field have been determined. The resulting phase diagrams have the same general features for both bond and site dilution. (author). 7 refs, 4 figs
A Variational Model for Two-Phase Immiscible Electroosmotic Flow at Solid Surfaces
Shao, Sihong
2012-01-01
We develop a continuum hydrodynamic model for two-phase immiscible flows that involve electroosmotic effect in an electrolyte and moving contact line at solid surfaces. The model is derived through a variational approach based on the Onsager principle of minimum energy dissipation. This approach was first presented in the derivation of a continuum hydrodynamic model for moving contact line in neutral two-phase immiscible flows (Qian, Wang, and Sheng, J. Fluid Mech. 564, 333-360 (2006)). Physically, the electroosmotic effect can be formulated by the Onsager principle as well in the linear response regime. Therefore, the same variational approach is applied here to the derivation of the continuum hydrodynamic model for charged two-phase immiscible flows where one fluid component is an electrolyte exhibiting electroosmotic effect on a charged surface. A phase field is employed to model the diffuse interface between two immiscible fluid components, one being the electrolyte and the other a nonconductive fluid, both allowed to slip at solid surfaces. Our model consists of the incompressible Navier-Stokes equation for momentum transport, the Nernst-Planck equation for ion transport, the Cahn-Hilliard phase-field equation for interface motion, and the Poisson equation for electric potential, along with all the necessary boundary conditions. In particular, all the dynamic boundary conditions at solid surfaces, including the generalized Navier boundary condition for slip, are derived together with the equations of motion in the bulk region. Numerical examples in two-dimensional space, which involve overlapped electric double layer fields, have been presented to demonstrate the validity and applicability of the model, and a few salient features of the two-phase immiscible electroosmotic flows at solid surface. The wall slip in the vicinity of moving contact line and the Smoluchowski slip in the electric double layer are both investigated. © 2012 Global-Science Press.
Predictions of Phase Separation in Three-Component Lipid Membranes by the MARTINI Force Field
DEFF Research Database (Denmark)
Davis, Ryan S.; Sunil Kumar, P. B.; Sperotto, Maria Maddalena
2013-01-01
The phase behavior of the coarse-grained MARTINI model for three-component lipid bilayers composed of dipalmytoyl-phosphatidylcholine (DPPC), cholesterol (Chol), and an unsaturated phosphatidylcholine (PC) was systematically investigated by molecular dynamics simulations. The aim of this study...... is to understand which types of unsaturated PC induce the formation of thermodynamically stable coexisting phases when added to mixtures of DPPC and Chol and to unravel the mechanisms that drive phase separation in such three-component mixtures. Our simulations indicate that the currently used MARTINI force field...... PCs, such as dilinoleyl-phosphatidylcholine (DUPC) and diarachidonoyl-phosphatidylcholine (DAPC). Through systematic tweaking of the interactions between the hydrophobic groups of the PC molecules, we show that the appearance of phase separation in three-component lipid bilayers, as modeled through...
International Nuclear Information System (INIS)
Delaje, Dzh.
1984-01-01
General hypothesis used to simplify the equations, describing two-phase flows, are considered. Two-component and one-component models of two-phase flow, as well as Zuber and Findlay model for actual volumetric steam content, and Wallis model, describing the given phase rates, are presented. The conclusion is made, that the two-component model, in which values averaged in time are included, is applicable for the solving of three-dimensional tasks for unsteady two-phase flow. At the same time, using the two-component model, including values, averaged in space only one-dimensional tasks for unsteady two-phase flow can be solved
Stochastic modelling of two-phase flows including phase change
International Nuclear Information System (INIS)
Hurisse, O.; Minier, J.P.
2011-01-01
Stochastic modelling has already been developed and applied for single-phase flows and incompressible two-phase flows. In this article, we propose an extension of this modelling approach to two-phase flows including phase change (e.g. for steam-water flows). Two aspects are emphasised: a stochastic model accounting for phase transition and a modelling constraint which arises from volume conservation. To illustrate the whole approach, some remarks are eventually proposed for two-fluid models. (authors)
Ordering phase transition in the one-dimensional Axelrod model
Vilone, D.; Vespignani, A.; Castellano, C.
2002-12-01
We study the one-dimensional behavior of a cellular automaton aimed at the description of the formation and evolution of cultural domains. The model exhibits a non-equilibrium transition between a phase with all the system sharing the same culture and a disordered phase of coexisting regions with different cultural features. Depending on the initial distribution of the disorder the transition occurs at different values of the model parameters. This phenomenology is qualitatively captured by a mean-field approach, which maps the dynamics into a multi-species reaction-diffusion problem.
Analytic properties of the Ruelle ζ-function for mean field models of phase transition
International Nuclear Information System (INIS)
Hallerberg, Sarah; Just, Wolfram; Radons, Guenter
2005-01-01
We evaluate by analytical means the Ruelle ζ-function for a spin model with global coupling. The implications of the ferromagnetic phase transitions for the analytical properties of the ζ-function are discussed in detail. In the paramagnetic phase the ζ-function develops a single branch point. In the low-temperature regime two branch points appear which correspond to the ferromagnetic state and the metastable state. The results are typical for any Ginsburg-Landau-type phase transition
Magnetization plateaus and phase diagrams of the Ising model on the Shastry–Sutherland lattice
Energy Technology Data Exchange (ETDEWEB)
Deviren, Seyma Akkaya, E-mail: sadeviren@nevsehir.edu.tr
2015-11-01
The magnetization properties of a two-dimensional spin-1/2 Ising model on the Shastry–Sutherland lattice are studied within the effective-field theory (EFT) with correlations. The thermal behavior of the magnetizations is investigated in order to characterize the nature (the first- or second-order) of the phase transitions as well as to obtain the phase diagrams of the model. The internal energy, specific heat, entropy and free energy of the system are also examined numerically as a function of the temperature in order to confirm the stability of the phase transitions. The applied field dependence of the magnetizations is also examined to find the existence of the magnetization plateaus. For strong enough magnetic fields, several magnetization plateaus are observed, e.g., at 1/9, 1/8, 1/3 and 1/2 of the saturation. The phase diagrams of the model are constructed in two different planes, namely (h/|J|, |J′|/|J|) and (h/|J|, T/|J|) planes. It was found that the model exhibits first- and second-order phase transitions; hence tricitical point is also observed in additional to the zero-temperature critical point. Moreover the Néel order (N), collinear order (C) and ferromagnetic (F) phases are also found with appropriate values of the system parameters. The reentrant behavior is also obtained whenever model displays two Néel temperatures. These results are compared with some theoretical and experimental works and a good overall agreement has been obtained. - Highlights: • Magnetization properties of spin-1/2 Ising model on SS lattice are investigated. • The magnetization plateaus of the 1/9, 1/8, 1/3 and 1/2 are observed. • The phase diagrams of the model are constructed in two different planes. • The model exhibits the tricitical and zero-temperature critical points. • The reentrant behavior is obtained whenever model displays two Neel temperatures.
Temperature-field phase diagram of extreme magnetoresistance.
Fallah Tafti, Fazel; Gibson, Quinn; Kushwaha, Satya; Krizan, Jason W; Haldolaarachchige, Neel; Cava, Robert Joseph
2016-06-21
The recent discovery of extreme magnetoresistance (XMR) in LaSb introduced lanthanum monopnictides as a new platform to study this effect in the absence of broken inversion symmetry or protected linear band crossing. In this work, we report XMR in LaBi. Through a comparative study of magnetotransport effects in LaBi and LaSb, we construct a temperature-field phase diagram with triangular shape that illustrates how a magnetic field tunes the electronic behavior in these materials. We show that the triangular phase diagram can be generalized to other topological semimetals with different crystal structures and different chemical compositions. By comparing our experimental results to band structure calculations, we suggest that XMR in LaBi and LaSb originates from a combination of compensated electron-hole pockets and a particular orbital texture on the electron pocket. Such orbital texture is likely to be a generic feature of various topological semimetals, giving rise to their small residual resistivity at zero field and subject to strong scattering induced by a magnetic field.
Modelling of stresses generated in steels by phase transformations
International Nuclear Information System (INIS)
Dudek, K.; Glowacki, M.; Pietrzyk, M.
1999-01-01
Numerical model describing stresses arising during phase transformations in steels products is presented. The full model consists of three components. The first component uses finite element solution of Fourier equation for an evaluation of the temperature field inside the sample. The second component predicts kinetics of phase transformation occurring during cooling of steel products. Coupling of these two components allows prediction of structure and properties of final products at room temperature. The third component uses elastic-plastic finite element model for prediction of stresses caused by non-uniform temperatures and by changes of volume during transformations. Typical results of simulations performed for cooling of rails after hot rolling are presented. (author)
Phase-field crystal simulation facet and branch crystal growth
Chen, Zhi; Wang, Zhaoyang; Gu, Xinrui; Chen, Yufei; Hao, Limei; de Wit, Jos; Jin, Kexin
2018-05-01
Phase-field crystal model with one mode is introduced to describe morphological transition. The relationship between growth morphology and smooth density distribution was investigated. The results indicate that the pattern selection of dendrite growth is caused by the competition between interface energy anisotropy and interface kinetic anisotropy based on the 2D phase diagram. When the calculation time increases, the crystal grows to secondary dendrite at the dimensionless undercooling equal to - 0.4. Moreover, when noise is introduced in the growth progress, the symmetry is broken in the growth mode, and there becomes irregular fractal-like growth morphology. Furthermore, the single crystal shape develops into polycrystalline when the noise amplitude is large enough. When the dimensionless undercooling is less than - 0.3, the noise has a significant effect on the growth shape. In addition, the growth velocity of crystal near to liquid phase line is slow, while the shape far away from the liquid adapts to fast growth. Based on the simulation results, the method was proved to be effective, and it can easily obtain different crystal shapes by choosing the different points in 2D phase diagram.
Synthesis Of Ultrasound Field Sources Based on Phase Screen Approximation
Directory of Open Access Journals (Sweden)
Sukhanov Dmitry
2018-01-01
Full Text Available Here is proposed the method for synthesizing the sources of an acoustic field on the basis of an approximation of the phase screen. The technology of manufacturing ultrasonic phased arrays providing the formation of a field of a given distribution is proposed. An experimental setup has been developed for the formation of a vortex field at a distance of 10 cm.
Two-phase flow field simulation of horizontal steam generators
Energy Technology Data Exchange (ETDEWEB)
Rabiee, Ataollah; Kamalinia, Amir Hossein; Hadad, Kamal [School of Mechanical Engineering, Shiraz University, Shiraz (Iran, Islamic Republic of)
2017-02-15
The analysis of steam generators as an interface between primary and secondary circuits in light water nuclear power plants is crucial in terms of safety and design issues. VVER-1000 nuclear power plants use horizontal steam generators which demand a detailed thermal hydraulics investigation in order to predict their behavior during normal and transient operational conditions. Two phase flow field simulation on adjacent tube bundles is important in obtaining logical numerical results. However, the complexity of the tube bundles, due to geometry and arrangement, makes it complicated. Employment of porous media is suggested to simplify numerical modeling. This study presents the use of porous media to simulate the tube bundles within a general-purpose computational fluid dynamics code. Solved governing equations are generalized phase continuity, momentum, and energy equations. Boundary conditions, as one of the main challenges in this numerical analysis, are optimized. The model has been verified and tuned by simple two-dimensional geometry. It is shown that the obtained vapor volume fraction near the cold and hot collectors predict the experimental results more accurately than in previous studies.
Angle-adjustable density field formulation for the modeling of crystalline microstructure
Wang, Zi-Le; Liu, Zhirong; Huang, Zhi-Feng
2018-05-01
A continuum density field formulation with particle-scale resolution is constructed to simultaneously incorporate the orientation dependence of interparticle interactions and the rotational invariance of the system, a fundamental but challenging issue in modeling the structure and dynamics of a broad range of material systems across variable scales. This generalized phase field crystal-type approach is based upon the complete expansion of particle direct correlation functions and the concept of isotropic tensors. Through applications to the modeling of various two- and three-dimensional crystalline structures, our study demonstrates the capability of bond-angle control in this continuum field theory and its effects on the emergence of ordered phases, and provides a systematic way of performing tunable angle analyses for crystalline microstructures.
Grassmann phase space methods for fermions. II. Field theory
Energy Technology Data Exchange (ETDEWEB)
Dalton, B.J., E-mail: bdalton@swin.edu.au [Centre for Quantum and Optical Science, Swinburne University of Technology, Melbourne, Victoria 3122 (Australia); Jeffers, J. [Department of Physics, University of Strathclyde, Glasgow G4ONG (United Kingdom); Barnett, S.M. [School of Physics and Astronomy, University of Glasgow, Glasgow G12 8QQ (United Kingdom)
2017-02-15
In both quantum optics and cold atom physics, the behaviour of bosonic photons and atoms is often treated using phase space methods, where mode annihilation and creation operators are represented by c-number phase space variables, with the density operator equivalent to a distribution function of these variables. The anti-commutation rules for fermion annihilation, creation operators suggests the possibility of using anti-commuting Grassmann variables to represent these operators. However, in spite of the seminal work by Cahill and Glauber and a few applications, the use of Grassmann phase space methods in quantum-atom optics to treat fermionic systems is rather rare, though fermion coherent states using Grassmann variables are widely used in particle physics. This paper presents a phase space theory for fermion systems based on distribution functionals, which replace the density operator and involve Grassmann fields representing anti-commuting fermion field annihilation, creation operators. It is an extension of a previous phase space theory paper for fermions (Paper I) based on separate modes, in which the density operator is replaced by a distribution function depending on Grassmann phase space variables which represent the mode annihilation and creation operators. This further development of the theory is important for the situation when large numbers of fermions are involved, resulting in too many modes to treat separately. Here Grassmann fields, distribution functionals, functional Fokker–Planck equations and Ito stochastic field equations are involved. Typical applications to a trapped Fermi gas of interacting spin 1/2 fermionic atoms and to multi-component Fermi gases with non-zero range interactions are presented, showing that the Ito stochastic field equations are local in these cases. For the spin 1/2 case we also show how simple solutions can be obtained both for the untrapped case and for an optical lattice trapping potential.
Grassmann phase space methods for fermions. II. Field theory
International Nuclear Information System (INIS)
Dalton, B.J.; Jeffers, J.; Barnett, S.M.
2017-01-01
In both quantum optics and cold atom physics, the behaviour of bosonic photons and atoms is often treated using phase space methods, where mode annihilation and creation operators are represented by c-number phase space variables, with the density operator equivalent to a distribution function of these variables. The anti-commutation rules for fermion annihilation, creation operators suggests the possibility of using anti-commuting Grassmann variables to represent these operators. However, in spite of the seminal work by Cahill and Glauber and a few applications, the use of Grassmann phase space methods in quantum-atom optics to treat fermionic systems is rather rare, though fermion coherent states using Grassmann variables are widely used in particle physics. This paper presents a phase space theory for fermion systems based on distribution functionals, which replace the density operator and involve Grassmann fields representing anti-commuting fermion field annihilation, creation operators. It is an extension of a previous phase space theory paper for fermions (Paper I) based on separate modes, in which the density operator is replaced by a distribution function depending on Grassmann phase space variables which represent the mode annihilation and creation operators. This further development of the theory is important for the situation when large numbers of fermions are involved, resulting in too many modes to treat separately. Here Grassmann fields, distribution functionals, functional Fokker–Planck equations and Ito stochastic field equations are involved. Typical applications to a trapped Fermi gas of interacting spin 1/2 fermionic atoms and to multi-component Fermi gases with non-zero range interactions are presented, showing that the Ito stochastic field equations are local in these cases. For the spin 1/2 case we also show how simple solutions can be obtained both for the untrapped case and for an optical lattice trapping potential.
Antiferromagnetic Ising model with transverse and longitudinal field
International Nuclear Information System (INIS)
Kischinhevsky, M.
1985-01-01
We study the quantum hamiltonian version of the Ising Model in one spacial dimension under an external longitudinal (uniform) field at zero temperature. A phenomenological renormalization group procedure is used to obtain the phase diagram; the transverse and longitudinal zero field limits are studied and we verify the validity of universality at non zero transverse fields, where two-dimensional critical behaviour is obtained. To perform the numerical calculations we use the Lanczos scheme, which gives highly precise results with rather short processing times. We also analyse the possibility of using these techniques to extend the present work to the quantum hamiltonian version of the q-state Potts Model (q>2) in larger system. (author) [pt
Global mean-field phase diagram of the spin-1 Ising ferromagnet in a random crystal field
Borelli, M. E. S.; Carneiro, C. E. I.
1996-02-01
We study the phase diagram of the mean-field spin-1 Ising ferromagnet in a uniform magnetic field H and a random crystal field Δi, with probability distribution P( Δi) = pδ( Δi - Δ) + (1 - p) δ( Δi). We analyse the effects of randomness on the first-order surfaces of the Δ- T- H phase diagram for different values of the concentration p and show how these surfaces are affected by the dilution of the crystal field.
Competing phases in a model of Pr-based cobaltites
Sotnikov, A.; Kuneš, J.
2017-12-01
Motivated by the physics of Pr-based cobaltites, we study the effect of the external magnetic field in the hole-doped two-band Hubbard model close to instabilities toward the excitonic condensation and ferromagnetic ordering. Using the dynamical mean-field theory we observe a field-driven suppression of the excitonic condensate. The onset of a magnetically ordered phase at the fixed chemical potential is accompanied by a sizable change of the electron density. This leads us to predict that Pr3 + abundance increases on the high-field side of the transition.
International Nuclear Information System (INIS)
Aldana, Maximino; Larralde, Hernan
2004-01-01
We investigate the nature of the phase transition from an ordered to a disordered state that occurs in a family of neural network models with noise. These models are closely related to the majority voter model, where a ferromagneticlike interaction between the elements prevails. Each member of the family is distinguished by the network topology, which is determined by the probability distribution of the number of incoming links. We show that for homogeneous random topologies, the phase transition belongs to the standard mean-field universality class, characterized by the order parameter exponent β=1/2. However, for scale-free networks we obtain phase transition exponents ranging from 1/2 to infinity. Furthermore, we show the existence of a phase transition even for values of the scale-free exponent in the interval (1.5,2], where the average network connectivity diverges
Pore-scale modeling of phase change in porous media
Juanes, Ruben; Cueto-Felgueroso, Luis; Fu, Xiaojing
2017-11-01
One of the main open challenges in pore-scale modeling is the direct simulation of flows involving multicomponent mixtures with complex phase behavior. Reservoir fluid mixtures are often described through cubic equations of state, which makes diffuse interface, or phase field theories, particularly appealing as a modeling framework. What is still unclear is whether equation-of-state-driven diffuse-interface models can adequately describe processes where surface tension and wetting phenomena play an important role. Here we present a diffuse interface model of single-component, two-phase flow (a van der Waals fluid) in a porous medium under different wetting conditions. We propose a simplified Darcy-Korteweg model that is appropriate to describe flow in a Hele-Shaw cell or a micromodel, with a gap-averaged velocity. We study the ability of the diffuse-interface model to capture capillary pressure and the dynamics of vaporization/condensation fronts, and show that the model reproduces pressure fluctuations that emerge from abrupt interface displacements (Haines jumps) and from the break-up of wetting films.
Peco, C.; Rosolen, A.; Arroyo, M.
2013-01-01
We present a Lagrangian phase-field method to study the low Reynolds number dynamics of vesicles embedded in a viscous fluid. In contrast to previous approaches, where the field variables are the phase-field and the fluid velocity, here we exploit the fact that the phasefield tracks a material interface to reformulate the problem in terms of the Lagrangian motion of a background medium, containing both the biomembrane and the fluid. We discretize the equations in space with maximum-entr...
Yaqoob, Zahid; Choi, Wonshik; Oh, Seungeun; Lue, Niyom; Park, Yongkeun; Fang-Yen, Christopher; Dasari, Ramachandra R.; Badizadegan, Kamran; Feld, Michael S.
2010-01-01
We report a quantitative phase microscope based on spectral domain optical coherence tomography and line-field illumination. The line illumination allows self phase-referencing method to reject common-mode phase noise. The quantitative phase microscope also features a separate reference arm, permitting the use of high numerical aperture (NA > 1) microscope objectives for high resolution phase measurement at multiple points along the line of illumination. We demonstrate that the path-length sensitivity of the instrument can be as good as 41 pm/Hz, which makes it suitable for nanometer scale study of cell motility. We present the detection of natural motions of cell surface and two-dimensional surface profiling of a HeLa cell. PMID:19550464
Broken Weyl symmetry. [Gauge model, coupling, Higgs field
Energy Technology Data Exchange (ETDEWEB)
Domokos, G.
1976-05-01
It is argued that conformal symmetry can be properly understood in the framework of field theories in curved space. In such theories, invariance is required under general coordinate transformations and conformal rescalings. A gauge model coupled to a Higgs field is examined. In the tree approximation, the vacuum solution exhibits two Higgs phenomena; both the phase (Goldstone boson) and the coordinate dependent part of the radial component of the scalar field can be removed by a Higgs-Kibble transformation. The resulting vacuum solution corresponds to a space of constant curvature and constant vacuum expectation value of the scalar field.
Effect of applied strain on phase separation of Fe-28 at.% Cr alloy: 3D phase-field simulation
Zhu, Lihui; Li, Yongsheng; Liu, Chengwei; Chen, Shi; Shi, Shujing; Jin, Shengshun
2018-04-01
A quantitative simulation of the separation of the α‧ phase in Fe-28 at.% Cr alloy under the effects of applied strain is performed by utilizing a three-dimensional phase-field model. The elongation of the Cr-enriched α‧ phase becomes obvious with the influence of applied uniaxial strain for the phase separation transforms from spinodal decomposition of 700 K to nucleation and growth of 773 K. The applied strain shows a significant influence on the early stage phase separation, and the influence is enlarged with the elevated temperature. The steady-state coarsening with the mechanism of spinodal decomposition is substantially affected by the applied strain for low-temperature aging, while the influence is reduced as the temperature increases and as the phase separation mechanism changes to nucleation and growth. The peak value of particle size distribution decreases, and the PSD for 773 K becomes more widely influenced by the applied strain. The simulation results of separation of the Cr-enriched α‧ phase with the applied strain provide a further understanding of the strain effect on the phase separation of Fe-Cr alloys from the metastable region to spinodal regions.
Molecular dynamics on diffusive time scales from the phase-field-crystal equation.
Chan, Pak Yuen; Goldenfeld, Nigel; Dantzig, Jon
2009-03-01
We extend the phase-field-crystal model to accommodate exact atomic configurations and vacancies by requiring the order parameter to be non-negative. The resulting theory dictates the number of atoms and describes the motion of each of them. By solving the dynamical equation of the model, which is a partial differential equation, we are essentially performing molecular dynamics simulations on diffusive time scales. To illustrate this approach, we calculate the two-point correlation function of a fluid.
Quantum field theoretic properties of nonabelian phase factors
International Nuclear Information System (INIS)
Wieczorek, E.
1984-01-01
The paper is concerned with quantum field theoretical properies of nonabelian phase factors. The phase factors defining parallel transport in fiber bundle space are the necessary tool for the construction of gauge invariant nonlocal operators describing bound states in QCD. General structures of such operators are discussed and renormalization properties as well as relations between meson and baryon operators are obtained from a study of the underlying phase factors
Magnetic-field-induced Quantum Phase in S = 1/2 Frustrated Trellis Lattice
Yamaguchi, Hironori; Yoshizawa, Daichi; Kida, Takanori; Hagiwara, Masayuki; Matsuo, Akira; Kono, Yohei; Sakakibara, Toshiro; Tamekuni, Yusuke; Miyagai, Hirotsugu; Hosokoshi, Yuko
2018-04-01
We present a new model compound of an S = 1/2 frustrated system with ferromagnetic interaction composed of verdazyl radical β-2,3,5-Cl3-V. The ab initio molecular orbital calculation indicates the formation of an S = 1/2 trellis lattice in which zigzag chains and ladders with ferromagnetic rung interaction are two-dimensionally coupled. We observe a field-induced successive phase transition and an unconventional change in the magnetization curve near the saturation field, accompanied by T2 dependence on the magnetic specific heat. A two-dimensional spin-nematic state attributed to the ferromagnetic rung interactions is a possible candidate for the ground state in high-field regions.
Yang, Fan; Liu, Ren-Bao
2013-03-01
Quantum evolution of particles under strong fields can be approximated by the quantum trajectories that satisfy the stationary phase condition in the Dirac-Feynmann path integrals. The quantum trajectories are the key concept to understand strong-field optics phenomena, such as high-order harmonic generation (HHG), above-threshold ionization (ATI), and high-order terahertz siedeband generation (HSG). The HSG in semiconductors may have a wealth of physics due to the possible nontrivial ``vacuum'' states of band materials. We find that in a spin-orbit-coupled semiconductor, the cyclic quantum trajectories of an electron-hole pair under a strong terahertz field accumulates nontrivial Berry phases. We study the monolayer MoS2 as a model system and find that the Berry phases are given by the Faraday rotation angles of the pulse emission from the material under short-pulse excitation. This result demonstrates an interesting Berry phase dependent effect in the extremely nonlinear optics of semiconductors. This work is supported by Hong Kong RGC/GRF 401512 and the CUHK Focused Investments Scheme.
A phase field approach for multicellular aggregate fusion in biofabrication.
Yang, Xiaofeng; Sun, Yi; Wang, Qi
2013-07-01
We present a modeling and computational approach to study fusion of multicellular aggregates during tissue and organ fabrication, which forms the foundation for the scaffold-less biofabrication of tissues and organs known as bioprinting. It is known as the phase field method, where multicellular aggregates are modeled as mixtures of multiphase complex fluids whose phase mixing or separation is governed by interphase force interactions, mimicking the cell-cell interaction in the multicellular aggregates, and intermediate range interaction mediated by the surrounding hydrogel. The material transport in the mixture is dictated by hydrodynamics as well as forces due to the interphase interactions. In a multicellular aggregate system with fixed number of cells and fixed amount of the hydrogel medium, the effect of cell differentiation, proliferation, and death are neglected in the current model, which can be readily included in the model, and the interaction between different components is dictated by the interaction energy between cell and cell as well as between cell and medium particles, respectively. The modeling approach is applicable to transient simulations of fusion of cellular aggregate systems at the time and length scale appropriate to biofabrication. Numerical experiments are presented to demonstrate fusion and cell sorting during tissue and organ maturation processes in biofabrication.
Sweijen, Thomas; Hartog, Niels; Marsman, Annemieke; Keijzer, Thomas J S
2014-06-01
Mercury is a contaminant of global concern. The use of elemental mercury in various (former) industrial processes, such as chlorine production at chlor-alkali plants, is known to have resulted in soil and groundwater contaminations worldwide. However, the subsurface transport behaviour of elemental mercury as an immiscible dense non-aqueous phase liquid (DNAPL) in porous media has received minimal attention to date. Even though, such insight would aid in the remediation effort of mercury contaminated sites. Therefore, in this study a detailed field characterization of elemental mercury DNAPL distribution with depth was performed together with two-phase flow modelling, using STOMP. This is to evaluate the dynamics of mercury DNAPL migration and the controls on its distribution in saturated porous media. Using a CPT-probe mounted with a digital camera, in-situ mercury DNAPL depth distribution was obtained at a former chlor-alkali-plant, down to 9 m below ground surface. Images revealing the presence of silvery mercury DNAPL droplets were used to quantify its distribution, characteristics and saturation, using an image analysis method. These field-observations with depth were compared with results from a one-dimensional two-phase flow model simulation for the same transect. Considering the limitations of this approach, simulations reasonably reflected the variability and range of the mercury DNAPL distribution. To further explore the impact of mercury's physical properties in comparison with more common DNAPLs, the migration of mercury and PCE DNAPL in several typical hydrological scenarios was simulated. Comparison of the simulations suggest that mercury's higher density is the overall controlling factor in controlling its penetration in saturated porous media, despite its higher resistance to flow due to its higher viscosity. Based on these results the hazard of spilled mercury DNAPL to cause deep contamination of groundwater systems seems larger than for any other
International Nuclear Information System (INIS)
Mariz, A.M.; Tsallis, C.; Albuquerque, E.L. de.
1984-01-01
The phae diagram for the Ising Model on a Cayley tree with competing nearest-neighbour interactions J 1 and next-nearest-neighbour interactions J 2 and J 3 in the presence of an external magnetic field is studied. To perform this study, an iterative scheme similar to that appearing in real space renormalization group frameworks is established; it recovers, as particular cases, previous works by Vannimenus and by Inawashiro et al. At vanishing temperature, the phase diagram is fully determined, for all values and signs of J 2 /J 1 and J 3 /J 2 ; in particular, it is verified that values of J 3 /J 2 high enough favour the paramagnetic phase. At finite temperatures, several interesting features (evolution of re-entrances, separation of the modulated region in two disconnected pieces, etc.) are exhibited for typical values of J 2 /J 1 and J 3 /J 2 . (Author) [pt
Cluster Mean-Field Approach to the Steady-State Phase Diagram of Dissipative Spin Systems
Directory of Open Access Journals (Sweden)
Jiasen Jin
2016-07-01
Full Text Available We show that short-range correlations have a dramatic impact on the steady-state phase diagram of quantum driven-dissipative systems. This effect, never observed in equilibrium, follows from the fact that ordering in the steady state is of dynamical origin, and is established only at very long times, whereas in thermodynamic equilibrium it arises from the properties of the (free energy. To this end, by combining the cluster methods extensively used in equilibrium phase transitions to quantum trajectories and tensor-network techniques, we extend them to nonequilibrium phase transitions in dissipative many-body systems. We analyze in detail a model of spin-1/2 on a lattice interacting through an XYZ Hamiltonian, each of them coupled to an independent environment that induces incoherent spin flips. In the steady-state phase diagram derived from our cluster approach, the location of the phase boundaries and even its topology radically change, introducing reentrance of the paramagnetic phase as compared to the single-site mean field where correlations are neglected. Furthermore, a stability analysis of the cluster mean field indicates a susceptibility towards a possible incommensurate ordering, not present if short-range correlations are ignored.
Wu, Tao; Li, Hua
2017-08-09
In this study, a model was multiphysically developed for the simulation of the phase transition of physical hydrogels between liquid solution and solid gel states, subject to an electro-chemo-mechanically coupled field, with the effect of the mobile ionic species in the solution. The present model consists of the governing equations for the equilibrium of forces and the conservation of mass, Maxwell's equations, and an evolution equation for the interface. Based on the second law of thermodynamics, the constitutive equations are formulated from the energy viewpoint, including a novel formulation of free energy with the effect of crosslink density. The present model may be reduced to Suo's non-equilibrium thermodynamic theory if the interface is ignored when only a single phase exists. It may also be reduced to Dolbow's model for gel-gel phase transition when the electric field is ignored. Therefore, the present model becomes more generalized since it is able to represent both the bulk phase and the interface behaviors, and the mechanical field is simultaneously coupled with both the electric and chemical fields. In the first case study, the system at equilibrium state was numerically investigated for analysis of the influences of the electrical and chemical potentials as well as the mechanical pressure externally imposed on the boundary of the system domain. The second case study presents a spherically symmetrical solution-gel phase transition at non-equilibrium states, with the emphasis on the evolution of both the interface and electrochemical potentials.
Characterization of topological phases in models of interacting fermions
International Nuclear Information System (INIS)
Motruk, Johannes
2016-01-01
by next-nearest neighbor interactions has been predicted by mean field theory. However, various subsequent studies challenged this picture and it was still unclear whether the CI would survive quantum fluctuations. We therefore map out the phase diagram of the model as a function of the interactions on an infinite cylinder with DMRG and find evidence for the absence of the CI phase. However, we report the detection of two novel charge-ordered phases and corroborate the existence of the remaining phases that had been predicted in mean field theory. Furthermore, we characterize the transitions between the various phases by studying the behavior of correlation length and entanglement entropy at the phase boundaries. Finally, we develop an improvement to the DMRG algorithm for fermionic lattice models on cylinders. By using a real space representation in the direction along the cylinder and a real space representation in the perpendicular direction, we are able to use the momentum around the cylinder as conserved quantity to reduce computational costs. We benchmark the method by studying the interacting Hofstadter model and report a considerable speedup in computation time and a severely reduced memory usage.
Grassmann phase space theory and the Jaynes–Cummings model
International Nuclear Information System (INIS)
Dalton, B.J.; Garraway, B.M.; Jeffers, J.; Barnett, S.M.
2013-01-01
The Jaynes–Cummings model of a two-level atom in a single mode cavity is of fundamental importance both in quantum optics and in quantum physics generally, involving the interaction of two simple quantum systems—one fermionic system (the TLA), the other bosonic (the cavity mode). Depending on the initial conditions a variety of interesting effects occur, ranging from ongoing oscillations of the atomic population difference at the Rabi frequency when the atom is excited and the cavity is in an n-photon Fock state, to collapses and revivals of these oscillations starting with the atom unexcited and the cavity mode in a coherent state. The observation of revivals for Rydberg atoms in a high-Q microwave cavity is key experimental evidence for quantisation of the EM field. Theoretical treatments of the Jaynes–Cummings model based on expanding the state vector in terms of products of atomic and n-photon states and deriving coupled equations for the amplitudes are a well-known and simple method for determining the effects. In quantum optics however, the behaviour of the bosonic quantum EM field is often treated using phase space methods, where the bosonic mode annihilation and creation operators are represented by c-number phase space variables, with the density operator represented by a distribution function of these variables. Fokker–Planck equations for the distribution function are obtained, and either used directly to determine quantities of experimental interest or used to develop c-number Langevin equations for stochastic versions of the phase space variables from which experimental quantities are obtained as stochastic averages. Phase space methods have also been developed to include atomic systems, with the atomic spin operators being represented by c-number phase space variables, and distribution functions involving these variables and those for any bosonic modes being shown to satisfy Fokker–Planck equations from which c-number Langevin equations are
Laser Light-field Fusion for Wide-field Lensfree On-chip Phase Contrast Microscopy of Nanoparticles
Kazemzadeh, Farnoud; Wong, Alexander
2016-12-01
Wide-field lensfree on-chip microscopy, which leverages holography principles to capture interferometric light-field encodings without lenses, is an emerging imaging modality with widespread interest given the large field-of-view compared to lens-based techniques. In this study, we introduce the idea of laser light-field fusion for lensfree on-chip phase contrast microscopy for detecting nanoparticles, where interferometric laser light-field encodings acquired using a lensfree, on-chip setup with laser pulsations at different wavelengths are fused to produce marker-free phase contrast images of particles at the nanometer scale. As a proof of concept, we demonstrate, for the first time, a wide-field lensfree on-chip instrument successfully detecting 300 nm particles across a large field-of-view of ~30 mm2 without any specialized or intricate sample preparation, or the use of synthetic aperture- or shift-based techniques.
Energy Technology Data Exchange (ETDEWEB)
Hu, Shenyang, E-mail: shenyang.hu@pnnl.gov; Burkes, Douglas E.; Lavender, Curt A.; Senor, David J.; Setyawan, Wahyu; Xu, Zhijie
2016-10-15
Nano-gas bubble superlattices are often observed in irradiated UMo nuclear fuels. However, the formation mechanism of gas bubble superlattices is not well understood. A number of physical processes may affect the gas bubble nucleation and growth; hence, the morphology of gas bubble microstructures including size and spatial distributions. In this work, a phase-field model integrating a first-passage Monte Carlo method to investigate the formation mechanism of gas bubble superlattices was developed. Six physical processes are taken into account in the model: 1) heterogeneous generation of gas atoms, vacancies, and interstitials informed from atomistic simulations; 2) one-dimensional (1-D) migration of interstitials; 3) irradiation-induced dissolution of gas atoms; 4) recombination between vacancies and interstitials; 5) elastic interaction; and 6) heterogeneous nucleation of gas bubbles. We found that the elastic interaction doesn’t cause the gas bubble alignment, and fast 1-D migration of interstitials along 〈110〉 directions in the body-centered cubic U matrix causes the gas bubble alignment along 〈110〉 directions. It implies that 1-D interstitial migration along [110] direction should be the primary mechanism of a fcc gas bubble superlattice which is observed in bcc UMo alloys. Simulations also show that fission rates, saturated gas concentration, and elastic interaction all affect the morphology of gas bubble microstructures.
High-velocity two-phase flow two-dimensional modeling
International Nuclear Information System (INIS)
Mathes, R.; Alemany, A.; Thilbault, J.P.
1995-01-01
The two-phase flow in the nozzle of a LMMHD (liquid metal magnetohydrodynamic) converter has been studied numerically and experimentally. A two-dimensional model for two-phase flow has been developed including the viscous terms (dragging and turbulence) and the interfacial mass, momentum and energy transfer between the phases. The numerical results were obtained by a finite volume method based on the SIMPLE algorithm. They have been verified by an experimental facility using air-water as a simulation pair and a phase Doppler particle analyzer for velocity and droplet size measurement. The numerical simulation of a lithium-cesium high-temperature pair showed that a nearly homogeneous and isothermal expansion of the two phases is possible with small pressure losses and high kinetic efficiencies. In the throat region a careful profiling is necessary to reduce the inertial effects on the liquid velocity field
Ising model with competing axial interactions in the presence of a field
International Nuclear Information System (INIS)
Yokoi, C.S.O.; Salinas, S.R.A.; Coutinho Filho, M.D.
1980-09-01
A layered Ising model is studied with competing interactions between nearest and next-nearest layers in the presence of a magnetic field. The analysis is carried out in the mean-field approximation with one effective field for each layer. The high-temperature region is studied analytically. The low-temperature region is studied numerically. T-H phase diagrams are constructed, which exhibit a variety of modulated phases, for various values of the ratio of the strength of the competing interactions. Numerical evidence of the devil's staircase behavior is found either as a function of temperature or applied magnetic field. (Author) [pt
Basak, Anup; Levitas, Valery I.
2018-04-01
A thermodynamically consistent, novel multiphase phase field approach for stress- and temperature-induced martensitic phase transformations at finite strains and with interfacial stresses has been developed. The model considers a single order parameter to describe the austenite↔martensitic transformations, and another N order parameters describing N variants and constrained to a plane in an N-dimensional order parameter space. In the free energy model coexistence of three or more phases at a single material point (multiphase junction), and deviation of each variant-variant transformation path from a straight line have been penalized. Some shortcomings of the existing models are resolved. Three different kinematic models (KMs) for the transformation deformation gradient tensors are assumed: (i) In KM-I the transformation deformation gradient tensor is a linear function of the Bain tensors for the variants. (ii) In KM-II the natural logarithms of the transformation deformation gradient is taken as a linear combination of the natural logarithm of the Bain tensors multiplied with the interpolation functions. (iii) In KM-III it is derived using the twinning equation from the crystallographic theory. The instability criteria for all the phase transformations have been derived for all the kinematic models, and their comparative study is presented. A large strain finite element procedure has been developed and used for studying the evolution of some complex microstructures in nanoscale samples under various loading conditions. Also, the stresses within variant-variant boundaries, the sample size effect, effect of penalizing the triple junctions, and twinned microstructures have been studied. The present approach can be extended for studying grain growth, solidifications, para↔ferro electric transformations, and diffusive phase transformations.
Energy Technology Data Exchange (ETDEWEB)
Deviren, Bayram [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey); Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.t [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2010-07-12
Dynamic aspects of a two-sublattice Ising metamagnet on honeycomb, square and hexagonal lattices under the presence of a time-dependent oscillating external magnetic field are studied by using the effective-field theory with correlations. The set of effective-field dynamic equations is derived by employing Glauber transition rates. The phases in the system are obtained by solving these dynamic equations. The thermal behavior of the dynamic staggered magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. The phase diagrams are constructed in two different planes, and exhibit dynamic tricritical behavior, which strongly depends on interaction parameters. In order to investigate the spin correlation effect on the dynamic phase diagrams of the system, the results are also given within the framework of the dynamic mean-field approximation.
International Nuclear Information System (INIS)
Deviren, Bayram; Keskin, Mustafa
2010-01-01
Dynamic aspects of a two-sublattice Ising metamagnet on honeycomb, square and hexagonal lattices under the presence of a time-dependent oscillating external magnetic field are studied by using the effective-field theory with correlations. The set of effective-field dynamic equations is derived by employing Glauber transition rates. The phases in the system are obtained by solving these dynamic equations. The thermal behavior of the dynamic staggered magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. The phase diagrams are constructed in two different planes, and exhibit dynamic tricritical behavior, which strongly depends on interaction parameters. In order to investigate the spin correlation effect on the dynamic phase diagrams of the system, the results are also given within the framework of the dynamic mean-field approximation.
The difficult challenge of a two-phase CFD modelling for all flow regimes
International Nuclear Information System (INIS)
Bestion, D.
2014-01-01
Highlights: • The theoretical difficulties for modelling all flow regimes at CFD scale are identified. • The choice of the number of fields and of the time and space averaging or filtering are discussed and clarified. • Closure issues related to an all flow regime CFD model are listed and the main difficulties are identified. - Abstract: System thermalhydraulic codes model all two-phase flow regimes but they are limited to a macroscopic description. Two-phase CFD tools predict two-phase flow with a much finer space resolution but the current modelling capabilities are limited to dispersed bubbly or droplet flow and separate-phase flow. Much less experience exists on more complex flow regimes which combine the existence of dispersed fields with the presence of large interfaces such as a free surface or a film surface. A list of possible reactor issues which might benefit from an “all flow regime CFD model” is given. The first difficulty is to identify the various types of local flow configuration. It is shown that a 4-field model has much better capabilities than a two-fluid approach to identify most complex regimes. Then the choice between time averaging, space averaging, or even ensemble averaging is discussed. It is shown that only the RANS-2-fluid and a space-filtered 4-field model may be reasonably envisaged. The latter has the capabilities to identify all types of interfaces and should be privileged if a good accuracy is expected or if time fluctuations in intermittent flow have to be predicted while the former may be used when a high accuracy is not necessary and if time fluctuations in intermittent flow are not of interest. Finally the closure issue is presented including wall transfers, interfacial transfers, mass transfers between dispersed and continuous fields, and turbulent transfers. An important effort is required to model all interactions between sub-filter phenomena and the transfers from the sub-filter domain to the simulated domain. The
Phase diagram of the disordered Bose-Hubbard model
International Nuclear Information System (INIS)
Gurarie, V.; Pollet, L.; Prokof'ev, N. V.; Svistunov, B. V.; Troyer, M.
2009-01-01
We establish the phase diagram of the disordered three-dimensional Bose-Hubbard model at unity filling which has been controversial for many years. The theorem of inclusions, proven by Pollet et al. [Phys. Rev. Lett. 103, 140402 (2009)] states that the Bose-glass phase always intervenes between the Mott insulating and superfluid phases. Here, we note that assumptions on which the theorem is based exclude phase transitions between gapped (Mott insulator) and gapless phases (Bose glass). The apparent paradox is resolved through a unique mechanism: such transitions have to be of the Griffiths type when the vanishing of the gap at the critical point is due to a zero concentration of rare regions where extreme fluctuations of disorder mimic a regular gapless system. An exactly solvable random transverse field Ising model in one dimension is used to illustrate the point. A highly nontrivial overall shape of the phase diagram is revealed with the worm algorithm. The phase diagram features a long superfluid finger at strong disorder and on-site interaction. Moreover, bosonic superfluidity is extremely robust against disorder in a broad range of interaction parameters; it persists in random potentials nearly 50 (!) times larger than the particle half-bandwidth. Finally, we comment on the feasibility of obtaining this phase diagram in cold-atom experiments, which work with trapped systems at finite temperature.
Efficient 3D Volume Reconstruction from a Point Cloud Using a Phase-Field Method
Directory of Open Access Journals (Sweden)
Darae Jeong
2018-01-01
Full Text Available We propose an explicit hybrid numerical method for the efficient 3D volume reconstruction from unorganized point clouds using a phase-field method. The proposed three-dimensional volume reconstruction algorithm is based on the 3D binary image segmentation method. First, we define a narrow band domain embedding the unorganized point cloud and an edge indicating function. Second, we define a good initial phase-field function which speeds up the computation significantly. Third, we use a recently developed explicit hybrid numerical method for solving the three-dimensional image segmentation model to obtain efficient volume reconstruction from point cloud data. In order to demonstrate the practical applicability of the proposed method, we perform various numerical experiments.
Energy Technology Data Exchange (ETDEWEB)
Zhao, L.; Law, D.H.S. [Alberta Research Council, Edmonton, AB (Canada); Freitag, N.; Huang, S. [Saskatchewan Research Council, Regina, SK (Canada)
2005-07-01
The mechanisms of enhanced oil recovery (EOR) and carbon dioxide (CO{sub 2}) storage in an oil depleted reservoir are being studied at the International Energy Agency's (IEA) Weyburn CO2 Monitoring and Storage Project in Saskatchewan. One of the objectives of this multi-disciplinary project has been to develop a Pressure-Volume-Temperature (PVT) model for the CO{sub 2}-Weyburn oil system that can be coupled with compositional reservoir models for short- and long-term field-scale reservoir simulations. In order to assess the long term risk of carbon dioxide (CO{sub 2}) injection for the purpose of EOR, it is important to accurately predict the CO{sub 2} distribution in different phases in the reservoir (aqueous, oleic and gaseous). The newly developed seven-component PVT model for Weyburn oil was based on measurements of phase-behavior properties such as oil density, viscosity, gas-oil ratio, saturation pressure and minimum miscibility pressure from oil samples collected from wells in different parts of the reservoir. The Peng-Robinson equation of state was used for the PVT model development and CO{sub 2} solubility in water was described by Henry's Law. Estimations of mineral trapping, ionic trapping and solubility trapping of CO{sub 2} are based on the amount of CO{sub 2} stored in the aqueous phase, but the amount of CO{sub 2} stored in the gaseous phase, which is the most mobile phase of CO{sub 2} in the reservoir, is essential in the estimation of CO{sub 2} leakage. The model was continuously modified as the field process proceeded in order to identify the dynamic change in fluid properties and the effect of contaminants in the injecting CO{sub 2}. The model, coupled with a compositional reservoir model, was used to predict the CO{sub 2} distribution and storage performance in the Weyburn field. 2 refs., 4 tabs., 8 figs.
Energy Technology Data Exchange (ETDEWEB)
Tupek, Michael R. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
2016-06-30
In recent years there has been a proliferation of modeling techniques for forward predictions of crack propagation in brittle materials, including: phase-field/gradient damage models, peridynamics, cohesive-zone models, and G/XFEM enrichment techniques. However, progress on the corresponding inverse problems has been relatively lacking. Taking advantage of key features of existing modeling approaches, we propose a parabolic regularization of Barenblatt cohesive models which borrows extensively from previous phase-field and gradient damage formulations. An efficient explicit time integration strategy for this type of nonlocal fracture model is then proposed and justified. In addition, we present a C++ computational framework for computing in- put parameter sensitivities efficiently for explicit dynamic problems using the adjoint method. This capability allows for solving inverse problems involving crack propagation to answer interesting engineering questions such as: 1) what is the optimal design topology and material placement for a heterogeneous structure to maximize fracture resistance, 2) what loads must have been applied to a structure for it to have failed in an observed way, 3) what are the existing cracks in a structure given various experimental observations, etc. In this work, we focus on the first of these engineering questions and demonstrate a capability to automatically and efficiently compute optimal designs intended to minimize crack propagation in structures.
A symmetry-breaking phase transition in a dynamical decision model
International Nuclear Information System (INIS)
Lambert, Gaultier; Chevereau, Guillaume; Bertin, Eric
2011-01-01
We consider a simple decision model in which a set of agents randomly choose one of two competing shops selling the same perishable products (typically food). The satisfaction of agents with respect to a given store is related to the freshness of the previously bought products. Agents select with a higher probability the store that they are most satisfied with. Studying the model from a statistical physics perspective, both through numerical simulations and mean-field analytical methods, we find a rich behaviour with continuous and discontinuous phase transitions between a symmetric phase where both stores maintain the same level of activity, and a phase with broken symmetry where one of the two shops attracts more customers than the other
Model-based magnetization retrieval from holographic phase images
Energy Technology Data Exchange (ETDEWEB)
Röder, Falk, E-mail: f.roeder@hzdr.de [Helmholtz-Zentrum Dresden-Rossendorf, Institut für Ionenstrahlphysik und Materialforschung, Bautzner Landstr. 400, D-01328 Dresden (Germany); Triebenberg Labor, Institut für Strukturphysik, Technische Universität Dresden, D-01062 Dresden (Germany); Vogel, Karin [Triebenberg Labor, Institut für Strukturphysik, Technische Universität Dresden, D-01062 Dresden (Germany); Wolf, Daniel [Helmholtz-Zentrum Dresden-Rossendorf, Institut für Ionenstrahlphysik und Materialforschung, Bautzner Landstr. 400, D-01328 Dresden (Germany); Triebenberg Labor, Institut für Strukturphysik, Technische Universität Dresden, D-01062 Dresden (Germany); Hellwig, Olav [Helmholtz-Zentrum Dresden-Rossendorf, Institut für Ionenstrahlphysik und Materialforschung, Bautzner Landstr. 400, D-01328 Dresden (Germany); AG Magnetische Funktionsmaterialien, Institut für Physik, Technische Universität Chemnitz, D-09126 Chemnitz (Germany); HGST, A Western Digital Company, 3403 Yerba Buena Rd., San Jose, CA 95135 (United States); Wee, Sung Hun [HGST, A Western Digital Company, 3403 Yerba Buena Rd., San Jose, CA 95135 (United States); Wicht, Sebastian; Rellinghaus, Bernd [IFW Dresden, Institute for Metallic Materials, P.O. Box 270116, D-01171 Dresden (Germany)
2017-05-15
The phase shift of the electron wave is a useful measure for the projected magnetic flux density of magnetic objects at the nanometer scale. More important for materials science, however, is the knowledge about the magnetization in a magnetic nano-structure. As demonstrated here, a dominating presence of stray fields prohibits a direct interpretation of the phase in terms of magnetization modulus and direction. We therefore present a model-based approach for retrieving the magnetization by considering the projected shape of the nano-structure and assuming a homogeneous magnetization therein. We apply this method to FePt nano-islands epitaxially grown on a SrTiO{sub 3} substrate, which indicates an inclination of their magnetization direction relative to the structural easy magnetic [001] axis. By means of this real-world example, we discuss prospects and limits of this approach. - Highlights: • Retrieval of the magnetization from holographic phase images. • Magnetostatic model constructed for a magnetic nano-structure. • Decomposition into homogeneously magnetized components. • Discretization of a each component by elementary cuboids. • Analytic solution for the phase of a magnetized cuboid considered. • Fitting a set of magnetization vectors to experimental phase images.
International Nuclear Information System (INIS)
Park, Chan Wook; Lee, Sung Su
2008-01-01
Two-phase compressible flow fields of air-water are investigated numerically in the fixed Eulerian grid framework. The phase interface is captured via volume fractions of ech phase. A way to model two phase compressible flows as a single phase one is found based on an equivalent equation of states of Tait's type for a multiphase cell. The equivalent single phase field is discretized using the Roe's approximate Riemann solver. Two approaches are tried to suppress the pressure oscillation phenomena at the phase interface, a passive advection of volume fraction and a direct pressure relaxation with the compressible form of volume fraction equation. The direct pressure equalizing method suppresses pressure oscillation successfully and generates sharp discontinuities, transmitting and reflecting acoustic waves naturally at the phase interface. In discretizing the compressible form of volume fraction equation, phase interfaces are geometrically reconstructed to minimize the numerical diffusion of volume fraction and relevant variables. The motion of a projectile in a water-filled tube which is fired by the release of highly pressurized air is simulated presuming the flow field as a two dimensional one, and several design factors affecting the projectile movement are investigated
Gao, Min
2014-09-01
In this paper, we develop an efficient numerical method for the two phase moving contact line problem with variable density, viscosity, and slip length. The physical model is based on a phase field approach, which consists of a coupled system of the Cahn-Hilliard and Navier-Stokes equations with the generalized Navier boundary condition [1,2,5]. To overcome the difficulties due to large density and viscosity ratio, the Navier-Stokes equations are solved by a splitting method based on a pressure Poisson equation [11], while the Cahn-Hilliard equation is solved by a convex splitting method. We show that the method is stable under certain conditions. The linearized schemes are easy to implement and introduce only mild CFL time constraint. Numerical tests are carried out to verify the accuracy, stability and efficiency of the schemes. The method allows us to simulate the interface problems with extremely small interface thickness. Three dimensional simulations are included to validate the efficiency of the method. © 2014 Elsevier Inc.
Gao, Min; Wang, Xiao-Ping
2014-01-01
In this paper, we develop an efficient numerical method for the two phase moving contact line problem with variable density, viscosity, and slip length. The physical model is based on a phase field approach, which consists of a coupled system of the Cahn-Hilliard and Navier-Stokes equations with the generalized Navier boundary condition [1,2,5]. To overcome the difficulties due to large density and viscosity ratio, the Navier-Stokes equations are solved by a splitting method based on a pressure Poisson equation [11], while the Cahn-Hilliard equation is solved by a convex splitting method. We show that the method is stable under certain conditions. The linearized schemes are easy to implement and introduce only mild CFL time constraint. Numerical tests are carried out to verify the accuracy, stability and efficiency of the schemes. The method allows us to simulate the interface problems with extremely small interface thickness. Three dimensional simulations are included to validate the efficiency of the method. © 2014 Elsevier Inc.
The Berry phase in GaAs semiconductor with a quantized field
International Nuclear Information System (INIS)
Chen Gang; Chen Zidong; Yu Lixian
2007-01-01
In this paper we investigate the Berry phase in GaAs semiconductor with a quantized magnetic field in the rotating wave approximation. The eigenfunctions of the nuclear spin in the quantized external field are obtained and thus the Berry phase is evaluated explicitly in terms of the introduction of the phase shift. It is shown that the Berry phase can be easily controlled by the coupling strength, the anisotropy constant and the frequency of the electromagnetic wave, which can be important in applications in geometric quantum computing
Discrete phase space - II: The second quantization of free relativistic wave fields
International Nuclear Information System (INIS)
Das, A.
2010-01-01
The Klein-Gordon equation, the Maxwell equation, and the Dirac equation are presented as partial difference equations in the eight-dimensional covariant discrete phase space. These equations are also furnished as difference-differential equations in the arena of discrete phase space and continuous time. The scalar field and electromagnetic fields are quantized with commutation relations. The spin-1/2 field is quantized with anti-commutation relations. Moreover, the total momentum, energy and charge of these free relativisitic quantized fields in the discrete phase space and continuous time are computed exactly. The results agree completely with those computed from the relativisitic fields defined on the space-time continuum. (author)
International Nuclear Information System (INIS)
Aminfar, H.; Mohammadpourfard, M.; Mohseni, F.
2012-01-01
This paper presents a numerical investigation of the hydro-thermal behavior of a ferrofluid (sea water and 4 vol% Fe 3 O 4 ) in a rectangular vertical duct in the presence of different magnetic fields, using two-phase mixture model and control volume technique. Considering the electrical conductivity of the ferrofluid, in addition to the ferrohydrodynamics principles, the magnetohydrodynamics principles have also been taken into account. Three cases for magnetic field have been considered to study mixed convection of the ferrofluid: non-uniform axial field (negative and positive gradient), uniform transverse field and another case when both fields are applied simultaneously. The results indicate that negative gradient axial field and uniform transverse field act similarly and enhance both the Nusselt number and the friction factor, while positive gradient axial field decreases them. It is also concluded that, under the influence of both fields by increasing the intensity of uniform transverse field the effect of non-uniform axial fields decrease. - Highlights: ► In addition to the FHD principles the MHD principles have also been taken into account. ► The mixed convective hydrodynamic and heat transfer have been investigated. ► Negative gradient axial and uniform transverse field enhance Nusselt number and friction factor. ► Positive gradient axial field decreases Nusselt number and friction factor. ► Increase in intensity of transverse fields decreases the effects of non-uniform axial fields.
Characterization of topological phases in models of interacting fermions
Energy Technology Data Exchange (ETDEWEB)
Motruk, Johannes
2016-05-25
) induced by next-nearest neighbor interactions has been predicted by mean field theory. However, various subsequent studies challenged this picture and it was still unclear whether the CI would survive quantum fluctuations. We therefore map out the phase diagram of the model as a function of the interactions on an infinite cylinder with DMRG and find evidence for the absence of the CI phase. However, we report the detection of two novel charge-ordered phases and corroborate the existence of the remaining phases that had been predicted in mean field theory. Furthermore, we characterize the transitions between the various phases by studying the behavior of correlation length and entanglement entropy at the phase boundaries. Finally, we develop an improvement to the DMRG algorithm for fermionic lattice models on cylinders. By using a real space representation in the direction along the cylinder and a real space representation in the perpendicular direction, we are able to use the momentum around the cylinder as conserved quantity to reduce computational costs. We benchmark the method by studying the interacting Hofstadter model and report a considerable speedup in computation time and a severely reduced memory usage.
Duality in the U(1) Higgs model with an external field
International Nuclear Information System (INIS)
Damgaard, P.H.
1988-07-01
An external electromagnetic field is coupled to the lattice U(1) Higgs model in a Villain form. Duality transformations are then used to express the partition function in terms of an effective Lagrangian of topological excitations and their couplings to the external field. Consequences for the phase diagram are derived. (orig.)
Phase space properties of charged fields in theories of local observables
International Nuclear Information System (INIS)
Buchholz, D.; D'Antoni, C.
1994-10-01
Within the setting of algebraic quantum field theory a relation between phase-space properties of observables and charged fields is established. These properties are expressed in terms of compactness and nuclarity conditions which are the basis for the characterization of theories with physically reasonable causal and thermal features. Relevant concepts and results of phase space analysis in algebraic qunatum field theory are reviewed and the underlying ideas are outlined. (orig.)
Multi-phase-field method for surface tension induced elasticity
Schiedung, Raphael; Steinbach, Ingo; Varnik, Fathollah
2018-01-01
A method, based on the multi-phase-field framework, is proposed that adequately accounts for the effects of a coupling between surface free energy and elastic deformation in solids. The method is validated via a number of analytically solvable problems. In addition to stress states at mechanical equilibrium in complex geometries, the underlying multi-phase-field framework naturally allows us to account for the influence of surface energy induced stresses on phase transformation kinetics. This issue, which is of fundamental importance on the nanoscale, is demonstrated in the limit of fast diffusion for a solid sphere, which melts due to the well-known Gibbs-Thompson effect. This melting process is slowed down when coupled to surface energy induced elastic deformation.
Phase space analysis of some interacting Chaplygin gas models
Energy Technology Data Exchange (ETDEWEB)
Khurshudyan, M. [Academy of Sciences of Armenia, Institute for Physical Research, Ashtarak (Armenia); Tomsk State University of Control Systems and Radioelectronics, Laboratory for Theoretical Cosmology, Tomsk (Russian Federation); Tomsk State Pedagogical University, Department of Theoretical Physics, Tomsk (Russian Federation); Myrzakulov, R. [Eurasian National University, Eurasian International Center for Theoretical Physics, Astana (Kazakhstan)
2017-02-15
In this paper we discuss a phase space analysis of various interacting Chaplygin gas models in general relativity. Linear and nonlinear sign changeable interactions are considered. For each case appropriate late time attractors of field equations are found. The Chaplygin gas is one of the dark fluids actively considered in modern cosmology due to the fact that it is a joint model of dark energy and dark matter. (orig.)
International Nuclear Information System (INIS)
Zhang Ruijie; Jing Tao; Jie Wanqi; Liu Baicheng
2006-01-01
To simulate quantitatively the microstructural evolution in the solidification process of multicomponent alloys, we extend the phase-field model for binary alloys to multicomponent alloys with consideration of the solute interactions between different species. These interactions have a great influence not only on the phase equilibria but also on the solute diffusion behaviors. In the model, the interface region is assumed to be a mixture of solid and liquid with the same chemical potential, but with different compositions. The simulation presented is coupled with thermodynamic and diffusion mobility databases, which can accurately predict the phase equilibria and the solute diffusion transportation in the whole system. The phase equilibria in the interface and other thermodynamic quantities are obtained using Thermo-Calc through the TQ interface. As an example, two-dimensional computations for the dendritic growth in Al-Cu-Mg ternary alloy are performed. The quantitative solute distributions and diffusion matrix are obtained in both solid and liquid phases
Automatic NMR field-frequency lock-pulsed phase locked loop approach.
Kan, S; Gonord, P; Fan, M; Sauzade, M; Courtieu, J
1978-06-01
A self-contained deuterium frequency-field lock scheme for a high-resolution NMR spectrometer is described. It is based on phase locked loop techniques in which the free induction decay signal behaves as a voltage-controlled oscillator. By pulsing the spins at an offset frequency of a few hundred hertz and using a digital phase-frequency discriminator this method not only eliminates the usual phase, rf power, offset adjustments needed in conventional lock systems but also possesses the automatic pull-in characteristics that dispense with the use of field sweeps to locate the NMR line prior to closure of the lock loop.
SUBCALC 2.0 -- Substation magnetic field modeling program: User's manual
International Nuclear Information System (INIS)
Pappa, J.R.; Silva, J.M.; Kasten, D.; Sebo, S.; Ohio State Univ., Columbus, OH
1995-11-01
SUBCALC, a Microsoft reg-sign Windows trademark application, allows users to map magnetic fields in or around electric utility substations from common types of substation equipment. SUBCALC allows users to create a substation using predefined transmission and distribution lines and other substation components and to quickly modify them to match the desired operating conditions. Users have the option of invoking Power Line Calculator, a program that integrates with SUBCALC, to define power line conditions such as currents, phase angles, power factor, or symmetric components for three-phase lines that are unbalanced or carry net current. SUBCALC 2.0 offers numerous modeling, user interface, and editing enhancements. For example, users can now produce multi-segmented linear profile plots, take spot measurements anywhere in the model, extend lines with automatic connectivity to preexisting structures, and produce phantom extensions of lines beyond the model to avoid a ''stunted'' appearance to the field map. The program's output is available in four possible formats, including a three-dimensional map of the magnetic field, two-dimensional contours, two-dimensional profile plots, and a table with statistical values. All formats may be printed, accompanied by a three-dimensional view of the world the user has drawn
Berry phase in a two-atom Jaynes-Cummings model with Kerr medium
International Nuclear Information System (INIS)
Bu Shenping; Zhang Guofeng; Liu Jia; Chen Ziyu
2008-01-01
The Jaynes-Cummings model (JCM) is an very important model for describing interaction between quantized electromagnetic fields and atoms in cavity quantum electrodynamics (QED). This model is generalized in many different directions since it predicts many novel quantum effects that can be verified by modern physics experimental technologies. In this paper, the Berry phase and entropy of the ground state for arbitrary photon number n of a two-atom Jaynes-Cummings model with Kerr-like medium are investigated. It is found that there is some correspondence between their images, especially the existence of a curve in the Δ-ε plane along which the energy, Berry phase and entropy all reach their special values. So it is available for detecting entanglement by applying Berry phase.
Berry phase in a two-atom Jaynes-Cummings model with Kerr medium
Energy Technology Data Exchange (ETDEWEB)
Bu Shenping; Zhang Guofeng; Liu Jia; Chen Ziyu [Department of Physics, School of Science, BeiHang University, Xueyuan Road, Beijing 100083 (China)], E-mail: chenzy@buaa.edu.cn
2008-12-15
The Jaynes-Cummings model (JCM) is an very important model for describing interaction between quantized electromagnetic fields and atoms in cavity quantum electrodynamics (QED). This model is generalized in many different directions since it predicts many novel quantum effects that can be verified by modern physics experimental technologies. In this paper, the Berry phase and entropy of the ground state for arbitrary photon number n of a two-atom Jaynes-Cummings model with Kerr-like medium are investigated. It is found that there is some correspondence between their images, especially the existence of a curve in the {delta}-{epsilon} plane along which the energy, Berry phase and entropy all reach their special values. So it is available for detecting entanglement by applying Berry phase.
Topological phases in the Haldane model with spin–spin on-site interactions
Rubio-García, A.; García-Ripoll, J. J.
2018-04-01
Ultracold atom experiments allow the study of topological insulators, such as the non-interacting Haldane model. In this work we study a generalization of the Haldane model with spin–spin on-site interactions that can be implemented on such experiments. We focus on measuring the winding number, a topological invariant, of the ground state, which we compute using a mean-field calculation that effectively captures long-range correlations and a matrix product state computation in a lattice with 64 sites. Our main result is that we show how the topological phases present in the non-interacting model survive until the interactions are comparable to the kinetic energy. We also demonstrate the accuracy of our mean-field approach in efficiently capturing long-range correlations. Based on state-of-the-art ultracold atom experiments, we propose an implementation of our model that can give information about the topological phases.
International Nuclear Information System (INIS)
Yang Tao; Chen Zheng; Zhang Jing; Wang Yongxin; Lu Yanli
2016-01-01
By employing the phase-field-crystal models, the atomic crystallization process of hexagonal and square crystals is investigated with the emphasis on the growth mechanism and morphological change. A unified regime describing the crystallization behavior of both crystals is obtained with the thermodynamic driving force varying. By increasing the driving force, both crystals (in the steady-state) transform from a faceted polygon to an apex-bulged polygon, and then into a symmetric dendrite. For the faceted polygon, the interface advances by a layer-by-layer (LL) mode while for the apex-bulged polygonal and the dendritic crystals, it first adopts the LL mode and then transits into the multi-layer (ML) mode in the later stage. In particular, a shift of the nucleation sites from the face center to the area around the crystal tips is detected in the early growth stage of both crystals and is rationalized in terms of the relation between the crystal size and the driving force distribution. Finally, a parameter characterizing the complex shape change of square crystal is introduced. (paper)
A gradient stable scheme for a phase field model for the moving contact line problem
Gao, Min
2012-02-01
In this paper, an efficient numerical scheme is designed for a phase field model for the moving contact line problem, which consists of a coupled system of the Cahn-Hilliard and Navier-Stokes equations with the generalized Navier boundary condition [1,2,4]. The nonlinear version of the scheme is semi-implicit in time and is based on a convex splitting of the Cahn-Hilliard free energy (including the boundary energy) together with a projection method for the Navier-Stokes equations. We show, under certain conditions, the scheme has the total energy decaying property and is unconditionally stable. The linearized scheme is easy to implement and introduces only mild CFL time constraint. Numerical tests are carried out to verify the accuracy and stability of the scheme. The behavior of the solution near the contact line is examined. It is verified that, when the interface intersects with the boundary, the consistent splitting scheme [21,22] for the Navier Stokes equations has the better accuracy for pressure. © 2011 Elsevier Inc.
Phase microscopy using light-field reconstruction method for cell observation.
Xiu, Peng; Zhou, Xin; Kuang, Cuifang; Xu, Yingke; Liu, Xu
2015-08-01
The refractive index (RI) distribution can serve as a natural label for undyed cell imaging. However, the majority of images obtained through quantitative phase microscopy is integrated along the illumination angle and cannot reflect additional information about the refractive map on a certain plane. Herein, a light-field reconstruction method to image the RI map within a depth of 0.2 μm is proposed. It records quantitative phase-delay images using a four-step phase shifting method in different directions and then reconstructs a similar scattered light field for the refractive sample on the focus plane. It can image the RI of samples, transparent cell samples in particular, in a manner similar to the observation of scattering characteristics. The light-field reconstruction method is therefore a powerful tool for use in cytobiology studies. Copyright © 2015 Elsevier Ltd. All rights reserved.
Energy Technology Data Exchange (ETDEWEB)
Taplin, D.J. [School of Physics and Astronomy, Monash University, Clayton, Victoria 3800 (Australia); Shibata, N. [Institute of Engineering Innovation, School of Engineering, University of Tokyo, Tokyo 113-8656 (Japan); Weyland, M. [Monash Centre for Electron Microscopy, Monash University, Clayton, Victoria 3800 (Australia); Department of Materials Science and Engineering, Monash University, Clayton, Victoria 3800 (Australia); Findlay, S.D., E-mail: scott.findlay@monash.edu [School of Physics and Astronomy, Monash University, Clayton, Victoria 3800 (Australia)
2016-10-15
To correlate atomistic structure with longer range electric field distribution within materials, it is necessary to use atomically fine electron probes and specimens in on-axis orientation. However, electric field mapping via low magnification differential phase contrast imaging under these conditions raises challenges: electron scattering tends to reduce the beam deflection due to the electric field strength from what simple models predict, and other effects, most notably crystal mistilt, can lead to asymmetric intensity redistribution in the diffraction pattern which is difficult to distinguish from that produced by long range electric fields. Using electron scattering simulations, we explore the effects of such factors on the reliable interpretation and measurement of electric field distributions. In addition to these limitations of principle, some limitations of practice when seeking to perform such measurements using segmented detector systems are also discussed. - Highlights: • Measuring electric fields by on-axis electron diffraction is explored by simulation. • Electron channelling reduces deflection predicted by the phase object approximation. • First moment measurements cannot distinguish electric fields from specimen mistilt. • Segmented detector estimates are fairly insensitive to camera length and orientation.
International Nuclear Information System (INIS)
Hou Hua; Zhao Yuhong; Zhao Yuhui
2009-01-01
With the microscopic phase-field model, atomic-scale computer simulation programs for the precipitation mechanism of the ordered intermetallic compound γ' in binary Ni-15.5 at.%Al alloy, θ and γ' in ternary Ni 75 Al x V 25-x alloys were worked out based on the microscopic diffusion equation and non-equilibrium free energy. The simulation can be applied to the whole precipitation process and composition range. A prior assumptions on the new phase structure or transformation path was unnecessary, the possible non-equilibrium phases, atomic clustering and ordering could be described automatically, and atomic images, order parameters and volume fractions of precipitates were obtained. Computer simulation was performed systematically on the precipitation mechanism, precipitation sequence of θ and γ' in complicated system with ordering and clustering simultaneously. Through the simulated atomic images and chemical order parameters of precipitates, we can explain the complex precipitation mechanisms of θ (Ni 3 V) and γ' (Ni 3 Al) ordered phases. For the binary alloy, the precipitation mechanism of γ' phase has the characteristic of both non-classical nucleation and growth (NCNG) and congruent ordering and spinodal decomposition (COSD). For the ternary alloys, the precipitation characteristic of γ' phase transforms from NCNG to COSD gradually, otherwise, the precipitation characteristic of θ phase transforms from COSD to NCNG mechanism gradually
Gauge-field topology in two dimensions: θ-vacuum, topological phases and composite fields
International Nuclear Information System (INIS)
Ilieva, N.; Pervushin, V.N.
1990-06-01
In the framework of the minimal quantization method, the residual 'longitudinal' vacuum dynamics of the Abelian gauge field, that is described by a new pair of canonical variables, is revealed. This dynamics is shown to give origin to the θ-vacuum, thus providing a field analogy of the Josephson effect. The destructive interference of the topological phases - that the fermion fields are shown to acquire - is considered as a reason for the charge screening in the two-dimensional massless QED. (author). 11 refs
Topics in phase-shift analysis and higher spin field theory
International Nuclear Information System (INIS)
Reisen, J.C.J.M.
1983-01-01
The first part of this thesis considers several aspects of the existence of phase-shift ambiguities. The subject is introduced with a few remarks on scattering theory and previous work in this area is discussed. The mathematical restrictions of presenting such problems clearly are considered and the construction of different unitary amplitudes which correspond to the same differential cross section is described. So far, examples of phase-shift ambiguities have only been found for rather special cases but the author shows that these results can be considerably generalized for spinless elastic scattering, leading to properties of phase-shift ambiguities being revealed that were previously absent. These properties are discussed in detail. Phase-shift ambiguities for the spin-0-spin-1/2 elastic scattering are then considered and again generalized. The second part of this thesis is concerned with the investigation of a free field theory for both massive and massless particles with higher spin (1, 2 and 3). A root method has been used which is described and shown to lead to the free field equations and the subsidiary conditions. A field equation and Lagrangian are constructed for massive particles and the former is then used to derive a massless field equation and Lagrangian. The relation between massive and massless field equations is investigated in more detail and particularly the expressions for the amplitude describing exchange of a particle between two external sources are compared. (Auth./C.F.)
Numerical calculation of flashing from long pipes using a two-field model
International Nuclear Information System (INIS)
Rivard, W.C.; Torrey, M.D.
1976-05-01
A two-field model for two-phase flows, in which the vapor and liquid phases have different densities, velocities, and temperatures, has been used to calculate the flashing of water from long pipes. The IMF (Implicit Multifield) technique is used to numerically solve the transient equations that govern the dynamics of each phase. The flow physics is described with finite rate phase transitions, interfacial friction, heat transfer, pipe wall friction, and appropriate state equations. The results of the calculations are compared with measured histories of pressure, temperature, and void fraction. A parameter study indicates the relative sensitivity of the results to the various physical models that are used
Numerical calculation of flashing from long pipes using a two-field model
International Nuclear Information System (INIS)
Rivard, W.C.; Torrey, M.D.
1975-11-01
A two-field model for two-phase flows, in which the vapor and liquid phases have different densities, velocities, and temperatures, has been used to calculate the flashing of water from long pipes. The IMF (Implicit Multifield) technique is used to numerically solve the transient equations that govern the dynamics of each phase. The flow physics is described with finite rate phase transitions, interfacial friction, heat transfer, pipe wall friction, and appropriate state equations. The results of the calculations are compared with measured histories of pressure, temperature, and void fraction. A parameter study indicates the relative sensitivity of the results to the various physical models that are used
Topological phase transitions in the gauged BPS baby Skyrme model
International Nuclear Information System (INIS)
Adam, C.; Naya, C.; Romanczukiewicz, T.; Sanchez-Guillen, J.; Wereszczynski, A.
2015-01-01
We demonstrate that the gauged BPS baby Skyrme model with a double vacuum potential allows for phase transitions from a non-solitonic to a solitonic phase, where the latter corresponds to a ferromagnetic liquid. Such a transition can be generated by increasing the external pressure P or by turning on an external magnetic field H. As a consequence, the topological phase where gauged BPS baby skyrmions exist, is a higher density phase. For smaller densities, obtained for smaller values of P and H, a phase without solitons is reached. We find the critical line in the P,H parameter space. Furthermore, in the soliton phase, we find the equation of state for the baby skyrmion matter V=V(P,H) at zero temperature, where V is the “volume”, i.e., area of the solitons.
Topological phase transitions in the gauged BPS baby Skyrme model
Energy Technology Data Exchange (ETDEWEB)
Adam, C.; Naya, C. [Departamento de Física de Partículas, Universidad de Santiago de Compostela andInstituto Galego de Física de Altas Enerxias (IGFAE), Santiago de Compostela, E-15782 (Spain); Romanczukiewicz, T. [Institute of Physics, Jagiellonian University, Lojasiecza 11, Kraków, 30-348 (Poland); Sanchez-Guillen, J. [Departamento de Física de Partículas, Universidad de Santiago de Compostela andInstituto Galego de Física de Altas Enerxias (IGFAE), Santiago de Compostela, E-15782 (Spain); Wereszczynski, A. [Institute of Physics, Jagiellonian University, Lojasiecza 11, Kraków, 30-348 (Poland)
2015-05-29
We demonstrate that the gauged BPS baby Skyrme model with a double vacuum potential allows for phase transitions from a non-solitonic to a solitonic phase, where the latter corresponds to a ferromagnetic liquid. Such a transition can be generated by increasing the external pressure P or by turning on an external magnetic field H. As a consequence, the topological phase where gauged BPS baby skyrmions exist, is a higher density phase. For smaller densities, obtained for smaller values of P and H, a phase without solitons is reached. We find the critical line in the P,H parameter space. Furthermore, in the soliton phase, we find the equation of state for the baby skyrmion matter V=V(P,H) at zero temperature, where V is the “volume”, i.e., area of the solitons.
International Nuclear Information System (INIS)
Neichev, Z; Benova, E; Gamero, A; Sola, A
2007-01-01
The purpose of this work is to investigate phase diagrams and electric field radial distribution of coaxial discharges, sustained by a traveling electromagnetic wave, assuming finite and infinite thickness of the discharge chamber in the model. The calculations are made for azimuthally symmetric and dipolar wave modes. The phase diagrams and the radial profiles of the electric field at various thicknesses of the outer dielectric tube of the chamber and different discharge conditions are obtained. For the purpose of low pressure coaxial plasma modelling, radial profiles of the electric field at different discharge conditions have been investigated experimentally and compared with the theoretical results
Schneider, Daniel; Schoof, Ephraim; Tschukin, Oleg; Reiter, Andreas; Herrmann, Christoph; Schwab, Felix; Selzer, Michael; Nestler, Britta
2018-03-01
Computational models based on the phase-field method have become an essential tool in material science and physics in order to investigate materials with complex microstructures. The models typically operate on a mesoscopic length scale resolving structural changes of the material and provide valuable information about the evolution of microstructures and mechanical property relations. For many interesting and important phenomena, such as martensitic phase transformation, mechanical driving forces play an important role in the evolution of microstructures. In order to investigate such physical processes, an accurate calculation of the stresses and the strain energy in the transition region is indispensable. We recall a multiphase-field elasticity model based on the force balance and the Hadamard jump condition at the interface. We show the quantitative characteristics of the model by comparing the stresses, strains and configurational forces with theoretical predictions in two-phase cases and with results from sharp interface calculations in a multiphase case. As an application, we choose the martensitic phase transformation process in multigrain systems and demonstrate the influence of the local homogenization scheme within the transition regions on the resulting microstructures.
Schmitt, Regina; Kuhn, Charlotte; Müller, Ralf
2017-07-01
A continuum phase field model for martensitic transformations is introduced, including crystal plasticity with different slip systems for the different phases. In a 2D setting, the transformation-induced eigenstrain is taken into account for two martensitic orientation variants. With aid of the model, the phase transition and its dependence on the volume change, crystal plastic material behavior, and the inheritance of plastic deformations from austenite to martensite are studied in detail. The numerical setup is motivated by the process of cryogenic turning. The resulting microstructure qualitatively coincides with an experimentally obtained martensite structure. For the numerical calculations, finite elements together with global and local implicit time integration scheme are employed.
Temperature dependence of critical magnetic fields for the Abelian Higgs model
International Nuclear Information System (INIS)
Magpantay, J.; Mukku, C.; Sayed, W.A.
1981-05-01
One loop temperature and external electromagnetic field effects on the Abelian Higgs model are studied using the momentum space heat kernel. We obtain expressions for the critical fields necessary for symmetry restoration at some finite temperature and display the critical B vs. T curve separating the broken and restored phases in the B-T plane. (author)
Quantum Phase Shift of a Moving Dipole under a Magnetic Field at a Distance
Lee, Kang-Ho; Kim, Young-Wan; Kang, Kicheon
2018-03-01
We predict a quantum phase shift of a moving electric dipole in the presence of an external magnetic field at a distance. On the basis of the Lorentz-covariant field interaction approach, we show that a phase shift appears in the internal dipole state under the condition that the dipole is moving in the field-free region, which is distinct from the topological He-McKellar-Wilkens phase generated by a direct overlap of the dipole and the field. We discuss the experimental feasibility of detecting this phase with atomic interferometry and argue that detection of this phase will resolve the question of the locality in quantum electromagnetic interaction.
Spin ordered phase transitions in neutron matter under the presence of a strong magnetic field
International Nuclear Information System (INIS)
Isayev, A.A.; Yang, J.
2011-01-01
In dense neutron matter under the presence of a strong magnetic field, considered in the model with the Skyrme effective interaction, there are possible two types of spin ordered states. In one of them the majority of neutron spins are aligned opposite to magnetic field (thermodynamically preferable state), and in other one the majority of spins are aligned along the field (metastable state). The equation of state, incompressibility modulus and velocity of sound are determined in each case with the aim to find the peculiarities allowing to distinguish between two spin ordered phases.
Perron, Aurelien; Roehling, John D.; Turchi, Patrice E. A.; Fattebert, Jean-Luc; McKeown, Joseph T.
2018-01-01
A combination of dynamic transmission electron microscopy (DTEM) experiments and CALPHAD-informed phase-field simulations was used to study rapid solidification in Cu-Ni thin-film alloys. Experiments—conducted in the DTEM—consisted of in situ laser melting and determination of the solidification kinetics by monitoring the solid-liquid interface and the overall microstructure evolution (time-resolved measurements) during the solidification process. Modelling of the Cu-Ni alloy microstructure evolution was based on a phase-field model that included realistic Gibbs energies and diffusion coefficients from the CALPHAD framework (thermodynamic and mobility databases). DTEM and post mortem experiments highlighted the formation of microsegregation-free columnar grains with interface velocities varying from ˜0.1 to ˜0.6 m s-1. After an ‘incubation’ time, the velocity of the planar solid-liquid interface accelerated until solidification was complete. In addition, a decrease of the temperature gradient induced a decrease in the interface velocity. The modelling strategy permitted the simulation (in 1D and 2D) of the solidification process from the initially diffusion-controlled to the nearly partitionless regimes. Finally, results of DTEM experiments and phase-field simulations (grain morphology, solute distribution, and solid-liquid interface velocity) were consistent at similar time (μs) and spatial scales (μm).
Full-field stress determination in photoelasticity with phase shifting technique
Guo, Enhai; Liu, Yonggang; Han, Yongsheng; Arola, Dwayne; Zhang, Dongsheng
2018-04-01
Photoelasticity is an effective method for evaluating the stress and its spatial variations within a stressed body. In the present study, a method to determine the stress distribution by means of phase shifting and a modified shear-difference is proposed. First, the orientation of the first principal stress and the retardation between the principal stresses are determined in the full-field through phase shifting. Then, through bicubic interpolation and derivation of a modified shear-difference method, the internal stress is calculated from the point with a free boundary along its normal direction. A method to reduce integration error in the shear difference scheme is proposed and compared to the existing methods; the integration error is reduced when using theoretical photoelastic parameters to calculate the stress component with the same points. Results show that when the value of Δx/Δy approaches one, the error is minimum, and although the interpolation error is inevitable, it has limited influence on the accuracy of the result. Finally, examples are presented for determining the stresses in a circular plate and ring subjected to diametric loading. Results show that the proposed approach provides a complete solution for determining the full-field stresses in photoelastic models.
Latitudinal amplitude-phase structure of MHD waves: STARE radar observations and modeling
Directory of Open Access Journals (Sweden)
Pilipenko V.
2016-09-01
Full Text Available We have developed a numerical model that yields a steady-state distribution of field components of MHD wave in an inhomogeneous plasma box simulating the realistic magnetosphere. The problem of adequate boundary condition at the ionosphere–magnetosphere interface for coupled MHD mode is considered. To justify the model’s assumptions, we have derived the explicit inequality showing when the ionospheric inductive Hall effect can be neglected upon the consideration of Alfven wave reflection from the ionospheric boundaries. The model predicts a feature of the ULF spatial amplitude/phase distribution that has not been noticed by the field line resonance theory: the existence of a region with opposite phase delays on the source side of the resonance. This theoretical prediction is supported by the amplitude-phase latitudinal structures of Pc5 waves observed by STARE radar and IMAGE magnetometers. A gradual decrease in azimuthal wave number m at smaller L-shells was observed at longitudinally separated radar beams.
Phase competition in a one-dimensional three-orbital Hubbard-Holstein model
Li, Shaozhi; Tang, Yanfei; Maier, Thomas A.; Johnston, Steven
2018-05-01
We study the interplay between the electron-phonon (e -ph) and on-site electron-electron (e-e) interactions in a three-orbital Hubbard-Holstein model on an extended one-dimensional lattice using determinant quantum Monte Carlo. For weak e-e and e -ph interactions, we observe a competition between an orbital-selective Mott phase (OSMP) and a (multicomponent) charge-density-wave (CDW) insulating phase, with an intermediate metallic phase located between them. For large e-e and e -ph couplings, the OSMP and CDW phases persist, while the metallic phase develops short-range orbital correlations and becomes insulating when both the e-e and e -ph interactions are large but comparable. Many of our conclusions are in line with those drawn from a prior dynamical mean-field theory study of the two-orbital Hubbard-Holstein model [Phys. Rev. B 95, 121112(R) (2017), 10.1103/PhysRevB.95.121112] in infinite dimension, suggesting that the competition between the e -ph and e-e interactions in multiorbital Hubbard-Holstein models leads to rich physics, regardless of the dimension of the system.
The Ising model and its applications to a phase transition of biological interest
International Nuclear Information System (INIS)
Cabrera, G.G.; Stein-Barana, A.M.; Zuckermann, M.J.
1984-01-01
It is investigated a gel-liquid crystal phase transition employing a two-state model equivalent to the Spin 1/2 Ising Model with applied magnetic field. The model is studied from the standpoint of the cluster variational method of Kikuchi for cooperative phenomena. (M.W.O.) [pt
Energy Technology Data Exchange (ETDEWEB)
Correa, E.B.S. [Universidade Federal do Sul e Sudeste do Para, Instituto de Ciencias Exatas, Maraba (Brazil); Centro Brasileiro de Pesquisas Fisicas-CBPF/MCTI, Rio de Janeiro (Brazil); Linhares, C.A. [Universidade do Estado do Rio de Janeiro, Instituto de Fisica, Rio de Janeiro (Brazil); Malbouisson, A.P.C. [Centro Brasileiro de Pesquisas Fisicas-CBPF/MCTI, Rio de Janeiro (Brazil); Malbouisson, J.M.C. [Universidade Federal da Bahia, Instituto de Fisica, Salvador (Brazil); Santana, A.E. [Universidade de Brasilia, Instituto de Fisica, Brasilia, DF (Brazil)
2017-04-15
We study effects coming from finite size, chemical potential and from a magnetic background on a massive version of a four-fermion interacting model. This is performed in four dimensions as an application of recent developments for dealing with field theories defined on toroidal spaces. We study effects of the magnetic field and chemical potential on the size-dependent phase structure of the model, in particular, how the applied magnetic field affects the size-dependent critical temperature. A connection with some aspects of the hadronic phase transition is established. (orig.)
Lamorgese, A.; Mauri, R.
2017-04-01
We simulate the mixing (demixing) process of a quiescent binary liquid mixture with a composition-dependent viscosity which is instantaneously brought from the two-phase (one-phase) to the one-phase (two-phase) region of its phase diagram. Our theoretical approach follows a standard diffuse-interface model of partially miscible regular binary mixtures wherein convection and diffusion are coupled via a nonequilibrium capillary force, expressing the tendency of the phase-separating system to minimize its free energy. Based on 2D simulation results, we discuss the influence of viscosity ratio on basic statistics of the mixing (segregation) process triggered by a rapid heating (quench), assuming that the ratio of capillary to viscous forces (a.k.a. the fluidity coefficient) is large. We show that, for a phase-separating system, at a fixed value of the fluidity coefficient (with the continuous phase viscosity taken as a reference), the separation depth and the characteristic length of single-phase microdomains decrease monotonically for increasing values of the viscosity of the dispersed phase. This variation, however, is quite small, in agreement with experimental results. On the other hand, as one might expect, at a fixed viscosity of the dispersed phase both of the above statistics increase monotonically as the viscosity of the continuous phase decreases. Finally, we show that for a mixing system the attainment of a single-phase equilibrium state by coalescence and diffusion is retarded by an increase in the viscosity ratio at a fixed fluidity for the dispersed phase. In fact, for large enough values of the viscosity ratio, a thin film of the continuous phase becomes apparent when two drops of the minority phase approach each other, which further retards coalescence.
Phase diagrams of the ternary alloy with a single-ion anisotropy in the mean-field approximation
International Nuclear Information System (INIS)
Dely, J.; Bobak, A.
2006-01-01
The phase diagram of the AB p C 1-p ternary alloy consisting of Ising spins S A =32, S B =2, and S C =52 is investigated by the use of a mean-field theory based on the Bogoliubov inequality for the Gibbs free energy. The effect of the single-ion anisotropy on the phase diagrams is discussed by changing values of the parameters in the model Hamiltonian and comparison is made with the recently reported finite-temperature phase diagrams for the ternary alloy having spin S B =1
On the phase velocity of plasma waves in a self-modulated laser wake-field accelerator
Andreev, N. E.; Kirsanov, V. I.; Sakharov, A. S.; van Amersfoort, P. W.; Goloviznin, V. V.
1996-01-01
The properties of the wake field excited by a flattop laser pulse with a sharp leading edge and a power below the critical one for relativistic self-focusing are studied analytically and numerically with emphasis on the phase velocity of the plasma wave. The paraxial model describing modulation of
Discrete element weld model, phase 2
Prakash, C.; Samonds, M.; Singhal, A. K.
1987-01-01
A numerical method was developed for analyzing the tungsten inert gas (TIG) welding process. The phenomena being modeled include melting under the arc and the flow in the melt under the action of buoyancy, surface tension, and electromagnetic forces. The latter entails the calculation of the electric potential and the computation of electric current and magnetic field therefrom. Melting may occur at a single temperature or over a temperature range, and the electrical and thermal conductivities can be a function of temperature. Results of sample calculations are presented and discussed at length. A major research contribution has been the development of numerical methodology for the calculation of phase change problems in a fixed grid framework. The model has been implemented on CHAM's general purpose computer code PHOENICS. The inputs to the computer model include: geometric parameters, material properties, and weld process parameters.
Sun, Hui; Wen, Jiayi; Zhao, Yanxiang; Li, Bo; McCammon, J. Andrew
2015-01-01
Dielectric boundary based implicit-solvent models provide efficient descriptions of coarse-grained effects, particularly the electrostatic effect, of aqueous solvent. Recent years have seen the initial success of a new such model, variational implicit-solvent model (VISM) [Dzubiella, Swanson, and McCammon Phys. Rev. Lett. 96, 087802 (2006) and J. Chem. Phys. 124, 084905 (2006)], in capturing multiple dry and wet hydration states, describing the subtle electrostatic effect in hydrophobic interactions, and providing qualitatively good estimates of solvation free energies. Here, we develop a phase-field VISM to the solvation of charged molecules in aqueous solvent to include more flexibility. In this approach, a stable equilibrium molecular system is described by a phase field that takes one constant value in the solute region and a different constant value in the solvent region, and smoothly changes its value on a thin transition layer representing a smeared solute-solvent interface or dielectric boundary. Such a phase field minimizes an effective solvation free-energy functional that consists of the solute-solvent interfacial energy, solute-solvent van der Waals interaction energy, and electrostatic free energy described by the Poisson–Boltzmann theory. We apply our model and methods to the solvation of single ions, two parallel plates, and protein complexes BphC and p53/MDM2 to demonstrate the capability and efficiency of our approach at different levels. With a diffuse dielectric boundary, our new approach can describe the dielectric asymmetry in the solute-solvent interfacial region. Our theory is developed based on rigorous mathematical studies and is also connected to the Lum–Chandler–Weeks theory (1999). We discuss these connections and possible extensions of our theory and methods. PMID:26723595
Sun, Hui; Wen, Jiayi; Zhao, Yanxiang; Li, Bo; McCammon, J Andrew
2015-12-28
Dielectric boundary based implicit-solvent models provide efficient descriptions of coarse-grained effects, particularly the electrostatic effect, of aqueous solvent. Recent years have seen the initial success of a new such model, variational implicit-solvent model (VISM) [Dzubiella, Swanson, and McCammon Phys. Rev. Lett. 96, 087802 (2006) and J. Chem. Phys. 124, 084905 (2006)], in capturing multiple dry and wet hydration states, describing the subtle electrostatic effect in hydrophobic interactions, and providing qualitatively good estimates of solvation free energies. Here, we develop a phase-field VISM to the solvation of charged molecules in aqueous solvent to include more flexibility. In this approach, a stable equilibrium molecular system is described by a phase field that takes one constant value in the solute region and a different constant value in the solvent region, and smoothly changes its value on a thin transition layer representing a smeared solute-solvent interface or dielectric boundary. Such a phase field minimizes an effective solvation free-energy functional that consists of the solute-solvent interfacial energy, solute-solvent van der Waals interaction energy, and electrostatic free energy described by the Poisson-Boltzmann theory. We apply our model and methods to the solvation of single ions, two parallel plates, and protein complexes BphC and p53/MDM2 to demonstrate the capability and efficiency of our approach at different levels. With a diffuse dielectric boundary, our new approach can describe the dielectric asymmetry in the solute-solvent interfacial region. Our theory is developed based on rigorous mathematical studies and is also connected to the Lum-Chandler-Weeks theory (1999). We discuss these connections and possible extensions of our theory and methods.
Phase-field simulations of pore migration and morphology change in thermal gradients
Energy Technology Data Exchange (ETDEWEB)
Vance, Ian W.; Millett, Paul C., E-mail: pmillett@uark.edu
2017-07-15
Here we present a phase-field simulation model that captures the thermal-gradient-driven migration of pores in oxide fuel associated with fuel restructuring. The model utilizes a Cahn-Hilliard equation supplemented with an advection term to describe the vapor transport of fuel material through the pore interior due to gradients in vapor pressure. Simulations demonstrate that the model not only predicts pore migration towards the centerline of the fuel, but also a concurrent change in pore shape during migration from an initially isotropic morphology to either a lenticular morphology or a prolate morphology depending on the vapor transport conditions. This model is a necessary first step to conducting accurate simulations of the microscopic changes that occur during the complicated process of oxide fuel restructuring.
Phase-Field Simulation of Microstructure Evolution in Industrial A2214 Alloy During Solidification
Wei, Ming; Tang, Ying; Zhang, Lijun; Sun, Weihua; Du, Yong
2015-07-01
By linking to the thermodynamic and atomic mobility databases in Al alloys well established in our research group, the microstructure evolution in industrial A2214 alloy (Al-4.5Cu-0.5Mg-1.0Si, in wt pct) during solidification process was studied by means of two-dimensional phase-field simulation via MICRostructure Evolution Simulation Software in the framework of the multi-phase-field formalism. The thermophysical parameters including interfacial energies and interfacial mobilities were carefully chosen for reproducing the experimental features. The solidification sequence due to the present phase-field simulation conforms to both equilibrium calculation and Scheil simulation. The predicted microstructure reproduces the experimental data very well. These facts indicate that a quantitative phase-field simulation was achieved in the present work. Moreover, the mechanisms of characteristic patterns and microstructure formation were revealed with the aid of the phase-field simulation. In addition, the effect of cooling rate on the secondary dendrite arm spacing and microsegregation was also investigated through comprehensive comparison with the experimental data.
Energy Technology Data Exchange (ETDEWEB)
Zhang, Li [China State Key Lab of Metal Matrix Composites, School of Materials Science and Engineering, Shanghai Jiao Tong University, Shanghai 200240 (China); Shen, Yao, E-mail: yaoshen@sjtu.edu.cn [China State Key Lab of Metal Matrix Composites, School of Materials Science and Engineering, Shanghai Jiao Tong University, Shanghai 200240 (China); Wan, Haibo [China State Key Lab of Metal Matrix Composites, School of Materials Science and Engineering, Shanghai Jiao Tong University, Shanghai 200240 (China); Shanghai Power Equipment Research Institute, Shanghai 200240 (China); Xiong, Xiaochuan [General Motors Global Research & Development, China Science Laboratory, Shanghai 201206 (China); Zhang, Lanting [China State Key Lab of Metal Matrix Composites, School of Materials Science and Engineering, Shanghai Jiao Tong University, Shanghai 200240 (China)
2015-11-25
A phase field model accounting for anisotropic elastic energy has been formulated to investigate the morphology and growth kinetics of a Widmanstätten microstructure during the isothermal austenite to ferrite transformation in binary Fe–C. Physically realistic parameters are employed, for which the thermodynamic functions and the diffusional mobilities are from the literatures that were assessed via the Calphad technique and from experimental results respectively. The simulation results suggest that the anisotropy of elastic energy, resulting from the lattice distortion between the ferrite precipitate and the austenite matrix in the phase transformation, is sufficient to generate a plate-like Widmanstätten structure. The growth of the ferrite precipitate follows completely different dynamic laws in different directions, i.e., parabolic thickening in the direction of the plate thickness and linear lengthening in the direction toward the plate tip. The chief reason for the former is that the moving of the plate broad sides may be regarded as a migration of straight interfaces in the diffusion-controlled phase transformation; the latter is because that the plate tip can maintain a constant radius of curvature during the phase transition after a transient initial stage. Furthermore, the aspect ratio and the lengthening rate of the Widmanstätten ferrite plate simulated by our analyses are in good agreement with the experimental observations. - Highlights: • A model assuming elastic anisotropy for the growth of ferrites is formulated. • The elastic anisotropy is sufficient to generate acicular Widmanstätten ferrites. • The direction of the plate thickness features a parabolic thickening. • The direction of the plate tip characterizes a linear lengthening. • The calculated aspect ratio and growth rate are in good agreement with experiments.
A three field two fluid CFD model for the bubbly-cap bubble regime
International Nuclear Information System (INIS)
Martin Lopez de Bertodano; Xiaodong Sun; Mamoru Ishii; Asim Ulke
2005-01-01
Full text of publication follows: The lateral phase distribution of a two phase duct flow in the cap bubble regime is analyzed with a three dimensional three field two-fluid CFD model based on the turbulent k-ε model for bubbly flows developed by Lopez de Bertodano et. al. [2]. The turbulent diffusion of the bubbles is the dominant phase distribution mechanism. A new analytic result is presented to support the development of the model for the bubble induced turbulent diffusion force. New experimental data obtained with a state-of-the-art four sensor miniature conductivity probe are used to validate the two-fluid model. The focus of this work is modeling the transport of the dispersed phase. Previous work (e.g., Lopez de Bertodano et. al.) was focused on the interfacial forces of drag, lift and virtual mass. However, the dispersion of the bubbles by the turbulent eddies of the continuous phase must be considered too. The rigorous formulation of a model for the turbulent dispersion of the bubbles results in a turbulent diffusion force which is obtained from a probability distribution function average (i.e., Boltzmann averaging) of the dispersed phase momentum equation. This force was recently applied to a turbulent bubbly jet with small bubbles (i.e., 1 mm diameter) without adjusting any coefficient. However, the application of this force to industrial conditions (i.e., larger bubbles) requires specific two-phase flow experimental data to calibrate the model due to the uncertainties of the flow around large bubbles. In particular the void distribution and the interfacial area concentration are measured in a mixture of big and small bubbles. The state-of-the-art miniaturized four-sensor conductivity probe developed by Kim et al. [3] is used to obtain the interfacial area concentration in complex two-phase flow situations. This probe can discriminate between small and large bubbles so it offers an opportunity to perform further developments of the multidimensional two
Energy Technology Data Exchange (ETDEWEB)
Bertrand, Thierry [Inst. de Physique Nucleaire, Lyon-1 Univ., 69 - Villeurbanne (France)
1998-12-11
The self-consistent Random Phase Approximation (SCRPA) is a method allowing in the mean-field theory inclusion of the correlations in the ground and excited states. It has the advantage of not violating the Pauli principle in contrast to RPA, that is based on the quasi-bosonic approximation; in addition, numerous applications in different domains of physics, show a possible variational character. However, the latter should be formally demonstrated. The first model studied with SCRPA is the anharmonic oscillator in the region where one of its symmetries is spontaneously broken. The ground state energy is reproduced by SCRPA more accurately than RPA, with no violation of the Ritz variational principle, what is not the case for the latter approximation. The success of SCRPA is the the same in case of ground state energy for a model mixing bosons and fermions. At the transition point the SCRPA is correcting RPA drastically, but far from this region the correction becomes negligible, both methods being of similar precision. In the deformed region in the case of RPA a spurious mode occurred due to the microscopical character of the model.. The SCRPA may also reproduce this mode very accurately and actually it coincides with an excitation in the exact spectrum 40 refs., 33 figs., 14 tabs.
International Nuclear Information System (INIS)
Suwa, Yoshihiro; Aizawa, Tatsuhiko; Takaya, Shigeru; Nagae, Yuji; Aoto, Kazumi
2005-03-01
The present research aims at a proposal of theoretical treatise to describe the local phase transformation from austenite to ferrite in the stainless steels under hot cyclic fatigue conditions. In experiments, this local phase transformation is detected as a magnetized region in the non-magnetic matrix after low-cycle fatigue test at the elevated temperature. The theoretical frame proposed here is composed of two methodologies. In the first approach, microstructure evolution with γ → α transformation is described by the phase field method. In the second approach, micromechanical method on the basis of the unit cell modeling is proposed to develop a new micromechanical analysis. The details of two approached are summarized in the following. (1) Phase formation simulation by the phase field method. Most of reports have started that γ-α phase transformation as a creep damage is induced by dechromization, which comes from carbide precipitation around grain boundaries. A new theoretical treatise is proposed for simulating this γ → α transformation in Fe-Cr-Ni system. Stabilities of both phases are investigated for various chemical compositions. Furthermore, in order to investigate dechromization phenomena in Fe-Cr-Ni-C system, a new theoretical frame is also proposed to handle an interstitial element in phase field method. (2) Low cycle fatigue elasto-plastic analysis by the unit-cell modeling. In experiments, the magnetized zones are generated to distribute at the vicinity of the hard, delta-phase inclusion in the austenitic matrix. The cumulative plastic region advances in the surroundings of this hard inclusion with increasing the number of cycles in the controlled strain range. This predicted profile of cumulative plastic regions corresponds to the experimentally measured, magnetized zones. In addition, the effect of geometric configuration of this inclusion on the plastic region evolution has close relationship of creep damage advancement in experiments
International Nuclear Information System (INIS)
Ahmed, K.; Tonks, M.; Zhang, Y.; Biner, B.
2016-01-01
A detailed phase field model for the effect of pore drag on grain growth kinetics was implemented in MARMOT. The model takes into consideration both the curvature-driven grain boundary motion and pore migration by surface diffusion. As such, the model accounts for the interaction between pore and grain boundary kinetics, which tends to retard the grain growth process. Our 2D and 3D simulations demonstrate that the model capture all possible pore-grain boundary interactions proposed in theoretical models. For high enough surface mobility, the pores move along with the migrating boundary as a quasi-rigid-body, albeit hindering its migration rate compared to the pore-free case. For less mobile pores, the migrating boundary can separate from the pores. For the pore-controlled grain growth kinetics, the model predicts a strong dependence of the growth rate on the number of pores, pore size, and surface diffusivity in agreement with theroretical models. An evolution equation for the grain size that includes these parameters was derived and showed to agree well with numerical solution. It shows a smooth transition from boundary-controlled kinetics to pore-controlled kinetics as the surface diffusivity decreases or the number of pores or their size increases. This equation can be utilized in BISON to give accurate estimate for the grain size evolution. This will be accomplished in the near future. The effect of solute drag and anisotropy of grain boundary on grain growth will be investigated in future studies.
Magnetic Phase Transitions of CeSb. II: Effects of Applied Magnetic Fields
DEFF Research Database (Denmark)
Meier, G.; Fischer, P.; Hälg, W.
1978-01-01
For pt.I see ibid., vol.11, p.345 (1978). The metamagnetic phase transition and the associated phase diagram of the anomalous antiferromagnet CeSb were determined in a neutron diffraction study of the magnetic ordering of CeSb single crystals in applied magnetic fields parallel to the (001...... magnetic fields. The observed magnetic structures do not correspond to the stable configurations expected from the molecular field theory of the face-centred cubic lattice. The change from a first-order transition at the Neel temperature in zero field to second-order transition at high fields points...
Multiscale empirical modeling of the geomagnetic field: From storms to substorms
Stephens, G. K.; Sitnov, M. I.; Korth, H.; Gkioulidou, M.; Ukhorskiy, A. Y.; Merkin, V. G.
2017-12-01
An advanced version of the TS07D empirical geomagnetic field model, herein called SST17, is used to model the global picture of the geomagnetic field and its characteristic variations on both storm and substorm scales. The new SST17 model uses two regular expansions describing the equatorial currents with each having distinctly different scales, one corresponding to a thick and one to a thin current sheet relative to the thermal ion gyroradius. These expansions have an arbitrary distribution of currents in the equatorial plane that is constrained only by magnetometer data. This multi-scale description allows one to reproduce the current sheet thinning during the growth phase. Additionaly, the model uses a flexible description of field-aligned currents that reproduces their spiral structure at low altitudes and provides a continuous transition from region 1 to region 2 current systems. The empirical picture of substorms is obtained by combining magnetometer data from Geotail, THEMIS, Van Allen Probes, Cluster II, Polar, IMP-8, GOES 8, 9, 10 and 12 and then binning this data based on similar values of the auroral index AL, its time derivative and the integral of the solar wind electric field parameter (from ACE, Wind, and IMP-8) in time over substorm scales. The performance of the model is demonstrated for several events, including the 3 July 2012 substorm, which had multi-probe coverage and a series of substorms during the March 2008 storm. It is shown that the AL binning helps reproduce dipolarization signatures in the northward magnetic field Bz, while the solar wind electric field integral allows one to capture the current sheet thinning during the growth phase. The model allows one to trace the substorm dipolarization from the tail to the inner magnetosphere where the dipolarization of strongly stretched tail field lines causes a redistribution of the tail current resulting in an enhancement of the partial ring current in the premidnight sector.
International Nuclear Information System (INIS)
Zhang, Xiao; Wang, Haifeng; Kuang, Wangwang; Zhang, Jianbao
2017-01-01
Modeling of non-equilibrium solidification in multi-component alloys is of singular importance in microstructure control, which however owing to the complex systems with complex additional constraints is still an open problem. In this work, the thermodynamic extremal principle was applied to solve the complex additional constraints self-consistently in thermodynamics. Consequently, short-range solute redistribution and long-range solute diffusion that share the same mobility are integrated naturally into the solute diffusion equations, thus avoiding the introduction of additional kinetic coefficients (e.g. interface permeability) to describe solute redistribution. Application to the non-equilibrium solidification of Al-Si-Cu alloys shows that anomalous solute trapping and anomalous solute profiles within the diffuse interface could occur, thus highlighting the important effect of the interaction among the component elements on the interface kinetics. The current phase-field model might be preferred for simulations not only because of its simplest form of evolution equations but also its feasibility to increase the simulation efficiency by the “thin interface limit” analysis.
International Nuclear Information System (INIS)
Gedik, Engin; Recebli, Ziyaddin; Kurt, Hueseyin; Kecebas, Ali
2012-01-01
The unsteady viscous incompressible and electrically conducting of two-phase fluid flow in circular pipes with external magnetic and electrical field is considered in this present study. Effects of both uniform transverse external magnetic and electrical fields applied perpendicular to the fluid and each other on the two-phase (solid/liquid) unsteady flow is investigated numerically. While iron powders are being used as the first phase of two-phase fluid, pure water was used as the second phase. The system of the derived governing equations, which are based on the Navier-Stokes equations including Maxwell equations, are solved numerically by using Pdex4 function on the Matlab for both phases. The originality of this study is that, in addition to magnetic field, the effect of electrical field on two-phase unsteady fluids is being examined. The magnetic field which is applied on flow decreases the velocity of both phases, whereas the electrical field applied along with magnetic field acted to increase and decrease the velocity values depending on the direction of electrical field. Electrical field alone did not display any impact on two-phase flow. On the other hand, analytical and numerical results are compared and favorable agreements have been obtained. (authors)
Wainwright, Carroll L.
2012-09-01
/undershoot method. The path iteratively deforms in the direction opposite the forces perpendicular to the path until the perpendicular forces vanish (or become very small). To find the phase structure, the program finds and integrates the change in a phase's minimum with respect to temperature.Running time: Approximately 1 minute for full analysis of the two-scalar-field test model on a 2.5 GHz CPU.
Two-phase electro-hydrodynamic flow modeling by a conservative level set model.
Lin, Yuan
2013-03-01
The principles of electro-hydrodynamic (EHD) flow have been known for more than a century and have been adopted for various industrial applications, for example, fluid mixing and demixing. Analytical solutions of such EHD flow only exist in a limited number of scenarios, for example, predicting a small deformation of a single droplet in a uniform electric field. Numerical modeling of such phenomena can provide significant insights about EHDs multiphase flows. During the last decade, many numerical results have been reported to provide novel and useful tools of studying the multiphase EHD flow. Based on a conservative level set method, the proposed model is able to simulate large deformations of a droplet by a steady electric field, which is beyond the region of theoretic prediction. The model is validated for both leaky dielectrics and perfect dielectrics, and is found to be in excellent agreement with existing analytical solutions and numerical studies in the literature. Furthermore, simulations of the deformation of a water droplet in decyl alcohol in a steady electric field match better with published experimental data than the theoretical prediction for large deformations. Therefore the proposed model can serve as a practical and accurate tool for simulating two-phase EHD flow. © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
The half-skyrmion phase in a chiral-quark model
International Nuclear Information System (INIS)
Mantovani Sarti, Valentina; Vento, Vicente
2014-01-01
The Chiral Dilaton Model, where baryons arise as non-topological solitons built from the interaction of quarks and chiral mesons, shows in the high density low temperature regime a two phase scenario in the nuclear matter phase diagram. Dense soliton matter described by the Wigner–Seitz approximation generates a periodic potential in terms of the sigma and pion fields that leads to the formation of a band structure. The analysis up to three times nuclear matter density shows that soliton matter undergoes two separate phase transitions: a delocalization of the baryon number density leading to B=1/2 structures, as in skyrmion matter, at moderate densities, and quark deconfinement at larger densities. This description fits well into the so-called quarkyonic phase where, before deconfinement, nuclear matter should undergo structural changes involving the restoration of fundamental symmetries of QCD
Tunable phase transition in single-layer TiSe2 via electric field
Liu, Lei; Zhuang, Houlong L.
2018-06-01
Phase transition represents an intriguing physical phenomenon that exists in a number of single-layer transition-metal dichalcogenides. This phenomenon often occurs below a critical temperature and breaks the long-range crystalline order leading to a reconstructed superstructure called the charge-density wave (CDW) structure, which can therefore be recovered by external stimuli such as temperature. Alternatively, we show here that another external stimulation, electric field can also result in the phase transition between the regular and CDW structures of a single-layer transition-metal dichalcogenide. We used single-layer TiSe2 as an example to elucidate the mechanism of the CDW followed by calculations of the electronic structure using a hybrid density functional. We found that applying electric field can tune the phase transition between the 1T and CDW phases of single-layer TiSe2. Our work opens up a route of tuning the phase transition of single-layer materials via electric field.
The Schwinger term and the Berry phase in simple models
International Nuclear Information System (INIS)
Grosse, H.
1989-01-01
We discuss quantization of fermions interacting with external fields and observe the occurrence of equivalent as well as inequivalent representations of the canonical anticommutation relations. Implementability of gauge and axial gauge transformations leads to generators which fulfill an algebra of charges with Schwinger term. This term can be written as a cocycle and leads to the boson-fermion correspondence. During an adiabatic transport along closed loops in a parameter space we may pick up a nonintegrable phase factor, usually called the Berry phase. We study the occurrence of such a topological phase in a model and give the parallel transport for density matrices. After second quantization one may pick up both a Berry phase and a Schwinger term. 13 refs. (Author)
Statistical mechanics of a multiconnected Hopfield neural-network model in a transverse field
International Nuclear Information System (INIS)
Ma, Y.; Gong, C.
1995-01-01
The Hopfield neural-network model with p-spin interactions in the presence of a transverse field is introduced and solved exactly in the limit p→∞. In the phase diagrams drawn as a function of the temperature, the important results such as reentrance are found, and the effects of the quantum fluctuations on the phase transitions, the retrieval phase, and the storage ratio α are examined
Diffeomorphisms as symplectomorphisms in history phase space: Bosonic string model
International Nuclear Information System (INIS)
Kouletsis, I.; Kuchar, K.V.
2002-01-01
The structure of the history phase space G of a covariant field system and its history group (in the sense of Isham and Linden) is analyzed on an example of a bosonic string. The history space G includes the time map T from the spacetime manifold (the two-sheet) Y to a one-dimensional time manifold T as one of its configuration variables. A canonical history action is posited on G such that its restriction to the configuration history space yields the familiar Polyakov action. The standard Dirac-ADM action is shown to be identical with the canonical history action, the only difference being that the underlying action is expressed in two different coordinate charts on G. The canonical history action encompasses all individual Dirac-ADM actions corresponding to different choices T of foliating Y. The history Poisson brackets of spacetime fields on G induce the ordinary Poisson brackets of spatial fields in the instantaneous phase space G 0 of the Dirac-ADM formalism. The canonical history action is manifestly invariant both under spacetime diffeomorphisms Diff Y and temporal diffeomorphisms Diff T. Both of these diffeomorphisms are explicitly represented by symplectomorphisms on the history phase space G. The resulting classical history phase space formalism is offered as a starting point for projection operator quantization and consistent histories interpretation of the bosonic string model
Three-Dimensional Electromagnetic Mixing Models for Dual-Phase Steel Microstructures
Directory of Open Access Journals (Sweden)
Weibin Zhou
2018-03-01
Full Text Available Linking the ferrite fraction in a dual-phase (DP steel microstructure and its electromagnetic properties is critical in the effort to develop on-line measurement techniques for phase transformation using electromagnetic (EM sensors. This paper developed a seamlessly integrated method for generating 3D microstructures and evaluating their equivalent permeability values. Both the generation of 3D microstructures and evaluation of equivalent permeability have been achieved through custom modelling packages developed by the authors. Voronoi modelling based on the random close packing of spheres (RCPS-VM was used to precisely control the ferrite fraction in DP steel microstructure, and an equivalent uniform field method for 3D finite element simulation was developed for efficient analysis.
Multicritical phase diagrams of the antiferromagnetic spin-3/2 Blume-Capel model
Energy Technology Data Exchange (ETDEWEB)
Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)]. E-mail: keskin@erciyes.edu.tr; Ali Pinar, M. [Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Erdinc, Ahmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Canko, Osman [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2006-04-24
The antiferromagnetic spin-3/2 Blume-Capel model in an external magnetic field is investigated, and the phase diagrams are obtained in detail by using the cluster variation method. The model exhibits distinct critical regions, including the first-order, second-order and special points: two double critical points, a critical end point, a tricritical point and a zero-temperature critical point. The new phase diagram topology is also found that was not obtained previously. Comparison of the results with those of other studies on this, and closely related systems, is made.
Multicritical phase diagrams of the antiferromagnetic spin-3/2 Blume-Capel model
International Nuclear Information System (INIS)
Keskin, Mustafa; Ali Pinar, M.; Erdinc, Ahmet; Canko, Osman
2006-01-01
The antiferromagnetic spin-3/2 Blume-Capel model in an external magnetic field is investigated, and the phase diagrams are obtained in detail by using the cluster variation method. The model exhibits distinct critical regions, including the first-order, second-order and special points: two double critical points, a critical end point, a tricritical point and a zero-temperature critical point. The new phase diagram topology is also found that was not obtained previously. Comparison of the results with those of other studies on this, and closely related systems, is made
A simple model for localized-itinerant magnetic systems: crystal field effects
International Nuclear Information System (INIS)
Iannarella, L.; Silva, X.A. da; Guimarares, A.P.
1989-01-01
The magnetic behavior of a system consisting of localized electrons coupled to conduction electrons and submitted to an axial crystral field at T=0 K is ivestigated within the framework of the molecular field approximation. An analytical ionic magnetic state equation is deduced; it shows how the magnetization depends on the model parameters (exchange, crystal field, band occupation) and external magnetic field. A condition for the onset of spontaneous magnetic order is obtained and the ferro - and paramagnetic phases are studied. This study displays several features of real magnetic systems, including quenching or total suppression of the magnetic moments (depending on the relative value of the crystal field parameter) and exchange enhacement. The relevance of such model for the description of rare-earth intermetallic compounds is discussed. (author) [pt
Topological phases of silicene and germanene in an external magnetic field: Quantitative results
Singh, Nirpendra; Schwingenschlö gl, Udo
2014-01-01
We investigate the topological phases of silicene and germanene that arise due to the strong spin-orbit interaction in an external perpendicular magnetic field. Below and above a critical field of 10 T, respectively, we demonstrate for silicene under 3% tensile strain quantum spin Hall and quantum anomalous Hall phases. Not far above the critical field, and therefore in the experimentally accessible regime, we obtain an energy gap in the meV range, which shows that the quantum anomalous Hall phase can be realized experimentally in silicene, in contrast to graphene (tiny energy gap) and germanene (enormous field required). © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
Topological phases of silicene and germanene in an external magnetic field: Quantitative results
Singh, Nirpendra
2014-03-17
We investigate the topological phases of silicene and germanene that arise due to the strong spin-orbit interaction in an external perpendicular magnetic field. Below and above a critical field of 10 T, respectively, we demonstrate for silicene under 3% tensile strain quantum spin Hall and quantum anomalous Hall phases. Not far above the critical field, and therefore in the experimentally accessible regime, we obtain an energy gap in the meV range, which shows that the quantum anomalous Hall phase can be realized experimentally in silicene, in contrast to graphene (tiny energy gap) and germanene (enormous field required). © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
Effective field study of ising model on a double perovskite structure
Energy Technology Data Exchange (ETDEWEB)
Ngantso, G. Dimitri; El Amraoui, Y. [LMPHE, (URAC 12), Faculté des Sciences, Université Mohammed V, Rabat (Morocco); Benyoussef, A. [LMPHE, (URAC 12), Faculté des Sciences, Université Mohammed V, Rabat (Morocco); Center of Materials and Nanomaterials, MAScIR, Rabat (Morocco); Hassan II Academy of Science and Technology, Rabat (Morocco); El Kenz, A., E-mail: elkenz@fsr.ac.ma [LMPHE, (URAC 12), Faculté des Sciences, Université Mohammed V, Rabat (Morocco)
2017-02-01
By using the effective field theory (EFT), the mixed spin-1/2 and spin-3/2 Ising ferrimagnetic model adapted to a double perovskite structure has been studied. The EFT calculations have been carried out from Ising Hamiltonian by taking into account first and second nearest-neighbors interactions and the crystal and external magnetic fields. Both first- and second-order phase transitions have been found in phase diagrams of interest. Depending on crystal-field values, the thermodynamic behavior of total magnetization indicated the compensation phenomenon existence. The hysteresis behaviors are studied by investigating the reduced magnetic field dependence of total magnetization and a series of hysteresis loops are shown for different reduced temperatures around the critical one. - Highlights: • Magnetic properties of double perovskite Structure have been studied. • Compensation temperature has been observed below the critical temperature. • Hysteresis behaviors have been studied.
Effective field study of ising model on a double perovskite structure
International Nuclear Information System (INIS)
Ngantso, G. Dimitri; El Amraoui, Y.; Benyoussef, A.; El Kenz, A.
2017-01-01
By using the effective field theory (EFT), the mixed spin-1/2 and spin-3/2 Ising ferrimagnetic model adapted to a double perovskite structure has been studied. The EFT calculations have been carried out from Ising Hamiltonian by taking into account first and second nearest-neighbors interactions and the crystal and external magnetic fields. Both first- and second-order phase transitions have been found in phase diagrams of interest. Depending on crystal-field values, the thermodynamic behavior of total magnetization indicated the compensation phenomenon existence. The hysteresis behaviors are studied by investigating the reduced magnetic field dependence of total magnetization and a series of hysteresis loops are shown for different reduced temperatures around the critical one. - Highlights: • Magnetic properties of double perovskite Structure have been studied. • Compensation temperature has been observed below the critical temperature. • Hysteresis behaviors have been studied.
The MARTINI force field : Coarse grained model for biomolecular simulations
Marrink, Siewert J.; Risselada, H. Jelger; Yefimov, Serge; Tieleman, D. Peter; de Vries, Alex H.
2007-01-01
We present an improved and extended version of our coarse grained lipid model. The new version, coined the MARTINI force field, is parametrized in a systematic way, based on the reproduction of partitioning free energies between polar and apolar phases of a large number of chemical compounds. To
The quantum-field renormalization group in the problem of a growing phase boundary
International Nuclear Information System (INIS)
Antonov, N.V.; Vasil'ev, A.N.
1995-01-01
Within the quantum-field renormalization-group approach we examine the stochastic equation discussed by S.I. Pavlik in describing a randomly growing phase boundary. We show that, in contrast to Pavlik's assertion, the model is not multiplicatively renormalizable and that its consistent renormalization-group analysis requires introducing an infinite number of counterterms and the respective coupling constants (open-quotes chargeclose quotes). An explicit calculation in the one-loop approximation shows that a two-dimensional surface of renormalization-group points exits in the infinite-dimensional charge space. If the surface contains an infrared stability region, the problem allows for scaling with the nonuniversal critical dimensionalities of the height of the phase boundary and time, δ h and δ t , which satisfy the exact relationship 2 δ h = δ t + d, where d is the dimensionality of the phase boundary. 23 refs., 1 tab
Kinetics of the spin-2 Blume-Capel model under a time-dependent oscillating external field
International Nuclear Information System (INIS)
Keskin, M.; Canko, O.; Ertas, M.
2007-01-01
Within a mean-field approach and using the Glauber-type stochastic dynamics, we study the kinetics of the spin-2 Blume-Capel model in the presence of a time-varying (sinusoidal) magnetic field. We investigate the time dependence of the average order parameter and the behavior of the average order parameter in a period, which is also called the dynamic order parameter, as a function of the reduced temperature. The nature (continuous and discontinuous) of the transition is characterized by the dynamic order parameter. The dynamic phase transition points are obtained and the phase diagrams are presented in the reduced magnetic field amplitude and reduced temperature plane. The phase diagrams exhibit one dynamic tricritical point; besides a disordered and an ordered phases, there are three phase coexistence regions that are strongly dependent on the interaction parameter
Energy Technology Data Exchange (ETDEWEB)
Ding, L.J., E-mail: dinglinjie82@126.com; Zhong, Y.
2017-07-15
Highlights: • The quantum critical scaling is investigated by Green’s function theory. • The obtained power-law critical exponents (β, δ and α) obey the critical scaling relation α + β(1 + δ) = 2. • The scaling hypothesis equations are proposed to verify the scaling analysis. - Abstract: The quantum phase transition and thermodynamics of a periodic Anderson-like polymer chain in a magnetic field are investigated by Green’s function theory. The T-h phase diagram is explored, wherein a crossover temperature T{sup ∗} denoting the gapless phase crossover into quantum critical regimes, smoothly connects near the critical fields to the universal linear line T{sup ∗} ∼ (h − h{sub c,s}), and ends at h{sub c,s}, providing a new route to capture quantum critical point (QCP). The quantum critical scaling around QCPs is demonstrated by analyzing magnetization, specific heat and Grüneisen parameter Γ{sub h}, which provide direct access to distill the power-law critical exponents (β, δ and α) obeying the critical scaling relation α + β(1 + δ) = 2, analogous to the quantum spin system. Furthermore, scaling hypothesis equations are proposed to check the scaling analysis, for which all the data collapse onto a single curve or two independent branches for the plot against an appropriate scaling variable, indicating the self-consistency and reliability of the obtained critical exponents.
Energy Technology Data Exchange (ETDEWEB)
Wang Zunjing; Deserno, Markus, E-mail: zwang@cmu.ed, E-mail: deserno@andrew.cmu.ed [Department of Physics, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213 (United States)
2010-09-15
We study the lipid and phase transferability of our recently developed systematically coarse-grained solvent-free membrane model. The force field was explicitly parameterized to describe a fluid 1-palmitoyl-2-oleoyl-phosphatidylcholine (POPC) bilayer at 310 K with correct structure and area per lipid, while gaining at least three orders of magnitude in computational efficiency (see Wang and Deserno 2010 J. Phys. Chem. B 114 11207-20). Here, we show that exchanging CG tails, without any subsequent re-parameterization, creates reliable models of 1,2-dioleoylphosphatidylcholine (DOPC) and 1,2-dipalmitoylphosphatidylcholine (DPPC) lipids in terms of structure and area per lipid. Furthermore, all CG lipids undergo a liquid-gel transition upon cooling, with characteristics like those observed in experiments and all-atom simulations during phase transformation. These studies suggest a promising transferability of our force field parameters to different lipid species and thermodynamic state points, properties that are a prerequisite for even more complex systems, such as mixtures.
International Nuclear Information System (INIS)
Wang Zunjing; Deserno, Markus
2010-01-01
We study the lipid and phase transferability of our recently developed systematically coarse-grained solvent-free membrane model. The force field was explicitly parameterized to describe a fluid 1-palmitoyl-2-oleoyl-phosphatidylcholine (POPC) bilayer at 310 K with correct structure and area per lipid, while gaining at least three orders of magnitude in computational efficiency (see Wang and Deserno 2010 J. Phys. Chem. B 114 11207-20). Here, we show that exchanging CG tails, without any subsequent re-parameterization, creates reliable models of 1,2-dioleoylphosphatidylcholine (DOPC) and 1,2-dipalmitoylphosphatidylcholine (DPPC) lipids in terms of structure and area per lipid. Furthermore, all CG lipids undergo a liquid-gel transition upon cooling, with characteristics like those observed in experiments and all-atom simulations during phase transformation. These studies suggest a promising transferability of our force field parameters to different lipid species and thermodynamic state points, properties that are a prerequisite for even more complex systems, such as mixtures.
Field induced magnetic quantum critical behavior in the Kondo necklace model
International Nuclear Information System (INIS)
Reyes, Daniel; Continentino, Mucio
2008-01-01
The Kondo necklace model augmented by a Zeeman term, serves as a useful model for heavy fermion compounds in an applied magnetic field. The phase diagram and thermodynamic behavior for arbitrary dimensions d has been investigated previously in the zero field case [D. Reyes, M. Continentino, Phys. Rev. B 76 (2007) 075114. ]. Here we extend the treatment to finite fields using a generalized bond operator representation for the localized and conduction electrons spins. A decoupling scheme on the double time Green's functions yields the dispersion relation for the excitations of the system. Two critical magnetic fields are found namely, a critical magnetic field called henceforth h c1 and a saturation field nominated h c2 . Then three important regions can be investigated: (i) Kondo spin liquid state (KSL) at low fields h c1 ; (ii) destruction of KSL state at h≥h c1 and appearance of a antiferromagnetic state; and (iii) saturated paramagnetic region above the upper critical field h c2
Mathematical model of phase transformations in thermo-chemical cathodes with zirconium insertion
International Nuclear Information System (INIS)
Kavokin, A.A.; Kazmi, I.H.
2007-01-01
The mathematical model of thermo-chemical processes in the cathode of plasmatron working in the gas environment is investigated. The model describes electromagnetic, temperature and concentration fields taking into account kinetic of phase transformation and chemical reaction in accordance with a state diagram. The offered approach is simpler than the Stefan's approach of describing an analogical phase transformation. As an example the case of copper cathodes with the zirconium insertion in the environment of oxygen is considered. The influence of separate parts of process on distribution of temperature inside of the insertion is estimated. On the basis of this analysis the opportunity of use of stationary approach for electric and temperature fields is shown and analytical formulas for temperature are received. After that a numerical solution for gas concentration distribution is obtained. The calculations on the specified model show that the size of area of a phase zirconium oxides depends mainly upon coefficient of diffusion of oxygen. The calculations for various types of dependencies of gas diffusion coefficient from temperature are concluded. The results of calculations develop understanding of some features of oxidation process of a zirconium insertion. Typical example of multi phase process model is the mathematical description of a heat and mass transfer occurring in metal which is being heated by an electric arch in the gas medium (1, 2, 4). The macroscopic model of physical and chemical transformations can be described as follows (3). As a metal is heated on the surface of an electrode as a function of rising results in the border dividing solid and liquid phases moves ahead deep into the electrode. At the same time there is a diffusion of gas in electrode and formation of new chemical compounds which can noticeably differ in the physical and chemical properties from each other and metal of the electrode. Moreover we shall name a phase of substance not
Field Model: An Object-Oriented Data Model for Fields
Moran, Patrick J.
2001-01-01
We present an extensible, object-oriented data model designed for field data entitled Field Model (FM). FM objects can represent a wide variety of fields, including fields of arbitrary dimension and node type. FM can also handle time-series data. FM achieves generality through carefully selected topological primitives and through an implementation that leverages the potential of templated C++. FM supports fields where the nodes values are paired with any cell type. Thus FM can represent data where the field nodes are paired with the vertices ("vertex-centered" data), fields where the nodes are paired with the D-dimensional cells in R(sup D) (often called "cell-centered" data), as well as fields where nodes are paired with edges or other cell types. FM is designed to effectively handle very large data sets; in particular FM employs a demand-driven evaluation strategy that works especially well with large field data. Finally, the interfaces developed for FM have the potential to effectively abstract field data based on adaptive meshes. We present initial results with a triangular adaptive grid in R(sup 2) and discuss how the same design abstractions would work equally well with other adaptive-grid variations, including meshes in R(sup 3).
Three-dimensional propagation in near-field tomographic X-ray phase retrieval
International Nuclear Information System (INIS)
Ruhlandt, Aike; Salditt, Tim
2016-01-01
An extension of phase retrieval algorithms for near-field X-ray (propagation) imaging to three dimensions is presented, enhancing the quality of the reconstruction by exploiting previously unused three-dimensional consistency constraints. This paper presents an extension of phase retrieval algorithms for near-field X-ray (propagation) imaging to three dimensions, enhancing the quality of the reconstruction by exploiting previously unused three-dimensional consistency constraints. The approach is based on a novel three-dimensional propagator and is derived for the case of optically weak objects. It can be easily implemented in current phase retrieval architectures, is computationally efficient and reduces the need for restrictive prior assumptions, resulting in superior reconstruction quality
DEFF Research Database (Denmark)
Fatnassi, Chemseddine; Boucenna, Rachid; Zaidi, Habib
2017-01-01
PURPOSE: In 3D gradient echo magnetic resonance imaging (MRI), strong field gradients B0macro are visually observed at air/tissue interfaces. At low spatial resolution in particular, the respective field gradients lead to an apparent increase in intravoxel dephasing, and subsequently, to signal...... loss or inaccurate R2* estimates. If the strong field gradients are measured, their influence can be removed by postprocessing. METHODS: Conventional corrections usually assume a linear phase evolution with time. For high macroscopic gradient inhomogeneities near the edge of the brain...
Wang, Ce-Qun; Chen, Qiang; Zhang, Lu; Xu, Jia-Min; Lin, Long-Nian
2014-12-25
The purpose of this article is to introduce the measurements of phase coupling between spikes and rhythmic oscillations of local field potentials (LFPs). Multi-channel in vivo recording techniques allow us to record ensemble neuronal activity and LFPs simultaneously from the same sites in the brain. Neuronal activity is generally characterized by temporal spike sequences, while LFPs contain oscillatory rhythms in different frequency ranges. Phase coupling analysis can reveal the temporal relationships between neuronal firing and LFP rhythms. As the first step, the instantaneous phase of LFP rhythms can be calculated using Hilbert transform, and then for each time-stamped spike occurred during an oscillatory epoch, we marked instantaneous phase of the LFP at that time stamp. Finally, the phase relationships between the neuronal firing and LFP rhythms were determined by examining the distribution of the firing phase. Phase-locked spikes are revealed by the non-random distribution of spike phase. Theta phase precession is a unique phase relationship between neuronal firing and LFPs, which is one of the basic features of hippocampal place cells. Place cells show rhythmic burst firing following theta oscillation within a place field. And phase precession refers to that rhythmic burst firing shifted in a systematic way during traversal of the field, moving progressively forward on each theta cycle. This relation between phase and position can be described by a linear model, and phase precession is commonly quantified with a circular-linear coefficient. Phase coupling analysis helps us to better understand the temporal information coding between neuronal firing and LFPs.
Phase separation and shape deformation of two-phase membranes
International Nuclear Information System (INIS)
Jiang, Y.; Lookman, T.; Saxena, A.
2000-01-01
Within a coupled-field Ginzburg-Landau model we study analytically phase separation and accompanying shape deformation on a two-phase elastic membrane in simple geometries such as cylinders, spheres, and tori. Using an exact periodic domain wall solution we solve for the shape and phase separating field, and estimate the degree of deformation of the membrane. The results are pertinent to preferential phase separation in regions of differing curvature on a variety of vesicles. (c) 2000 The American Physical Society
Effect of grain size on void swelling in irradiated materials: A phase-field approach
International Nuclear Information System (INIS)
Chang, Kunok; Lee, Gyeonggeun; Kwon, Junhyun
2014-01-01
The progress of swelling is retarded as the average grain diameter increases in a pure copper case. Within the framework of the production bias model (PBM), their experimental results were quantitatively explained. The phase-field method has already been used to investigate the void/bubble behavior in the irradiated materials. In particular, Millett et al. already incorporated the interaction between the point defect and the grain boundary in their study. Therefore, they described the void denuded zones and void peaked zones adjacent to the grain boundaries, which are already observed in the experimental investigations. We performed the phase-field simulation in order to verify the role of the grain diameter on the void swelling in the cascade damage condition. In addition, our results will be compared with the experimental observations or the theoretical works, such as PBM. Two-dimensional phase-field simulations were performed to investigate the void swelling process in the irradiated materials. We clearly observed the void denuded and void peaked zones, which were already observed in formal experimental and computational approaches. We also found that the progress of swelling was retarded as the average grain diameter increased. The triple junctions, which are believed to be a critical factor t affecting the fracture, are the main cites for the void nucleation and growth in our simulations
Two-field and drift-flux models with application to nuclear reactor safety
International Nuclear Information System (INIS)
Travis, J.R.
1986-01-01
The ideas of the two-field (6 equation model) and drift-flux (4 equation model) description of two-phase flows are presented. Several example calculations relating to reactor safety are discussed and comparisons of the numerical results and experimental data are shown to be in good agreement. 16 refs., 32 figs
International Nuclear Information System (INIS)
Carl Stern; Martin Lee
1999-01-01
Phase I work studied the feasibility of developing software for automatic component calibration and error correction in beamline optics models. A prototype application was developed that corrects quadrupole field strength errors in beamline models
Carl-Stern
1999-01-01
Phase I work studied the feasibility of developing software for automatic component calibration and error correction in beamline optics models. A prototype application was developed that corrects quadrupole field strength errors in beamline models.
International Nuclear Information System (INIS)
Blanc, V.; Barbie, L.; Masson, R.
2011-01-01
Homogenization of linear viscoelastic heterogeneous media is here extended from two phase inclusion-matrix media to three phase inclusion-matrix media. Each phase obeying to a compressible Maxwellian behaviour, this analytic method leads to an equivalent elastic homogenization problem in the Laplace-Carson space. For some particular microstructures, such as the Hashin composite sphere assemblage, an exact solution is obtained. The inversion of the Laplace-Carson transforms of the overall stress-strain behaviour gives in such cases an internal variable formulation. As expected, the number of these internal variables and their evolution laws are modified to take into account the third phase. Moreover, evolution laws of averaged stresses and strains per phase can still be derived for three phase media. Results of this model are compared to full fields computations of representative volume elements using finite element method, for various concentrations and sizes of inclusion. Relaxation and creep test cases are performed in order to compare predictions of the effective response. The internal variable formulation is shown to yield accurate prediction in both cases. (authors)
Li, Heyang Thomas; Kingston, Andrew M; Myers, Glenn R; Beeching, Levi; Sheppard, Adrian P
2018-01-01
Near-field x-ray refraction (phase) contrast is unavoidable in many lab-based micro-CT imaging systems. Quantitative analysis of x-ray refraction (a.k.a. phase retrieval) is in general an under-constrained problem. Regularizing assumptions may not hold true for interesting samples; popular single-material methods are inappropriate for heterogeneous samples, leading to undesired blurring and/or over-sharpening. In this paper, we constrain and solve the phase-retrieval problem for heterogeneous objects, using the Alvarez-Macovski model for x-ray attenuation. Under this assumption we neglect Rayleigh scattering and pair production, considering only Compton scattering and the photoelectric effect. We formulate and test the resulting method to extract the material properties of density and atomic number from single-distance, dual-energy imaging of both strongly and weakly attenuating multi-material objects with polychromatic x-ray spectra. Simulation and experimental data are used to compare our proposed method with the Paganin single-material phase-retrieval algorithm, and an innovative interpretation of the data-constrained modeling phase-retrieval technique.
A Semi-implicit Numerical Scheme for a Two-dimensional, Three-field Thermo-Hydraulic Modeling
International Nuclear Information System (INIS)
Hwang, Moonkyu; Jeong, Jaejoon
2007-07-01
The behavior of two-phase flow is modeled, depending on the purpose, by either homogeneous model, drift flux model, or separated flow model, Among these model, in the separated flow model, the behavior of each flow phase is modeled by its own governing equation, together with the interphase models which describe the thermal and mechanical interactions between the phases involved. In this study, a semi-implicit numerical scheme for two-dimensional, transient, two-fluid, three-field is derived. The work is an extension to the previous study for the staggered, semi-implicit numerical scheme in one-dimensional geometry (KAERI/TR-3239/2006). The two-dimensional extension is performed by specifying a relevant governing equation set and applying the related finite differencing method. The procedure for employing the semi-implicit scheme is also described in detail. Verifications are performed for a 2-dimensional vertical plate for a single-phase and two-phase flows. The calculations verify the mass and energy conservations. The symmetric flow behavior, for the verification problem, also confirms the momentum conservation of the numerical scheme
Modelling of imploding phase of thin-film liners
International Nuclear Information System (INIS)
Savic, P.; Gupta, R.P.; Kekez, M.M.; Lau, J.H.; Lougheed, G.D.
1983-01-01
Theoretical models for thin-film implosions in vacuum are proposed for theta and Z-geometries in this paper, in order to develop a high-energy XUV source. In the present study, attention is confined to the implosion phase. The authors consider the plasma to be perfectly conducting and to have a frozen magnetic field resulting in a modified magnatoacoustic wave speed. An attempt is made to find to what extend the present treatment differs from detailed numerical analysis
Critical behavior of mean-field hadronic models for warm nuclear matter
International Nuclear Information System (INIS)
Silva, J.B.; Lourenco, O.; Delfino, A.; Martins, J.S. Sa; Dutra, M.
2008-01-01
We study a set of hadronic mean-field models in the liquid-gas phase transition regime and calculate their critical parameters. The discussion is unified by scaling the coexistence curves in terms of these critical parameters. We study the models close to spinodal points, where they also present critical behavior. Inspired by signals of criticality shown in fragmentation experiments, we analyze two different scenarios in which such behavior would be expected: (i) the stability limits of a metastable system with vanishing external pressure; and (ii) the critical point of a gas-liquid phase equilibrium system for which the Maxwell construction applies. Spinodal and coexistence curves show the regions in which model dependence arises. Unexpectedly, this model dependence does not manifest if one calculates the thermal incompressibility of the models
Extracting flat-field images from scene-based image sequences using phase correlation
Energy Technology Data Exchange (ETDEWEB)
Caron, James N., E-mail: Caron@RSImd.com [Research Support Instruments, 4325-B Forbes Boulevard, Lanham, Maryland 20706 (United States); Montes, Marcos J. [Naval Research Laboratory, Code 7231, 4555 Overlook Avenue, SW, Washington, DC 20375 (United States); Obermark, Jerome L. [Naval Research Laboratory, Code 8231, 4555 Overlook Avenue, SW, Washington, DC 20375 (United States)
2016-06-15
Flat-field image processing is an essential step in producing high-quality and radiometrically calibrated images. Flat-fielding corrects for variations in the gain of focal plane array electronics and unequal illumination from the system optics. Typically, a flat-field image is captured by imaging a radiometrically uniform surface. The flat-field image is normalized and removed from the images. There are circumstances, such as with remote sensing, where a flat-field image cannot be acquired in this manner. For these cases, we developed a phase-correlation method that allows the extraction of an effective flat-field image from a sequence of scene-based displaced images. The method uses sub-pixel phase correlation image registration to align the sequence to estimate the static scene. The scene is removed from sequence producing a sequence of misaligned flat-field images. An average flat-field image is derived from the realigned flat-field sequence.
A multi-species exchange model for fully fluctuating polymer field theory simulations.
Düchs, Dominik; Delaney, Kris T; Fredrickson, Glenn H
2014-11-07
Field-theoretic models have been used extensively to study the phase behavior of inhomogeneous polymer melts and solutions, both in self-consistent mean-field calculations and in numerical simulations of the full theory capturing composition fluctuations. The models commonly used can be grouped into two categories, namely, species models and exchange models. Species models involve integrations of functionals that explicitly depend on fields originating both from species density operators and their conjugate chemical potential fields. In contrast, exchange models retain only linear combinations of the chemical potential fields. In the two-component case, development of exchange models has been instrumental in enabling stable complex Langevin (CL) simulations of the full complex-valued theory. No comparable stable CL approach has yet been established for field theories of the species type. Here, we introduce an extension of the exchange model to an arbitrary number of components, namely, the multi-species exchange (MSE) model, which greatly expands the classes of soft material systems that can be accessed by the complex Langevin simulation technique. We demonstrate the stability and accuracy of the MSE-CL sampling approach using numerical simulations of triblock and tetrablock terpolymer melts, and tetrablock quaterpolymer melts. This method should enable studies of a wide range of fluctuation phenomena in multiblock/multi-species polymer blends and composites.
DEFF Research Database (Denmark)
Aagesen, L.K.; Fife, J.L.; Lauridsen, Erik Mejdal
2011-01-01
The evolution of the solid–liquid interface in an Al–Cu dendritic microstructure is predicted using a phase-field model and compared to experimental data. The interfacial velocities are measured during isothermal coarsening using in situ X-ray tomographic microscopy. Good qualitative agreement...
Phase transitions induced by the Aharonov-Bohm field
International Nuclear Information System (INIS)
Krive, I.V.; Naftulin, S.A.
1990-07-01
The influence of the Aharonov-Bohm flux (φ) on the order parameters of the 3-dimensional Gross-Neveu model and CP N -model in R 2 xS 1 space is considered. It is shown that the variation of flux causes the order parameter oscillations and for the small enough length of circular coordinate l c these oscillations attended with re-ordering phase transitions (i.e. the repeating transitions between the ordered and the disordered phases of the models in question). (author). 22 refs, 3 figs
Quantum field theory and phase transitions: universality and renormalization group
International Nuclear Information System (INIS)
Zinn-Justin, J.
2003-08-01
In the quantum field theory the problem of infinite values has been solved empirically through a method called renormalization, this method is satisfying only in the framework of renormalization group. It is in the domain of statistical physics and continuous phase transitions that these issues are the easiest to discuss. Within the framework of a course in theoretical physics the author introduces the notions of continuous limits and universality in stochastic systems operating with a high number of freedom degrees. It is shown that quasi-Gaussian and mean field approximation are unable to describe phase transitions in a satisfying manner. A new concept is required: it is the notion of renormalization group whose fixed points allow us to understand universality beyond mean field. The renormalization group implies the idea that long distance correlations near the transition temperature might be described by a statistical field theory that is a quantum field in imaginary time. Various forms of renormalization group equations are presented and solved in particular boundary limits, namely for fields with high numbers of components near the dimensions 4 and 2. The particular case of exact renormalization group is also introduced. (A.C.)
Energy Technology Data Exchange (ETDEWEB)
Li, Yulan; Hu, Shenyang Y.; Montgomery, Robert O.; Gao, Fei; Sun, Xin
2012-05-30
Experiments show that inter-granular and intra-granular gas bubbles have different growth kinetics which results in heterogeneous gas bubble microstructures in irradiated nuclear fuels. A science-based model predicting the heterogeneous microstructure evolution kinetics is desired, which enables one to study the effect of thermodynamic and kinetic properties of the system on gas bubble microstructure evolution kinetics and morphology, improve the understanding of the formation mechanisms of heterogeneous gas bubble microstructure, and provide the microstructure to macroscale approaches to study their impact on thermo-mechanical properties such as thermo-conductivity, gas release, volume swelling, and cracking. In our previous report 'Mesoscale Benchmark Demonstration, Problem 1: Mesoscale Simulations of Intra-granular Fission Gas Bubbles in UO2 under Post-irradiation Thermal Annealing', we developed a phase-field model to simulate the intra-granular gas bubble evolution in a single crystal during post-irradiation thermal annealing. In this work, we enhanced the model by incorporating thermodynamic and kinetic properties at grain boundaries, which can be obtained from atomistic simulations, to simulate fission gas bubble growth kinetics in polycrystalline UO2 fuels. The model takes into account of gas atom and vacancy diffusion, vacancy trapping and emission at defects, gas atom absorption and resolution at gas bubbles, internal pressure in gas bubbles, elastic interaction between defects and gas bubbles, and the difference of thermodynamic and kinetic properties in matrix and grain boundaries. We applied the model to simulate gas atom segregation at grain boundaries and the effect of interfacial energy and gas mobility on gas bubble morphology and growth kinetics in a bi-crystal UO2 during post-irradiation thermal annealing. The preliminary results demonstrate that the model can produce the equilibrium thermodynamic properties and the morphology of gas
Microstructural modelling of nuclear graphite using multi-phase models
International Nuclear Information System (INIS)
Berre, C.; Fok, S.L.; Marsden, B.J.; Mummery, P.M.; Marrow, T.J.; Neighbour, G.B.
2008-01-01
This paper presents a new modelling technique using three-dimensional multi-phase finite element models in which meshes representing the microstructure of thermally oxidised nuclear graphite were generated from X-ray micro-tomography images. The density of the material was related to the image greyscale using Beer-Lambert's law, and multiple phases could thus be defined. The local elastic and non-linear properties of each phase were defined as a function of density and changes in Young's modulus, tensile and compressive strength with thermal oxidation were calculated. Numerical predictions compared well with experimental data and with other numerical results obtained using two-phase models. These models were found to be more representative of the actual microstructure of the scanned material than two-phase models and, possibly because of pore closure occurring during compression, compressive tests were also predicted to be less sensitive to the microstructure geometry than tensile tests
Silaev, Mihail; Winyard, Thomas; Babaev, Egor
2018-05-01
The London model describes strongly type-2 superconductors as massive vector field theories, where the magnetic field decays exponentially at the length scale of the London penetration length. This also holds for isotropic multiband extensions, where the presence of multiple bands merely renormalizes the London penetration length. We show that, by contrast, the magnetic properties of anisotropic multiband London models are not this simple, and the anisotropy leads to the interband phase differences becoming coupled to the magnetic field. This results in the magnetic field in such systems having N +1 penetration lengths, where N is the number of field components or bands. That is, in a given direction, the magnetic field decay is described by N +1 modes with different amplitudes and different decay length scales. For certain anisotropies we obtain magnetic modes with complex masses. That means that magnetic field decay is not described by a monotonic exponential increment set by a real penetration length but instead is oscillating. Some of the penetration lengths are shown to diverge away from the superconducting phase transition when the mass of the phase-difference mode vanishes. Finally the anisotropy-driven hybridization of the London mode with the Leggett modes can provide an effectively nonlocal magnetic response in the nominally local London model. Focusing on the two-component model, we discuss the magnetic field inversion that results from the effective nonlocality, both near the surface of the superconductor and around vortices. In the regime where the magnetic field decay becomes nonmonotonic, the multiband London superconductor is shown to form weakly-bound states of vortices.
Multiphysics modeling of two-phase film boiling within porous corrosion deposits
Energy Technology Data Exchange (ETDEWEB)
Jin, Miaomiao, E-mail: mmjin@mit.edu; Short, Michael, E-mail: hereiam@mit.edu
2016-07-01
Porous corrosion deposits on nuclear fuel cladding, known as CRUD, can cause multiple operational problems in light water reactors (LWRs). CRUD can cause accelerated corrosion of the fuel cladding, increase radiation fields and hence greater exposure risk to plant workers once activated, and induce a downward axial power shift causing an imbalance in core power distribution. In order to facilitate a better understanding of CRUD's effects, such as localized high cladding surface temperatures related to accelerated corrosion rates, we describe an improved, fully-coupled, multiphysics model to simulate heat transfer, chemical reactions and transport, and two-phase fluid flow within these deposits. Our new model features a reformed assumption of 2D, two-phase film boiling within the CRUD, correcting earlier models' assumptions of single-phase coolant flow with wick boiling under high heat fluxes. This model helps to better explain observed experimental values of the effective CRUD thermal conductivity. Finally, we propose a more complete set of boiling regimes, or a more detailed mechanism, to explain recent CRUD deposition experiments by suggesting the new concept of double dryout specifically in thick porous media with boiling chimneys. - Highlights: • A two-phase model of CRUD's effects on fuel cladding is developed and improved. • This model eliminates the formerly erroneous assumption of wick boiling. • Higher fuel cladding temperatures are predicted when accounting for two-phase flow. • Double-peaks in thermal conductivity vs. heat flux in experiments are explained. • A “double dryout” mechanism in CRUD is proposed based on the model and experiments.
International Nuclear Information System (INIS)
Vasconcelos Dos Santos, R.J.; Coutinho, S.
1995-01-01
The effect of a local field acting on decorating classical D-vector bond spins of an antiferromagnetic Ising model on the square lattice is studied for both the annealed isotropic and the axial decorated cases. In both models the effect on the phase diagrams of the transversal and the longitudinal components of the local field acting on the decorating spins are fully analyzed and discussed
Energy Technology Data Exchange (ETDEWEB)
Marzola, Luca; Racioppi, Antonio; Vaskonen, Ville [National Institute of Chemical Physics and Biophysics, Tallinn (Estonia)
2017-07-15
Thermal corrections in classically conformal models typically induce a strong first-order electroweak phase transition, thereby resulting in a stochastic gravitational background that could be detectable at gravitational wave observatories. After reviewing the basics of classically conformal scenarios, in this paper we investigate the phase transition dynamics in a thermal environment and the related gravitational wave phenomenology within the framework of scalar conformal extensions of the Standard Model. We find that minimal extensions involving only one additional scalar field struggle to reproduce the correct phase transition dynamics once thermal corrections are accounted for. Next-to-minimal models, instead, yield the desired electroweak symmetry breaking and typically result in a very strong gravitational wave signal. (orig.)
The questions of liquid metal two-phase flow modelling in the FBR core channels
International Nuclear Information System (INIS)
Martsiniouk, D.Ye.; Sorokin, A.P.
2000-01-01
The two-fluid model representation for calculations of two-phase flow characteristics in the FBR fuel pin bundles with liquid metal cooling is presented and analysed. Two conservation equations systems of the mass, momentum and energy have been written for each phase. Components accounted the mass-, momentum- and heat transfer throughout the interface occur in the macro-field equations after the averaging procedure realisation. The pattern map and correlations for two-fluid model in vertical liquid metal flows are presented. The description of processes interphase mass- and heat exchange and interphase friction is determined by the two-phase flow regime. The opportunity of the liquid metal two-phase flow regime definition is analysed. (author)
An order-by-disorder process in the cyclic phase of spin-2 condensate with a weak magnetic field
International Nuclear Information System (INIS)
Zheng, Gong-Ping; Xu, Lei-Kuan; Qin, Shuai-Feng; Jian, Wen-Tian; Liang, J.-Q.
2013-01-01
We present in this paper a model study on the “order-by-disorder” process in the cyclic phase of spin-2 condensate, which forms a family of incommensurable, spiral degenerate ground states. On the basis of the ordering mechanism of entropic splitting, it is demonstrated that the energy corrections resulting from quantum fluctuations of disorder lift the accidental degeneracy of the cyclic configurations and thus lead to an eventual spiral order called the cyclic order. The order-by-disorder phenomenon is then realized even if the magnetic field exists. Finally, we show that our theoretic observations can be verified experimentally by direct detection of the cyclic order in the 87 Rb condensate of a spin-2 manifold with a weak magnetic field. -- Highlights: •A model for the order-by-disorder process in the cyclic phase of spin-2 condensate is presented. •The second-order quantum fluctuations of the mean-field states are studied. •The energy corrections lift the accidental degeneracy of the cyclic configurations. •The order-by-disorder phenomenon is realized even if a magnetic field exists. •The theoretic observations can be verified experimentally for 87 Rb condensate
International Nuclear Information System (INIS)
Siquieri, R; Emmerich, H; Doernberg, E; Schmid-Fetzer, R
2009-01-01
In this work we present experimental and theoretical investigations of the directional solidification of Al-36 wt% Ni alloy. A phase-field approach (Folch and Plapp 2005 Phys. Rev. E 72 011602) is coupled with the CALPHAD (calculation of phase diagrams) method to be able to simulate directional solidification of Al-Ni alloy including the peritectic phase Al 3 Ni. The model approach is calibrated by systematic comparison to microstructures grown under controlled conditions in directional solidification experiments. To illustrate the efficiency of the model it is employed to investigate the effect of temperature gradient on the microstructure evolution of Al-36 wt% Ni during solidification.
Modelling gamma-ray light curves of phase-aligned millisecond pulsars
Chang, Shan; Zhang, Li; Li, Xiang; Jiang, Zejun
2018-04-01
Three gamma-ray millisecond pulsars (MSPs), PSR J1939+2134, PSR J1959+2048, and PSR J0034-0534, have been confirmed to have a common feature of phase-aligned in radio and gamma-ray bands. With a geometric (two-pole caustic) model and a physical outer gap model (revised 3D outer gap model) in a three dimensional (3D) retarded magnetic dipole with a perturbation magnetic field, the observed features of these MSPs are studied. In order to obtained the best-fitting model parameters, the Markov chain Monte Carlo technique is used and reasonable GeV band light curves for three MSPs are given. Our calculations indicate that MSPs emit high energy photons with smaller inclination angles (α ≈ 10°-50°), larger view angles (ζ ≈ 65°-100°), and smaller perturbation factor (ɛ ≈ -0.15-0.1). Note that the factor ɛ, describing the strength of the perturbed magnetic field, is all less than zero in these two models, so the magnetic field caused by current-induced play a leading role in the pulsed location of MSPs.
The average action for scalar fields near phase transitions
International Nuclear Information System (INIS)
Wetterich, C.
1991-08-01
We compute the average action for fields in two, three and four dimensions, including the effects of wave function renormalization. A study of the one loop evolution equations for the scale dependence of the average action gives a unified picture of the qualitatively different behaviour in various dimensions for discrete as well as abelian and nonabelian continuous symmetry. The different phases and the phase transitions can be infered from the evolution equation. (orig.)
Phase transition and field effect topological quantum transistor made of monolayer MoS2
Simchi, H.; Simchi, M.; Fardmanesh, M.; Peeters, F. M.
2018-06-01
We study topological phase transitions and topological quantum field effect transistor in monolayer molybdenum disulfide (MoS2) using a two-band Hamiltonian model. Without considering the quadratic (q 2) diagonal term in the Hamiltonian, we show that the phase diagram includes quantum anomalous Hall effect, quantum spin Hall effect, and spin quantum anomalous Hall effect regions such that the topological Kirchhoff law is satisfied in the plane. By considering the q 2 diagonal term and including one valley, it is shown that MoS2 has a non-trivial topology, and the valley Chern number is non-zero for each spin. We show that the wave function is (is not) localized at the edges when the q 2 diagonal term is added (deleted) to (from) the spin-valley Dirac mass equation. We calculate the quantum conductance of zigzag MoS2 nanoribbons by using the nonequilibrium Green function method and show how this device works as a field effect topological quantum transistor.
Energy Technology Data Exchange (ETDEWEB)
Tian, Liang [Ames Laboratory; Russell, Alan [Ames Laboratory
2014-03-27
The phase field approach is a powerful computational technique to simulate morphological and microstructural evolution at the mesoscale. Spheroidization is a frequently observed morphological change of mesoscale heterogeneous structures during annealing. In this study, we used the diffuse interface phase field method to investigate the interfacial diffusion-driven spheroidization of cylindrical rod structures in a composite comprised of two mutually insoluble phases in a two-dimensional case. Perturbation of rod radius along a cylinder's axis has long been known to cause the necessary chemical potential gradient that drives spheroidization of the rod by Lord Rayleigh's instability theory. This theory indicates that a radius perturbation wavelength larger than the initial rod circumference would lead to cylindrical spheroidization. We investigated the effect of perturbation wavelength, interfacial energy, volume diffusion, phase composition, and interfacial percentage on the kinetics of spheroidization. The results match well with both the Rayleigh's instability criterion and experimental observations.
Roberto Viana, J.; Rodriguez Salmon, Octavio D.; Neto, Minos A.; Carvalho, Diego C.
2018-02-01
A new approximation technique is developed so as to study the quantum ferromagnetic spin-1 Blume-Capel model in the presence of a transverse crystal field in the square lattice. Our proposal consists of approaching the spin system by considering islands of finite clusters whose frontiers are surrounded by noninteracting spins that are treated by the effective-field theory. The resulting phase diagram is qualitatively correct, in contrast to most effective-field treatments, in which the first-order line exhibits spurious behavior by not being perpendicular to the anisotropy axis at low-temperatures. The effect of the transverse anisotropy is also verified by the presence of quantum phase transitions. The possibility of using larger sizes constitutes an advantage to other approaches where the implementation of larger sizes is computationally costly.
Liu, Hao; Lin, Lingfang; Yu, Yang; Lin, Hanxuan; Zhu, Yinyan; Miao, Tian; Bai, Yu; Shi, Qian; Cai, Peng; Kou, Yunfang; Lan, Fanli; Wang, Wenbin; Zhou, Xiaodong; Dong, Shuai; Yin, Lifeng; Shen, Jian
2017-11-01
Electronic phase separation (EPS) is a common phenomenon in strongly correlated oxides. For colossal magnetoresistive (CMR) manganites, the EPS is so pronounced that not only does it govern the CMR behavior, but also raises a question whether EPS exists as a ground state for systems or a metastable state. While it has been well known that a magnetic field can drive the transition of the EPS state into a single-phase state in manganites, the reversibility of this transition is not well studied. In this work we use magnetic force microscopy (MFM) to directly visualize the reversibility of the field driven transition between the EPS state and the single-phase state at different temperatures. The MFM images correspond well with the global magnetic and transport property measurements, uncovering the underlying mechanism of the field driven transition between the EPS state and the single-phase state. We argue that EPS state is a consequence of system quenching whose response to an external magnetic field is governed by a local energy landscape.
Phase separation in La-Ca manganites: Magnetic field effects
International Nuclear Information System (INIS)
Tovar, M.; Causa, M.T.; Ramos, C.A.; Laura-Ccahuana, D.
2008-01-01
The coexistence of magnetic phases seems to be a characteristic of the La-Ca family of in colossal magnetoresistant manganites. We have analyzed this phenomenon in terms of a free energy, F, where magnetic and electronic contributions of two coexistent phases are included. Three order parameters describe the behavior of the mixed material: the magnetization of each phase and the metallic fraction. Due to the coupling between order parameters there is a range: T**≤T≤T* where coexistence is possible. Values for the phenomenological parameters are obtained from the experiment. In this paper we analyze the effects of an applied magnetic field on the range of T where the phase coexistence takes place, based on results obtained from dc-magnetization and ESR measurements
Phase separation in La-Ca manganites: Magnetic field effects
Energy Technology Data Exchange (ETDEWEB)
Tovar, M; Causa, M T [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica and Universidad Nacional de Cuyo, 8400 San Carlos de Bariloche, Rio Negro (Argentina); Ramos, C.A. [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica and Universidad Nacional de Cuyo, 8400 San Carlos de Bariloche, Rio Negro (Argentina)], E-mail: cramos@cab.cnea.gov.ar; Laura-Ccahuana, D [Centro Atomico Bariloche and Instituto Balseiro, Comision Nacional de Energia Atomica and Universidad Nacional de Cuyo, 8400 San Carlos de Bariloche, Rio Negro (Argentina); Universidad Nacional de Ingenieria, Av. Tupac Amaru 210, Rimac/Lima 25 (Peru)
2008-02-15
The coexistence of magnetic phases seems to be a characteristic of the La-Ca family of in colossal magnetoresistant manganites. We have analyzed this phenomenon in terms of a free energy, F, where magnetic and electronic contributions of two coexistent phases are included. Three order parameters describe the behavior of the mixed material: the magnetization of each phase and the metallic fraction. Due to the coupling between order parameters there is a range: T**{<=}T{<=}T* where coexistence is possible. Values for the phenomenological parameters are obtained from the experiment. In this paper we analyze the effects of an applied magnetic field on the range of T where the phase coexistence takes place, based on results obtained from dc-magnetization and ESR measurements.
Application of the weighted total field-scattering field technique to 3D-PSTD light scattering model
Hu, Shuai; Gao, Taichang; Liu, Lei; Li, Hao; Chen, Ming; Yang, Bo
2018-04-01
PSTD (Pseudo Spectral Time Domain) is an excellent model for the light scattering simulation of nonspherical aerosol particles. However, due to the particularity of its discretization form of the Maxwell's equations, the traditional Total Field/Scattering Field (TF/SF) technique for FDTD (Finite Differential Time Domain) is not applicable to PSTD, and the time-consuming pure scattering field technique is mainly applied to introduce the incident wave. To this end, the weighted TF/SF technique proposed by X. Gao is generalized and applied to the 3D-PSTD scattering model. Using this technique, the incident light can be effectively introduced by modifying the electromagnetic components in an inserted connecting region between the total field and the scattering field region with incident terms, where the incident terms are obtained by weighting the incident field by a window function. To optimally determine the thickness of connection region and the window function type for PSTD calculations, their influence on the modeling accuracy is firstly analyzed. To further verify the effectiveness and advantages of the weighted TF/SF technique, the improved PSTD model is validated against the PSTD model equipped with pure scattering field technique in both calculation accuracy and efficiency. The results show that, the performance of PSTD seems to be not sensitive to variation of window functions. The number of the connection layer required decreases with the increasing of spatial resolution, where for spatial resolution of 24 grids per wavelength, a 6-layer region is thick enough. The scattering phase matrices and integral scattering parameters obtained by the improved PSTD show an excellent consistency with those well-tested models for spherical and nonspherical particles, illustrating that the weighted TF/SF technique can introduce the incident precisely. The weighted TF/SF technique shows higher computational efficiency than pure scattering technique.
Wide-field phase imaging for the endoscopic detection of dysplasia and early-stage esophageal cancer
Fitzpatrick, C. R. M.; Gordon, G. S. D.; Sawyer, T. W.; Wilkinson, T. D.; Bohndiek, S. E.
2018-02-01
Esophageal cancer has a 5-year survival rate below 20%, but can be curatively resected if it is detected early. At present, poor contrast for early lesions in white light imaging leads to a high miss rate in standard-of- care endoscopic surveillance. Early lesions in the esophagus, referred to as dysplasia, are characterized by an abundance of abnormal cells with enlarged nuclei. This tissue has a different refractive index profile to healthy tissue, which results in different light scattering properties and provides a source of endogenous contrast that can be exploited for advanced endoscopic imaging. For example, point measurements of such contrast can be made with scattering spectroscopy, while optical coherence tomography generates volumetric data. However, both require specialist interpretation for diagnostic decision making. We propose combining wide-field phase imaging with existing white light endoscopy in order to provide enhanced contrast for dysplasia and early-stage cancer in an image format that is familiar to endoscopists. Wide-field phase imaging in endoscopy can be achieved using coherent illumination combined with phase retrieval algorithms. Here, we present the design and simulation of a benchtop phase imaging system that is compatible with capsule endoscopy. We have undertaken preliminary optical modelling of the phase imaging setup, including aberration correction simulations and an investigation into distinguishing between different tissue phantom scattering coefficients. As our approach is based on phase retrieval rather than interferometry, it is feasible to realize a device with low-cost components for future clinical implementation.
Ray calibration and phase mapping for structured-light-field 3D reconstruction.
Cai, Zewei; Liu, Xiaoli; Peng, Xiang; Gao, Bruce Z
2018-03-19
In previous work, we presented a structured light field (SLF) method combining light field imaging with structured illumination to perform multi-view depth measurement. However, the previous work just accomplishes depth rather than 3D reconstruction. In this paper, we propose a novel active method involving ray calibration and phase mapping, to achieve SLF 3D reconstruction. We performed the ray calibration for the first time to determine each light field ray with metric spatio-angular parameters, making the SLF realize multi-view 3D reconstruction. Based on the ray parametric equation, we further derived the phase mapping in the SLF that spatial coordinates can be directly mapped from phase. A flexible calibration strategy was correspondently designed to determine mapping coefficients for each light field ray, achieving high-efficiency SLF 3D reconstruction. Experimental results demonstrated that the proposed method was suitable for high-efficiency multi-view 3D reconstruction in the SLF.
Abnormal screening in the quantum disordered phases of nonlinear σ-models
International Nuclear Information System (INIS)
Wen, X.G.; Zee, A.
1989-01-01
We study some properties of the quantum disordered phase of nonlinear σ-models, focussing on the quantum numbers of the quasi-particles and possible experimental implications. We find that the quasi-particles in the quantum disordered phase may, in many cases, carry new quantum numbers which do not appear in any finite combination of the fundamental fields. We call this phenomenon abnormal screening. Abnormal screening is shown to appear in (1+1)-dimensional systems. Using a large N mean field approach to the quantum disordered state, we show that abnormal screening may also appear in (1+2)-dimensional nonlinear σ-models. In 1+2 dimensions abnormal screening is closely related to spin-charge separation, which was proposed to occur in the spin liquid state relevant in some theories of high T c superconductivity. We compare the mean field approach with bosonization and other exact results for (1+1)-dimensional systems and find exact agreement for the quantum numbers of the quasi-particles. This suggests that mean field analysis of high T c superconductivity may yield a qualitatively reliable picture. Our result also gives an alternative way of understanding some novel properties of the antiferromagnetic spin chain. We estimate the density and temperature at which deconfinement and abnormal screening occur. Finally, we suggest some experimental signatures for this phenomenon. (orig.)
Phase Transition Couplings in the Higgsed Monopole Model
Laperashvili, L V
1999-01-01
Using a one-loop approximation for the effective potential in the Higgs model of electrodynamics for a charged scalar field, we argue for the existence of a triple point for the renormalized (running) values of the selfinteraction beta-function as a typical quantity we estimate that the one-loop approximation is valid with accuracy of deviations not more than 30% in the region of the parameters: $0.2 \\stackrel{<}{\\sim}{\\large \\alpha, \\tilde{\\alpha}} corresponds to the above-mentioned region of $\\alpha, \\tilde \\alpha$. Under the point of view that the Higgs particle is a monopole with a magnetic charge g, the obtained electric fine structure constant turns out to be to the $\\alpha_{crit}^{lat}\\approx{0.20}$ which in a U(1) lattice gauge theory corresponds to the phase transition between the "Coulomb" and confinement phases. Such a result is very encouraging for the idea of an approximate "universality" (regularization independence) of gauge couplings at the phase transition point. This idea was suggested by...
Energy Technology Data Exchange (ETDEWEB)
Lan, Mi-Xiang; Dai, Zi-Gao [School of Astronomy and Space Science, Nanjing University, Nanjing 210093 (China); Wu, Xue-Feng, E-mail: dzg@nju.edu.cn [Purple Mountain Observatory, Chinese Academy of Sciences, Nanjing 210008 (China)
2016-08-01
The X-ray afterglows of almost one-half of gamma-ray bursts have been discovered by the Swift satellite to have a shallow decay phase of which the origin remains mysterious. Two main models have been proposed to explain this phase: relativistic wind bubbles (RWBs) and structured ejecta, which could originate from millisecond magnetars and rapidly rotating black holes, respectively. Based on these models, we investigate polarization evolution in the shallow decay phase of X-ray and optical afterglows. We find that in the RWB model, a significant bump of the polarization degree evolution curve appears during the shallow decay phase of both optical and X-ray afterglows, while the polarization position angle abruptly changes its direction by 90°. In the structured ejecta model, however, the polarization degree does not evolve significantly during the shallow decay phase of afterglows whether the magnetic field configuration in the ejecta is random or globally large-scale. Therefore, we conclude that these two models for the shallow decay phase and relevant central engines would be testable with future polarization observations.
All-Atom Polarizable Force Field for DNA Based on the Classical Drude Oscillator Model
Savelyev, Alexey; MacKerell, Alexander D.
2014-01-01
Presented is a first generation atomistic force field for DNA in which electronic polarization is modeled based on the classical Drude oscillator formalism. The DNA model is based on parameters for small molecules representative of nucleic acids, including alkanes, ethers, dimethylphosphate, and the nucleic acid bases and empirical adjustment of key dihedral parameters associated with the phosphodiester backbone, glycosidic linkages and sugar moiety of DNA. Our optimization strategy is based on achieving a compromise between satisfying the properties of the underlying model compounds in the gas phase targeting QM data and reproducing a number of experimental properties of DNA duplexes in the condensed phase. The resulting Drude force field yields stable DNA duplexes on the 100 ns time scale and satisfactorily reproduces (1) the equilibrium between A and B forms of DNA and (2) transitions between the BI and BII sub-states of B form DNA. Consistency with the gas phase QM data for the model compounds is significantly better for the Drude model as compared to the CHARMM36 additive force field, which is suggested to be due to the improved response of the model to changes in the environment associated with the explicit inclusion of polarizability. Analysis of dipole moments associated with the nucleic acid bases shows the Drude model to have significantly larger values than those present in CHARMM36, with the dipoles of individual bases undergoing significant variations during the MD simulations. Additionally, the dipole moment of water was observed to be perturbed in the grooves of DNA. PMID:24752978
First and second order operator splitting methods for the phase field crystal equation
International Nuclear Information System (INIS)
Lee, Hyun Geun; Shin, Jaemin; Lee, June-Yub
2015-01-01
In this paper, we present operator splitting methods for solving the phase field crystal equation which is a model for the microstructural evolution of two-phase systems on atomic length and diffusive time scales. A core idea of the methods is to decompose the original equation into linear and nonlinear subequations, in which the linear subequation has a closed-form solution in the Fourier space. We apply a nonlinear Newton-type iterative method to solve the nonlinear subequation at the implicit time level and thus a considerably large time step can be used. By combining these subequations, we achieve the first- and second-order accuracy in time. We present numerical experiments to show the accuracy and efficiency of the proposed methods
Berry phase in superconducting charge qubits interacting with a cavity field
International Nuclear Information System (INIS)
Abdel-Aty, Mahmoud
2009-01-01
We propose a method for analyzing Berry phase for a multi-qubit system of superconducting charge qubits interacting with a microwave field. By suitably choosing the system parameters and precisely controlling the dynamics, novel connection found between the Berry phase and entanglement creations.
Phase coexistence and electric-field control of toroidal order in oxide superlattices.
Damodaran, A R; Clarkson, J D; Hong, Z; Liu, H; Yadav, A K; Nelson, C T; Hsu, S-L; McCarter, M R; Park, K-D; Kravtsov, V; Farhan, A; Dong, Y; Cai, Z; Zhou, H; Aguado-Puente, P; García-Fernández, P; Íñiguez, J; Junquera, J; Scholl, A; Raschke, M B; Chen, L-Q; Fong, D D; Ramesh, R; Martin, L W
2017-10-01
Systems that exhibit phase competition, order parameter coexistence, and emergent order parameter topologies constitute a major part of modern condensed-matter physics. Here, by applying a range of characterization techniques, and simulations, we observe that in PbTiO 3 /SrTiO 3 superlattices all of these effects can be found. By exploring superlattice period-, temperature- and field-dependent evolution of these structures, we observe several new features. First, it is possible to engineer phase coexistence mediated by a first-order phase transition between an emergent, low-temperature vortex phase with electric toroidal order and a high-temperature ferroelectric a 1 /a 2 phase. At room temperature, the coexisting vortex and ferroelectric phases form a mesoscale, fibre-textured hierarchical superstructure. The vortex phase possesses an axial polarization, set by the net polarization of the surrounding ferroelectric domains, such that it possesses a multi-order-parameter state and belongs to a class of gyrotropic electrotoroidal compounds. Finally, application of electric fields to this mixed-phase system permits interconversion between the vortex and the ferroelectric phases concomitant with order-of-magnitude changes in piezoelectric and nonlinear optical responses. Our findings suggest new cross-coupled functionalities.
Phase coexistence and electric-field control of toroidal order in oxide superlattices
International Nuclear Information System (INIS)
Damodaran, A. R.; Clarkson, J. D.; Hong, Z.
2017-01-01
Systems that exhibit phase competition, order parameter coexistence, and emergent order parameter topologies constitute a major part of modern condensed-matter physics. Here, by applying a range of characterization techniques, and simulations, we observe that in PbTiO 3 /SrTiO 3 superlattices all of these effects can be found. By exploring superlattice period-, temperature- and field-dependent evolution of these structures, we observe several new features. First, it is possible to engineer phase coexistence mediated by a first-order phase transition between an emergent, low-temperature vortex phase with electric toroidal order and a high-temperature ferroelectric a 1 /a 2 phase. At room temperature, the coexisting vortex and ferroelectric phases form a mesoscale, fibre-textured hierarchical superstructure. The vortex phase possesses an axial polarization, set by the net polarization of the surrounding ferroelectric domains, such that it possesses a multi-order-parameter state and belongs to a class of gyrotropic electrotoroidal compounds. Finally, application of electric fields to this mixed-phase system permits interconversion between the vortex and the ferroelectric phases concomitant with order-of-magnitude changes in piezoelectric and nonlinear optical responses. Here, our findings suggest new cross-coupled functionalities.
Far-field and Fresnel Liquid Crystal Geometric Phase Holograms via Direct-Write Photo-Alignment
Directory of Open Access Journals (Sweden)
Xiao Xiang
2017-12-01
Full Text Available We study computer-generated geometric-phase holograms (GPHs realized by photo-aligned liquid crystals, in both simulation and experiment. We demonstrate both far-field and Fresnel holograms capable of producing far-field and near-field images with preserved fidelity for all wavelengths. The GPHs are fabricated by patterning a photo-alignment layer (PAL using a direct-write laser scanner and coating the surface with a polymerizable liquid crystal (i.e., a reactive mesogen. We study various recording pixel sizes, down to 3 μm, that are easily recorded in the PAL. We characterize the fabricated elements and find good agreement with theory and numerical simulation. Because of the wavelength independent geometric phase, the (phase fidelity of the replay images is preserved for all wavelengths, unlike conventional dynamic phase holograms. However, governed by the diffraction equation, the size and location of a reconstructed image depends on the replay wavelength for far-field and near-field GPHs, respectively. These offer interesting opportunities for white-light holography.
Test of quantum thermalization in the two-dimensional transverse-field Ising model.
Blaß, Benjamin; Rieger, Heiko
2016-12-01
We study the quantum relaxation of the two-dimensional transverse-field Ising model after global quenches with a real-time variational Monte Carlo method and address the question whether this non-integrable, two-dimensional system thermalizes or not. We consider both interaction quenches in the paramagnetic phase and field quenches in the ferromagnetic phase and compare the time-averaged probability distributions of non-conserved quantities like magnetization and correlation functions to the thermal distributions according to the canonical Gibbs ensemble obtained with quantum Monte Carlo simulations at temperatures defined by the excess energy in the system. We find that the occurrence of thermalization crucially depends on the quench parameters: While after the interaction quenches in the paramagnetic phase thermalization can be observed, our results for the field quenches in the ferromagnetic phase show clear deviations from the thermal system. These deviations increase with the quench strength and become especially clear comparing the shape of the thermal and the time-averaged distributions, the latter ones indicating that the system does not completely lose the memory of its initial state even for strong quenches. We discuss our results with respect to a recently formulated theorem on generalized thermalization in quantum systems.
Phase-of-flight method for setting the accelerating fields in the ion linear accelerator
International Nuclear Information System (INIS)
Dvortsov, S.V.; Lomize, L.G.
1983-01-01
For setting amplitudes and phases of accelerating fields in multiresonator ion accelerators presently Δt-procedure is used. The determination and setting of two unknown parameters of RF-field (amplitude and phase) in n-resonator is made according to the two increments of particle time-of-flight, measured experimentally: according to the change of the particle time-of-flight Δt 1 in the n-resonator, during the field switching in the resonator, and according to the change of Δt 2 of the time-of-flight in (n+1) resonator without RF-field with the switching of accelerating field in the n-resonator. When approaching the accelerator exit the particle energy increases, relative energy increment decreases and the accuracy of setting decreases. To enchance the accuracy of accelerating fields setting in a linear ion accelerator a phase-of-flight method is developed, in which for the setting of accelerating fields the measured time-of-flight increment Δt only in one resonator is used (the one in which the change of amplitude and phase is performed). Results of simulation of point bunch motion in the IYaI AN USSR linear accelerator are presented
DEFF Research Database (Denmark)
Jannati, Mohammad; Monadi, Ali; Nik Idris, Nik Rumzi
2016-01-01
This paper discusses the d-q model and winding function method (WFM) for modeling and a rotor eld-oriented control (RFOC) system for controlling a faulty three-phase induction motor (three-phase IM when one of the phases is disconnected). In the adapted scheme for controlling the faulty IM...
International Nuclear Information System (INIS)
Moelans, N.; Blanpain, B.; Wollants, P.
2008-01-01
A phase-field approach for quantitative simulations of grain growth in anisotropic systems is introduced, together with a new methodology to derive appropriate model parameters that reproduce given misorientation and inclination dependent grain boundary energy and mobility in the simulations. The proposed model formulation and parameter choice guarantee a constant diffuse interface width and consequently give high controllability of the accuracy in grain growth simulations
Phase diagram of an extended Agassi model
García-Ramos, J. E.; Dukelsky, J.; Pérez-Fernández, P.; Arias, J. M.
2018-05-01
Background: The Agassi model [D. Agassi, Nucl. Phys. A 116, 49 (1968), 10.1016/0375-9474(68)90482-X] is an extension of the Lipkin-Meshkov-Glick (LMG) model [H. J. Lipkin, N. Meshkov, and A. J. Glick, Nucl. Phys. 62, 188 (1965), 10.1016/0029-5582(65)90862-X] that incorporates the pairing interaction. It is a schematic model that describes the interplay between particle-hole and pair correlations. It was proposed in the 1960s by D. Agassi as a model to simulate the properties of the quadrupole plus pairing model. Purpose: The aim of this work is to extend a previous study by Davis and Heiss [J. Phys. G: Nucl. Phys. 12, 805 (1986), 10.1088/0305-4616/12/9/006] generalizing the Agassi model and analyze in detail the phase diagram of the model as well as the different regions with coexistence of several phases. Method: We solve the model Hamiltonian through the Hartree-Fock-Bogoliubov (HFB) approximation, introducing two variational parameters that play the role of order parameters. We also compare the HFB calculations with the exact ones. Results: We obtain the phase diagram of the model and classify the order of the different quantum phase transitions appearing in the diagram. The phase diagram presents broad regions where several phases, up to three, coexist. Moreover, there is also a line and a point where four and five phases are degenerated, respectively. Conclusions: The phase diagram of the extended Agassi model presents a rich variety of phases. Phase coexistence is present in extended areas of the parameter space. The model could be an important tool for benchmarking novel many-body approximations.
Mehta, Shalin B.; Sheppard, Colin J. R.
2010-05-01
Various methods that use large illumination aperture (i.e. partially coherent illumination) have been developed for making transparent (i.e. phase) specimens visible. These methods were developed to provide qualitative contrast rather than quantitative measurement-coherent illumination has been relied upon for quantitative phase analysis. Partially coherent illumination has some important advantages over coherent illumination and can be used for measurement of the specimen's phase distribution. However, quantitative analysis and image computation in partially coherent systems have not been explored fully due to the lack of a general, physically insightful and computationally efficient model of image formation. We have developed a phase-space model that satisfies these requirements. In this paper, we employ this model (called the phase-space imager) to elucidate five different partially coherent systems mentioned in the title. We compute images of an optical fiber under these systems and verify some of them with experimental images. These results and simulated images of a general phase profile are used to compare the contrast and the resolution of the imaging systems. We show that, for quantitative phase imaging of a thin specimen with matched illumination, differential phase contrast offers linear transfer of specimen information to the image. We also show that the edge enhancement properties of spiral phase contrast are compromised significantly as the coherence of illumination is reduced. The results demonstrate that the phase-space imager model provides a useful framework for analysis, calibration, and design of partially coherent imaging methods.
Unified Dark Matter scalar field models with fast transition
Energy Technology Data Exchange (ETDEWEB)
Bertacca, Daniele [Dipartimento di Fisica Galileo Galilei, Università di Padova, via F. Marzolo 8, I-35131 Padova (Italy); Bruni, Marco [Institute of Cosmology and Gravitation, University of Portsmouth, Dennis Sciama Building, Portsmouth, PO1 3FX (United Kingdom); Piattella, Oliver F. [Department of Physics, Universidade Federal do Espírito Santo, avenida Ferrari 514, 29075-910, Vitória, ES (Brazil); Pietrobon, Davide, E-mail: daniele.bertacca@pd.infn.it, E-mail: marco.bruni@port.ac.uk, E-mail: oliver.piattella@gmail.com, E-mail: davide.pietrobon@jpl.nasa.gov [Jet Propulsion Laboratory, California Institute of Technology, 4800 Oak Grove Drive, 91109 Pasadena CA U.S.A. (United States)
2011-02-01
We investigate the general properties of Unified Dark Matter (UDM) scalar field models with Lagrangians with a non-canonical kinetic term, looking specifically for models that can produce a fast transition between an early Einstein-de Sitter CDM-like era and a later Dark Energy like phase, similarly to the barotropic fluid UDM models in JCAP01(2010)014. However, while the background evolution can be very similar in the two cases, the perturbations are naturally adiabatic in fluid models, while in the scalar field case they are necessarily non-adiabatic. The new approach to building UDM Lagrangians proposed here allows to escape the common problem of the fine-tuning of the parameters which plague many UDM models. We analyse the properties of perturbations in our model, focusing on the the evolution of the effective speed of sound and that of the Jeans length. With this insight, we can set theoretical constraints on the parameters of the model, predicting sufficient conditions for the model to be viable. An interesting feature of our models is that what can be interpreted as w{sub DE} can be < −1 without violating the null energy conditions.
DEFF Research Database (Denmark)
Marbjerg, Gerd Høy; Brunskog, Jonas; Jeong, Cheol-Ho
2015-01-01
A model, combining acoustical radiosity and the image source method, including phase shifts on reflection, has been developed. The model is denoted Phased Acoustical Radiosity and Image Source Method (PARISM), and it has been developed in order to be able to model both specular and diffuse...... radiosity by regarding the model as being stochastic. Three methods of implementation are proposed and investigated, and finally, recommendations are made for their use. Validation of the image source method is done by comparison with finite element simulations of a rectangular room with a porous absorber...
Nature of phase transitions in Axelrod-like coupled Potts models in two dimensions
Gandica, Yerali; Chiacchiera, Silvia
2016-03-01
We study F coupled q -state Potts models in a two-dimensional square lattice. The interaction between the different layers is attractive to favor a simultaneous alignment in all of them, and its strength is fixed. The nature of the phase transition for zero field is numerically determined for F =2 ,3 . Using the Lee-Kosterlitz method, we find that it is continuous for F =2 and q =2 , whereas it is abrupt for higher values of q and/or F . When a continuous or a weakly first-order phase transition takes place, we also analyze the properties of the geometrical clusters. This allows us to determine the fractal dimension D of the incipient infinite cluster and to examine the finite-size scaling of the cluster number density via data collapse. A mean-field approximation of the model, from which some general trends can be determined, is presented too. Finally, since this lattice model has been recently considered as a thermodynamic counterpart of the Axelrod model of social dynamics, we discuss our results in connection with this one.
Generalized phase transformations of spinor fields
International Nuclear Information System (INIS)
Mikhov, S.G.
1993-09-01
In this paper some generalized four parameter phase transformations of a Dirac spinor are considered. It is shown that a corresponding compensating transformation of the electromagnetic field which restores the invariance of the Dirac-Maxwell equation might exist, provided some consistency conditions are satisfied by the parameters of the transformations. These transformations are used further to consider the Maxwell equations under the assumption that a Bosonization takes place. Only one of the considered cases proves to have a solution (the other cases show to be trivial) which although unphysical is obtained explicitly. (author). 10 refs
Coupled oscillators as models of phantom and scalar field cosmologies
International Nuclear Information System (INIS)
Faraoni, Valerio
2004-01-01
We study a toy model for phantom cosmology recently introduced in the literature and consisting of two oscillators, one of which carries negative kinetic energy. The results are compared with the exact phase space picture obtained for similar dynamical systems describing, respectively, a massive canonical scalar field conformally coupled to the spacetime curvature and a conformally coupled massive phantom. Finally, the dynamical system describing exactly a minimally coupled phantom is studied and compared with the toy model
The phase diagram of scalar field theory on the fuzzy disc
Energy Technology Data Exchange (ETDEWEB)
Rea, Simone; Sämann, Christian [Maxwell Institute for Mathematical Sciences, Department of Mathematics,Heriot-Watt University,Colin Maclaurin Building, Riccarton, Edinburgh EH14 4AS (United Kingdom)
2015-11-17
Using a recently developed bootstrapping method, we compute the phase diagram of scalar field theory on the fuzzy disc with quartic even potential. We find three distinct phases with second and third order phase transitions between them. In particular, we find that the second order phase transition happens approximately at a fixed ratio of the two coupling constants defining the potential. We compute this ratio analytically in the limit of large coupling constants. Our results qualitatively agree with previously obtained numerical results.
International Nuclear Information System (INIS)
Perez, J.F.; Pontin, L.F.; Segundo, J.A.B.
1985-01-01
Using a method proposed by van Hemmen the free energy of the Curie-Weiss version of the site-dilute antiferromagnetic Ising model is computed, in the presence of an uniform magnetic field. The solution displays an exact correspondence between this model and the Curie-Weiss version of the Ising model in the presence of a random magnetic field. The phase diagrams are discussed and a tricritical point is shown to exist. (Author) [pt
Mathematical models for two-phase stratified pipe flow
Energy Technology Data Exchange (ETDEWEB)
Biberg, Dag
2005-06-01
The simultaneous transport of oil, gas and water in a single multiphase flow pipe line has for economical and practical reasons become common practice in the gas and oil fields operated by the oil industry. The optimal design and safe operation of these pipe lines require reliable estimates of liquid inventory, pressure drop and flow regime. Computer simulations of multiphase pipe flow have thus become an important design tool for field developments. Computer simulations yielding on-line monitoring and look ahead predictions are invaluable in day-to-day field management. Inaccurate predictions may have large consequences. The accuracy and reliability of multiphase pipe flow models are thus important issues. Simulating events in large pipelines or pipeline systems is relatively computer intensive. Pipe-lines carrying e.g. gas and liquefied gas (condensate) may cover distances of several hundred km in which transient phenomena may go on for months. The evaluation times associated with contemporary 3-D CFD models are thus not compatible with field applications. Multiphase flow lines are therefore normally simulated using specially dedicated 1-D models. The closure relations of multiphase pipe flow models are mainly based on lab data. The maximum pipe inner diameter, pressure and temperature in a multiphase pipe flow lab is limited to approximately 0.3 m, 90 bar and 60{sup o}C respectively. The corresponding field values are, however, much higher i.e.: 1 m, 1000 bar and 200{sup o}C respectively. Lab data does thus not cover the actual field conditions. Field predictions are consequently frequently based on model extrapolation. Applying field data or establishing more advanced labs will not solve this problem. It is in fact not practically possible to acquire sufficient data to cover all aspects of multiphase pipe flow. The parameter range involved is simply too large. Liquid levels and pressure drop in three-phase flow are e.g. determined by 13 dimensionless parameters
Scattering and short-distance properties in field theory models
International Nuclear Information System (INIS)
Iagolnitzer, D.
1987-01-01
The aim of constructive field theory is not only to define models but also to establish their general properties of physical interest. We here review recent works on scattering and on short-distance properties for weakly coupled theories with mass gap such as typically P(φ) in dimension 2, φ 4 in dimension 3 and the (renormalizable, asymptotically free) massive Gross-Neveu (GN) model in dimension 2. Many of the ideas would apply similarly to other (possibly non renormalizable) theories that might be defined in a similar way via phase-space analysis
A nonlocal phase-field system with inertial term
Czech Academy of Sciences Publication Activity Database
Grasselli, M.; Petzeltová, Hana; Schimperna, G.
2007-01-01
Roč. 65, č. 3 (2007), s. 451-469 ISSN 0033-569X R&D Projects: GA AV ČR(CZ) IAA100190606 Institutional research plan: CEZ:AV0Z10190503 Keywords : nonlocal phase-field system * Lojasiewicz inequality * convergence to equilibria Subject RIV: BA - General Mathematics Impact factor: 0.463, year: 2007
Boundary Induced Phase Transition in Cellular Automata Models of Pedestrian Flow
Czech Academy of Sciences Publication Activity Database
Bukáček, M.; Hrabák, Pavel
2016-01-01
Roč. 11, č. 4 (2016), s. 327-338 ISSN 1557-5969 R&D Projects: GA ČR GA13-13502S Institutional support: RVO:67985556 Keywords : Adaptive time-span * Cellular automata model * Floor-field * Pedestrian flow * Phase transition * Principle of bonds Subject RIV: BD - Theory of Information Impact factor: 0.696, year: 2016
International Nuclear Information System (INIS)
Kumamaru, Hiroshige
1980-01-01
Brief review of the studies on the flow and heat transfer of two-component, two-phase flow of liquid metal in magnetic field is presented. R.J. Thome measured the distribution of void rate, slip ratio and pressure loss for the two-phase flow of NaK-N 2 under vertical magnetic field. The void rate distribution became even and the slip ratio increased with the increasing magnetic field. The experimental results of pressure loss was compared with the calculation by an equation derived from the homogeneous flow model. R.G. Owen et al. made the analytical studies of the MHD friction loss of two phase flow. Michiyoshi et al. made experimental studies on the hydrodynamic local properties of Hg-Ar two-phase flow of slug region in a vertically ascending tube under magnetic field, and Kimi et al. also made studies on the heat transfer of Hg-Ar flow under magnetic field. Saito et al. measured the slip ratio and pressure loss of NaK-N 2 flow. As a whole, it can be said that the average void rate decreases, and its distribution becomes even under magnetic field. The slip ratio increases, and the friction loss factor becomes nearly one. It was hard to make clear the heat transfer characteristics. (Kato, T.)
Steinmetz, Philipp; Kellner, Michael; Hötzer, Johannes; Nestler, Britta
2018-02-01
For the analytical description of the relationship between undercoolings, lamellar spacings and growth velocities during the directional solidification of ternary eutectics in 2D and 3D, different extensions based on the theory of Jackson and Hunt are reported in the literature. Besides analytical approaches, the phase-field method has been established to study the spatially complex microstructure evolution during the solidification of eutectic alloys. The understanding of the fundamental mechanisms controlling the morphology development in multiphase, multicomponent systems is of high interest. For this purpose, a comparison is made between the analytical extensions and three-dimensional phase-field simulations of directional solidification in an ideal ternary eutectic system. Based on the observed accordance in two-dimensional validation cases, the experimentally reported, inherently three-dimensional chain-like pattern is investigated in extensive simulation studies. The results are quantitatively compared with the analytical results reported in the literature, and with a newly derived approach which uses equal undercoolings. A good accordance of the undercooling-spacing characteristics between simulations and the analytical Jackson-Hunt apporaches are found. The results show that the applied phase-field model, which is based on the Grand potential approach, is able to describe the analytically predicted relationship between the undercooling and the lamellar arrangements during the directional solidification of a ternary eutectic system in 3D.
Deviren, Seyma Akkaya
2017-02-01
In this research, we have investigated the magnetic properties of the spin-1 Ising model on the Shastry Sutherland lattice with the crystal field interaction by using the effective-field theory with correlations. The effects of the applied field on the magnetization are examined in detail in order to obtain the magnetization plateaus, thus different types of magnetization plateaus, such as 1/4, 1/3, 1/2, 3/5, 2/3 and 7/9 of the saturation, are obtained for strong enough magnetic fields (h). Magnetization plateaus exhibit single, triple, quintuplet and sextuple forms according to the interaction parameters, hence the magnetization plateaus originate from the competition between the crystal field (D) and exchange interaction parameters (J, J‧). The ground-state phase diagrams of the system are presented in three varied planes, namely (h/J, J‧/J), (h/J, D/J) and (D/J, J‧/J) planes. These phase diagrams display the Néel (N), collinear (C) and ferromagnetic (F) phases for certain values of the model parameters. The obtained results are in good agreement with some theoretical and experimental studies.
Soustelle, Michel
2015-01-01
This book is part of a set of books which offers advanced students successive characterization tool phases, the study of all types of phase (liquid, gas and solid, pure or multi-component), process engineering, chemical and electrochemical equilibria, and the properties of surfaces and phases of small sizes. Macroscopic and microscopic models are in turn covered with a constant correlation between the two scales. Particular attention has been given to the rigor of mathematical developments. This second volume in the set is devoted to the study of liquid phases.
Ertaş, Mehmet
2015-09-01
Keskin and Ertaş (2009) presented a study of the magnetic properties of a mixed spin (2, 5/2) ferrimagnetic Ising model within an oscillating magnetic field. They employed dynamic mean-field calculations to find the dynamic phase transition temperatures, the dynamic compensation points of the model and to present the dynamic phase diagrams. In this work, we extend the study and investigate the dynamic hysteresis behaviors for the two-dimensional (2D) mixed spin (2, 5/2) ferrimagnetic Ising model on a hexagonal lattice in an oscillating magnetic field within the framework of dynamic mean-field calculations. The dynamic hysteresis curves are obtained for both the ferromagnetic and antiferromagnetic interactions and the effects of the Hamiltonian parameters on the dynamic hysteresis behaviors are discussed in detail. The thermal behaviors of the coercivity and remanent magnetizations are also investigated. The results are compared with some theoretical and experimental works and a qualitatively good agreement is found. Finally, the dynamic phase diagrams depending on the frequency of an oscillating magnetic field in the plane of the reduced temperature versus magnetic field amplitude is examined and it is found that the dynamic phase diagrams display richer dynamic critical behavior for higher values of frequency than for lower values.
Constraints on Interacting Scalars in 2T Field Theory and No Scale Models in 1T Field Theory
Bars, Itzhak
2010-01-01
In this paper I determine the general form of the physical and mathematical restrictions that arise on the interactions of gravity and scalar fields in the 2T field theory setting, in d+2 dimensions, as well as in the emerging shadows in d dimensions. These constraints on scalar fields follow from an underlying Sp(2,R) gauge symmetry in phase space. Determining these general constraints provides a basis for the construction of 2T supergravity, as well as physical applications in 1T-field theory, that are discussed briefly here, and more detail elsewhere. In particular, no scale models that lead to a vanishing cosmological constant at the classical level emerge naturally in this setting.
Local two-phase modeling of the water-steam flows occurring in steam generators
International Nuclear Information System (INIS)
Denefle, Romain
2013-01-01
The present study is related to the need of modeling the two-phase flows occurring in a steam generator (liquid at inlet and vapour at outlet). The choice is made to investigate a hybrid modeling of the flow, considering the gas phase as two separated fields, each one being modeled with different closure laws. In so doing, the small and spherical bubbles are modeled through a dispersed approach within the two-fluid model, and the distorted bubbles are simulated with an interface locating method. The main outcome is about the implementation, the verification and the validation of the model dedicated to the large and distorted bubbles, as well as the coupling of the two approaches for the gas, allowing the presentation of demonstration calculations using the so-called hybrid approach. (author)
The Quantum Space Phase Transitions for Particles and Force Fields
Directory of Open Access Journals (Sweden)
Chung D.-Y.
2006-07-01
Full Text Available We introduce a phenomenological formalism in which the space structure is treated in terms of attachment space and detachment space. Attachment space attaches to an object, while detachment space detaches from the object. The combination of these spaces results in three quantum space phases: binary partition space, miscible space and binary lattice space. Binary lattice space consists of repetitive units of alternative attachment space and detachment space. In miscible space, attachment space is miscible to detachment space, and there is no separation between attachment space and detachment spaces. In binary partition space, detachment space and attachment space are in two separat continuous regions. The transition from wavefunction to the collapse of wavefuction under interference becomes the quantum space phase transition from binary lattice space to miscible space. At extremely conditions, the gauge boson force field undergoes a quantum space phase transition to a "hedge boson force field", consisting of a "vacuum" core surrounded by a hedge boson shell, like a bubble with boundary.
Plasma pressure and anisotropy inferred from the Tsyganenkomagnetic field model
Directory of Open Access Journals (Sweden)
F. Cao
Full Text Available A numerical procedure has been developed to deduce the plasma pressure and anisotropy from the Tsyganenko magnetic field model. The Tsyganenko empirical field model, which is based on vast satellite field data, provides a realistic description of magnetic field configuration in the magnetosphere. When the force balance under the static condition is assumed, the electromagnetic J×B force from the Tsyganenko field model can be used to infer the plasma pressure and anisotropy distributions consistent with the field model. It is found that the J×B force obtained from the Tsyganenko field model is not curl-free. The curl-free part of the J×B force in an empirical field model can be balanced by the gradient of the isotropic pressure, while the nonzero curl of the J×B force can only be associated with the pressure anisotropy. The plasma pressure and anisotropy in the near-Earth plasma sheet are numerically calculated to obtain a static equilibrium consistent with the Tsyganenko field model both in the noon-midnight meridian and in the equatorial plane. The plasma pressure distribution deduced from the Tsyganenko 1989 field model is highly anisotropic and shows this feature early in the substorm growth phase. The pressure anisotropy parameter α_{P}, defined as α_{P}=1-P_{Vert}P_{⊥}, is typically ~0.3 at x ≈ -4.5R_{E} and gradually decreases to a small negative value with an increasing tailward distance. The pressure anisotropy from the Tsyganenko 1989 model accounts for 50% of the cross-tail current at maximum and only in a highly localized region near xsim-10R_{E}. In comparison, the plasma pressure anisotropy inferred from the Tsyganenko 1987 model is much smaller. We also find that the boundary
Study of incommensurable phases in quantum chains
International Nuclear Information System (INIS)
Vollmer, J.
1990-12-01
The phases of quantum chains with spin-1/2 and spin-1-respresentations of the SU(2) algebra and the phases of a mixed spin-1/2 / spin-1 chain are reported and investigated. These chains are models with an XX-interaction in a magnetic field. In a certain range of the magnetic field the groundstate magnetisation depends continuously on the magnetic field and the energy gaps vanish, this is a so called 'floating phase'. Within this phase the energy spectrum is a conformal spectrum, comparable to the spectrum of the Gauss-model, but the momenta have a macroscopic part. These macroscopic momenta are connected to oscillating correlation functions, whose periods are determined by the magnetic field. The transition from the floating phase to an existing phase with constant groundstate magnetisation is a Pokrovsky-Talapov-transition, it is a universal transition in all three models. (orig.) [de
Chiral phase transition in the soft-wall model of AdS/QCD
International Nuclear Information System (INIS)
Chelabi, Kaddour; Fang, Zhen; Huang, Mei; Li, Danning; Wu, Yue-Liang
2016-01-01
We investigate the chiral phase transition in the soft-wall model of AdS/QCD at zero chemical potential for two-flavor and three-flavor cases, respectively. We show that there is no spontaneous chiral symmetry breaking in the original soft-wall model. After detailed analysis, we find that in order to realize chiral symmetry breaking and restoration, both profiles for the scalar potential and the dilaton field are essential. The scalar potential determines the possible solution structure of the chiral condensate, except the mass term, it takes another quartic term for the two-flavor case, and for the three-flavor case, one has to take into account an extra cubic term due to the t’Hooft determinant interaction. The profile of the dilaton field reflects the gluodynamics, which is negative at a certain ultraviolet scale and approaches positive quadratic behavior at far infrared region. With this set-up, the spontaneous chiral symmetry breaking in the vacuum and its restoration at finite temperature can be realized perfectly. In the two-flavor case, it gives a second order chiral phase transition in the chiral limit, while the transition turns to be a crossover for any finite quark mass. In the case of three-flavor, the phase transition becomes a first order one in the chiral limit, while above sufficient large quark mass it turns to be a crossover again. This scenario agrees exactly with the current understanding on chiral phase transition from lattice QCD and other effective model studies.
The vortex free energy in the screening phase of the Z(2) Higgs model
International Nuclear Information System (INIS)
Meyer, H.
1983-06-01
The vortex free energy was proposed to distinguish between the confinement - and the Higgs phase (in the sense of 't Hooft) in lattice gauge theory, when matter fields are present that transform according to an arbitrary representation of the gauge group. In this paper I consider the Z(2) Higgs model and calculate the vortex free energy in the screening part of the confining/screening phase of Fradkin and Shenker. The result does not agree with the expected behavior that corresponds to the structure of the phase diagram. Therefore the vortex free energy is no longer a good indicator for confinement when matter fields transform nontrivially under the center of the gauge group (such as Z(2) Higgs scalars). (orig.)
Directory of Open Access Journals (Sweden)
Dongjia Cao
2017-12-01
Full Text Available Phase-field simulation serves as an effective tool for quantitative characterization of microstructure evolution in single-crystal Ni-based superalloys during solidification nowadays. The classic unit cell is either limited to γ dendrites along crystal orientation or too ideal to cover complex morphologies for γ dendrites. An attempt to design the unit cell for two-dimensional (2-D phase-field simulations of microstructure evolution in single-crystal Ni-based superalloys during solidification was thus performed by using the MICRESS (MICRostructure Evolution Simulation Software in the framework of the multi-phase-field (MPF model, and demonstrated in a commercial TMS-113 superalloy. The coupling to CALPHAD (CALculation of PHAse Diagram thermodynamic database was realized via the TQ interface and the experimental diffusion coefficients were utilized in the simulation. Firstly, the classic unit cell with a single γ dendrite along crystal orientation was employed for the phase-field simulation in order to reproduce the microstructure features. Then, such simple unit cell was extended into the cases with two other different crystal orientations, i.e., and . Thirdly, for crystal orientations, the effect of γ dendritic orientations and unit cell sizes on microstructure and microsegregation was comprehensively studied, from which a new unit cell with multiple γ dendrites was proposed. The phase-field simulation with the newly proposed unit cell was further performed in the TMS-113 superalloy, and the microstructure features including the competitive growth of γ dendrites, microsegregation of different solutes and distribution of γ′ grains, can be nicely reproduced.
The diluted tri-dimensional spin-one Ising model with crystal field interactions
International Nuclear Information System (INIS)
Saber, M.
1988-09-01
3D spin-one Ising models with nearest-neighbour ferromagnetic interactions with crystal-field exhibit tricritical behaviour. A new method that applies to a wide class of random systems is used to study the influence of site and bond dilution on this behaviour. We have calculated temperature-crystal-field-concentration phase diagrams and determined, in particular, the influence of dilution on the zero temperature tricritical temperature. (author). 10 refs, 8 figs
International Nuclear Information System (INIS)
Taylor, A.J.; Omenetto, G.; Rodriguez, G.; Siders, C.W.; Siders, J.L.W.; Downer, C.
1999-01-01
This is the final report of a three-year Laboratory Directed Research and Development (LDRD) Project at Los Alamos National Laboratory (LANL). The detailed dynamics of an atom in a strong laser field is rich in both interesting physics and potential applications. The goal of this project was to develop a technique for characterizing high-field laser-plasma interactions with femtosecond resolution based on the direct measurement of the phase change of an optical pulse. The authors developed the technique of Multi-pulse Interferometric Frequency Resolved Optical Gating (MI-FROG), which recovers (to all orders) the phase difference between pumped and unpumped probe pulses, enabling the determination of sub-pulsewidth time-resolved phase and frequency shifts impressed by a pump pulse on a weak probe pulse. Using MI-FROG, the authors obtained the first quantitative measurements of high-field ionization rates in noble gases and diatomic molecules. They obtained agreement between the measured ionization rates an d those calculated for the noble gases and diatomic nitrogen and hydrogen using a one-dimensional fluid model and rates derived from tunneling theory. However, much higher rates are measured for diatomic oxygen than predicted by tunneling theory calculations
Electroweak phase transition in two Higgs doublet models
International Nuclear Information System (INIS)
Cline, J.M.; Lemieux, P.
1997-01-01
We reexamine the strength of the first-order phase transition in the electroweak theory supplemented by an extra Higgs doublet. The finite-temperature effective potential V eff is computed to one-loop order, including the summation of ring diagrams, to study the ratio φ c /T c of the Higgs field VEV to the critical temperature. We make a number of improvements over previous treatments, including a consistent treatment of Goldstone bosons in V eff , an accurate analytic approximation to V eff valid for any mass-to-temperature ratios, and use of the experimentally measured top quark mass. For two-Higgs-doublet models, we identify a significant region of parameter space where φ c /T c is large enough for electroweak baryogenesis, and we argue that this identification should persist even at higher orders in perturbation theory. In the case of the minimal supersymmetric standard model, our results indicate that the extra Higgs bosons have little effect on the strength of the phase transition. copyright 1997 The American Physical Society
Evidence of a fractional quantum Hall nematic phase in a microscopic model
Regnault, N.; Maciejko, J.; Kivelson, S. A.; Sondhi, S. L.
2017-07-01
At small momenta, the Girvin-MacDonald-Platzman (GMP) mode in the fractional quantum Hall (FQH) effect can be identified with gapped nematic fluctuations in the isotropic FQH liquid. This correspondence would be exact as the GMP mode softens upon approach to the putative point of a quantum phase transition to a FQH nematic. Motivated by these considerations as well as by suggestive evidence of an FQH nematic in tilted field experiments, we have sought evidence of such a nematic FQHE in a microscopic model of interacting electrons in the lowest Landau level at filling factor 1/3. Using a family of anisotropic Laughlin states as trial wave functions, we find a continuous quantum phase transition between the isotropic Laughlin liquid and the FQH nematic. Results of numerical exact diagonalization also suggest that rotational symmetry is spontaneously broken, and that the phase diagram of the model contains both a nematic and a stripe phase.
Demange, Gilles; Pontikis, Vassilis; Lunéville, Laurence; Simeone, David
2016-01-01
In this work, a multiscale approach based on phase field was developed to simulate the microstructure's evolution under irradiation in binary systems, from atomic to microstructural scale. For that purpose, an efficient numerical scheme was developed. In the case of AgCu alloy under Krypton ions irradiation, phenomenological parameters were computed using atomistic methods, as a function of the temperature and the irradiation flux. As a result, we predicted the influence of the irradiation fl...
Energy Technology Data Exchange (ETDEWEB)
Smiseth, Jo
2005-07-01
The critical properties of three-dimensional U(1)-symmetric lattice gauge theories have been studied. The models apply to various physical systems such as insulating phases of strongly correlated electron systems as well as superconducting and superfluid states of liquid metallic hydrogen under extreme pressures. The thesis contains an introductory part and a collection of research papers of which seven are published works and one is submitted for publication. The outline of this thesis is as follows. In Chapter 2 the theory of phase transitions is discussed with emphasis on continuous phase transitions, critical phenomena and phase transitions in gauge theories. In the next chapter the phases of the abelian Higgs model are presented, and the critical phenomena are discussed. Furthermore, the multicomponent Ginzburg-Landau theory and the applications to liquid metallic hydrogen are presented. Chapter 4 contains an overview of the Monte Carlo integration scheme, including the Metropolis algorithm, error estimates, and re weighting techniques. This chapter is followed by the papers I-VIII. Paper I: Criticality in the (2+1)-Dimensional Compact Higgs Model and Fractionalized Insulators. Paper II: Phase structure of (2+1)-dimensional compact lattice gauge theories and the transition from Mott insulator to fractionalized insulator. Paper III: Compact U(1) gauge theories in 2+1 dimensions and the physics of low dimensional insulating materials. Paper IV: Phase structure of Abelian Chern-Simons gauge theories. Paper V: Critical Properties of the N-Color London Model. Paper VI: Field- and temperature induced topological phase transitions in the three-dimensional N-component London superconductor. Paper VII: Vortex Sublattice Melting in a Two-Component Superconductor. Paper VIII: Observation of a metallic superfluid in a numerical experiment (ml)
Magnetic phase diagram of UNi2Si2 under magnetic field and high-pressure
International Nuclear Information System (INIS)
Honda, F.; Oomi, G.; Svoboda, P.; Syshchenko, A.; Sechovsky, V.; Khmelevski, S.; Divis, M.; Andreev, A.V.; Takeshita, N.; Mori, N.; Menovsky, A.A.
2001-01-01
Measurements of electrical resistance under high pressure and neutron diffraction in high-magnetic field of single crystalline UNi 2 Si 2 have been performed. We have found the analogy between the p-T and B-T magnetic phase diagrams. It is also found that the propagation vector q Z of incommensurate antiferromagnetic phase decreases with increasing magnetic field. A new pronounced pressure-induced incommensurate-commensurate magnetic phase transition has been detected
Three-field modeling for MARS 1-D code
International Nuclear Information System (INIS)
Hwang, Moonkyu; Lim, Ho-Gon; Jeong, Jae-Jun; Chung, Bub-Dong
2006-01-01
In this study, the three-field modeling of the two-phase mixture is developed. The finite difference equations for the three-field equations thereafter are devised. The solution scheme has been implemented into the MARS 1-D code. The three-field formulations adopted are similar to those for MARS 3-D module, in a sense that the mass and momentum are treated separately for the entrained liquid and continuous liquid. As in the MARS-3D module, the entrained liquid and continuous liquid are combined into one for the energy equation, assuming thermal equilibrium between the two. All the non-linear terms are linearized to arrange the finite difference equation set into a linear matrix form with respect to the unknown arguments. The problems chosen for the assessment of the newly added entrained field consist of basic conceptual tests. Among the tests are gas-only test, liquid-only test, gas-only with supplied entrained liquid test, Edwards pipe problem, and GE level swell problem. The conceptual tests performed confirm the sound integrity of the three-field solver
Modeling the Phase Composition of Gas Condensate in Pipelines
Dudin, S. M.; Zemenkov, Yu D.; Shabarov, A. B.
2016-10-01
Gas condensate fields demonstrate a number of thermodynamic characteristics to be considered when they are developed, as well as when gas condensate is transported and processed. A complicated phase behavior of the gas condensate system, as well as the dependence of the extracted raw materials on the phase state of the deposit other conditions being equal, is a key aspect. Therefore, when designing gas condensate lines the crucial task is to select the most appropriate methods of calculating thermophysical properties and phase equilibrium of the transported gas condensate. The paper describes a physical-mathematical model of a gas-liquid flow in the gas condensate line. It was developed based on balance equations of conservation of mass, impulse and energy of the transported medium within the framework of a quasi-1D approach. Constitutive relationships are given separately, and practical recommendations on how to apply the research results are provided as well.
Dynamic magnetic hysteresis behavior and dynamic phase transition in the spin-1 Blume-Capel model
Energy Technology Data Exchange (ETDEWEB)
Deviren, Bayram, E-mail: bayram.deviren@nevsehir.edu.tr [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey); Keskin, Mustafa [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2012-03-15
The nature (time variation) of response magnetization m(wt) of the spin-1 Blume-Capel model in the presence of a periodically varying external magnetic field h(wt) is studied by employing the effective-field theory (EFT) with correlations as well as the Glauber-type stochastic dynamics. We determine the time variations of m(wt) and h(wt) for various temperatures, and investigate the dynamic magnetic hysteresis behavior. We also investigate the temperature dependence of the dynamic magnetization, hysteresis loop area and correlation near the transition point in order to characterize the nature (first- or second-order) of the dynamic transitions as well as obtain the dynamic phase transition temperatures. The hysteresis loops are obtained for different reduced temperatures and we find that the areas of the loops are decreasing with the increasing of the reduced temperatures. We also present the dynamic phase diagrams and compare the results of the EFT with the results of the dynamic mean-field approximation. The phase diagrams exhibit many dynamic critical points, such as tricritical ( Bullet ), zero-temperature critical (Z), triple (TP) and multicritical (A) points. According to values of Hamiltonian parameters, besides the paramagnetic (P), ferromagnetic (F) fundamental phases, one coexistence or mixed phase region, (F+P) and the reentrant behavior exist in the system. The results are in good agreement with some experimental and theoretical results. - Highlights: Black-Right-Pointing-Pointer Kinetic spin-1 Blume-Capel model is studied using the effective-field theory. Black-Right-Pointing-Pointer We investigated the dynamic magnetic hysteresis behavior. Black-Right-Pointing-Pointer Dynamic magnetization, hysteresis loop area and correlation are investigated. Black-Right-Pointing-Pointer System exhibits tricritical, zero-temperature, triple and multicritical points. Black-Right-Pointing-Pointer We present the dynamic phase diagrams and compare the results of the EFT
Energy Technology Data Exchange (ETDEWEB)
Pawlak, A., E-mail: pawlak@amu.edu.pl [Faculty of Physics, Adam Mickiewicz University, Umultowska 85, 61–614 Poznań (Poland); Gülpınar, G. [Department of Physics, Dokuz Eylül University, 35160 İzmir (Turkey); Erdem, R. [Department of Physics, Akdeniz University, 07058 Antalya (Turkey); Ağartıoğlu, M. [Institute of Science, Dokuz Eylül University, 35160 İzmir (Turkey)
2015-12-01
The expressions for the dipolar and quadrupolar susceptibilities are obtained within the mean-field approximation in the Blume–Emery–Griffiths model. Temperature as well as crystal field dependences of the susceptibilities are investigated for two different phase diagram topologies which take place for K/J=3 and K/J=5.0.Their behavior near the second and first order transition points as well as multi-critical points such as tricritical, triple and critical endpoint is presented. It is found that in addition to the jumps connected with the phase transitions there are broad peaks in the quadrupolar susceptibility. It is indicated that these broad peaks lie on a prolongation of the first-order line from a triple point to a critical point ending the line of first-order transitions between two distinct paramagnetic phases. It is argued that the broad peaks are a reminiscence of very strong quadrupolar fluctuations at the critical point. The results reveal the fact that near ferromagnetic–paramagnetic phase transitions the quadrupolar susceptibility generally shows a jump whereas near the phase transition between two distinct paramagnetic phases it is an edge-like. - Highlights: • MFA calculation of the quadrupolar and dipolar susceptibility in BEG model is given • The crystal-field variation of susceptibilities near the multi-critical points is examined • There are broad peaks in the quadrupolar susceptibility in the vicinity of CP • These maxima are remembrances of the very strong quadrupolar Fluctuations.
Energy Technology Data Exchange (ETDEWEB)
Wang, Mingyue [Key Laboratory for Advanced Materials Processing Technology, Ministry of Education, Department of Mechanical Engineering, Tsinghua University, Beijing 100084 (China); Jing, Tao; Liu, Baicheng [Key Laboratory for Advanced Materials Processing Technology, Ministry of Education, Department of Mechanical Engineering, Tsinghua University, Beijing 100084 (China)
2009-10-15
A formulation of solid-liquid interfacial thermodynamic and kinetic anisotropic characteristics for hexagonal close-packed metals is proposed. The two- and three-dimensional dendritic growth of primary Mg in undercooled Mg-Al alloy melts is modeled using the phase-field method, based on a combination of crystallographic lattice symmetry and experimental observations. The morphologies of three-dimensional dendrites are obtained and the calculated results show intricately hierarchical branched structures. The excess free energy of the solution system is based on the Redlich-Kister model.
International Nuclear Information System (INIS)
Wang, Mingyue; Jing, Tao; Liu, Baicheng
2009-01-01
A formulation of solid-liquid interfacial thermodynamic and kinetic anisotropic characteristics for hexagonal close-packed metals is proposed. The two- and three-dimensional dendritic growth of primary Mg in undercooled Mg-Al alloy melts is modeled using the phase-field method, based on a combination of crystallographic lattice symmetry and experimental observations. The morphologies of three-dimensional dendrites are obtained and the calculated results show intricately hierarchical branched structures. The excess free energy of the solution system is based on the Redlich-Kister model.
Helical Phase Inflation and Monodromy in Supergravity Theory
Directory of Open Access Journals (Sweden)
Tianjun Li
2015-01-01
Full Text Available We study helical phase inflation which realizes “monodromy inflation” in supergravity theory. In the model, inflation is driven by the phase component of a complex field whose potential possesses helicoid structure. We construct phase monodromy based on explicitly breaking global U(1 symmetry in the superpotential. By integrating out heavy fields, the phase monodromy from single complex scalar field is realized and the model fulfills natural inflation. The phase-axion alignment is achieved from explicitly symmetry breaking and gives super-Planckian phase decay constant. The F-term scalar potential provides strong field stabilization for all the scalars except inflaton, which is protected by the approximate global U(1 symmetry. Besides, we show that helical phase inflation can be naturally realized in no-scale supergravity with SU(2,1/SU(2×U(1 symmetry since the supergravity setup needed for phase monodromy is automatically provided in the no-scale Kähler potential. We also demonstrate that helical phase inflation can be reduced to another well-known supergravity inflation model with shift symmetry. Helical phase inflation is free from the UV-sensitivity problem although there is super-Planckian field excursion, and it suggests that inflation can be effectively studied based on supersymmetric field theory while a UV-completed framework is not prerequisite.
Liu, Hui; Chen, Jun; Huang, Houbing; Fan, Longlong; Ren, Yang; Pan, Zhao; Deng, Jinxia; Chen, Long-Qing; Xing, Xianran
2018-01-01
A functional material with coexisting energetically equivalent phases often exhibits extraordinary properties such as piezoelectricity, ferromagnetism, and ferroelasticity, which is simultaneously accompanied by field-driven reversible phase transformation. The study on the interplay between such phase transformation and the performance is of great importance. Here, we have experimentally revealed the important role of field-driven reversible phase transformation in achieving enhanced electromechanical properties using in situ high-energy synchrotron x-ray diffraction combined with 2D geometry scattering technology, which can establish a comprehensive picture of piezoelectric-related microstructural evolution. High-throughput experiments on various Pb /Bi -based perovskite piezoelectric systems suggest that reversible phase transformation can be triggered by an electric field at the morphotropic phase boundary and the piezoelectric performance is highly related to the tendency of electric-field-driven phase transformation. A strong tendency of phase transformation driven by an electric field generates peak piezoelectric response. Further, phase-field modeling reveals that the polarization alignment and the piezoelectric response can be much enhanced by the electric-field-driven phase transformation. The proposed mechanism will be helpful to design and optimize the new piezoelectrics, ferromagnetics, or other related functional materials.
Gong, Yuezheng; Zhao, Jia; Wang, Qi
2017-10-01
A quasi-incompressible hydrodynamic phase field model for flows of fluid mixtures of two incompressible viscous fluids of distinct densities and viscosities is derived by using the generalized Onsager principle, which warrants the variational structure, the mass conservation and energy dissipation law. We recast the model in an equivalent form and discretize the equivalent system in space firstly to arrive at a time-dependent ordinary differential and algebraic equation (DAE) system, which preserves the mass conservation and energy dissipation law at the semi-discrete level. Then, we develop a temporal discretization scheme for the DAE system, where the mass conservation and the energy dissipation law are once again preserved at the fully discretized level. We prove that the fully discretized algorithm is unconditionally energy stable. Several numerical examples, including drop dynamics of viscous fluid drops immersed in another viscous fluid matrix and mixing dynamics of binary polymeric solutions, are presented to show the convergence property as well as the accuracy and efficiency of the new scheme.
Institute of Scientific and Technical Information of China (English)
HOU Hua; XU Hong; ZHAO Yu-hong
2006-01-01
With the microscopic phase-field model, the precipitation process of aged alloys was explored by computer simulation, which could clarify some discussional views on the precipitation mechanisms of alloys. The precipitation process of Ni75Al2.5V22.5 alloy was studied. From the simulated atomic pictures, calculated order parameters and volume fraction of different precipitates, it's found that the θ ordered phase precipitates earlier than γ' ordered phase by congruent ordering+spinodal decomposition mechanism and thus produces a nonstoicheometric θ single ordered phase. Then, the nonstoicheometric γ' phase is precipitated by a non-classical nucleation and growth mechanism at the APBS of θ phases. Meanwhile, both of them transform to stoicheometric ordered phases.
International Nuclear Information System (INIS)
Largenton, R.
2012-01-01
This research thesis aimed at developing a model based on scale change to assess more precisely the distribution of local thermo-mechanical fields within a heterogeneous medium as MOX fuel. The analysis method is a non-uniform transformation field analysis (NTFA) which is adapted to the problem of scale change in presence of a coupling between dissipative and elastic effects. More precisely, the author addressed the development of a NTFA model based on specific three-phase and three-dimensional microstructures which are typical of the MOX fuel in an in-service operation. The first part proposes an overview of knowledge and use of MOX. It recalls the context and the industrial problematic associated with this fuel: operating principles for a 900 MWe PWR, fuel fabrication processes, fuel morphologies and structural and microstructural consequences. It addresses local mechanisms within each phase during irradiation, and presents the approach methodology regarding scale change. The second part reports the representation and analysis in complete fields of multiphase particle-based composites (MOX type) in order to determine the representative elementary volume and the local behaviour of each phase. The third part reports the extension of the NTFA approach to 3D aspects, free deformations, ageing and optimization. The last part compares the NTFA approach with the incremental two-phase and three-phase Mori-Tanaka models
Chiral symmetry breaking in d=3 NJL model in external gravitational and magnetic fields
Gitman, D. M.; Odintsov, S. D.; Shil'nov, Yu. I.
1996-01-01
The phase structure of $d=3$ Nambu-Jona-Lasinio model in curved spacetime with magnetic field is investigated in the leading order of the $1/N$-expansion and in linear curvature approximation (an external magnetic field is treated exactly). The possibility of the chiral symmetry breaking under the combined action of the external gravitational and magnetic fields is shown explicitly. At some circumstances the chiral symmetry may be restored due to the compensation of the magnetic field by the ...
Multiphase-field model of small strain elasto-plasticity according to the mechanical jump conditions
Herrmann, Christoph; Schoof, Ephraim; Schneider, Daniel; Schwab, Felix; Reiter, Andreas; Selzer, Michael; Nestler, Britta
2018-04-01
We introduce a small strain elasto-plastic multiphase-field model according to the mechanical jump conditions. A rate-independent J_2 -plasticity model with linear isotropic hardening and without kinematic hardening is applied exemplary. Generally, any physically nonlinear mechanical model is compatible with the subsequently presented procedure. In contrast to models with interpolated material parameters, the proposed model is able to apply different nonlinear mechanical constitutive equations for each phase separately. The Hadamard compatibility condition and the static force balance are employed as homogenization approaches to calculate the phase-inherent stresses and strains. Several verification cases are discussed. The applicability of the proposed model is demonstrated by simulations of the martensitic transformation and quantitative parameters.
Energy Technology Data Exchange (ETDEWEB)
Dong, Wen D.; Carlos Valadez, J.; Gallagher, John A.; Jo, Hwan R.; Lynch, Christopher S., E-mail: cslynch@seas.ucla.edu [Department of Mechanical and Aerospace Engineering, The University of California, Los Angeles, 420 Westwood Plaza, Los Angeles, California 90095 (United States); Sahul, Raffi; Hackenberger, Wes [TRS Technologies, 2820 East College Avenue, State College, Pennsylvania 16801 (United States)
2015-06-28
Ceramic niobium modified 95/5 lead zirconate-lead titanate (PZT) undergoes a pressure induced ferroelectric to antiferroelectric phase transformation accompanied by an elimination of polarization and a volume reduction. Electric field and temperature drive the reverse transformation from the antiferroelectric to ferroelectric phase. The phase transformation was monitored under pressure, temperature, and electric field loading. Pressures and temperatures were varied in discrete steps from 0 MPa to 500 MPa and 25 °C to 125 °C, respectively. Cyclic bipolar electric fields were applied with peak amplitudes of up to 6 MV m{sup −1} at each pressure and temperature combination. The resulting electric displacement–electric field hysteresis loops were open “D” shaped at low pressure, characteristic of soft ferroelectric PZT. Just below the phase transformation pressure, the hysteresis loops took on an “S” shape, which split into a double hysteresis loop just above the phase transformation pressure. Far above the phase transformation pressure, when the applied electric field is insufficient to drive an antiferroelectric to ferroelectric phase transformation, the hysteresis loops collapse to linear dielectric behavior. Phase stability maps were generated from the experimental data at each of the temperature steps and used to form a three dimensional pressure–temperature–electric field phase diagram.
Energy Technology Data Exchange (ETDEWEB)
Akhil Datta-Gupta
2008-03-31
Streamline-based assisted and automatic history matching techniques have shown great potential in reconciling high resolution geologic models to production data. However, a major drawback of these approaches has been incompressibility or slight compressibility assumptions that have limited applications to two-phase water-oil displacements only. We propose an approach to history matching three-phase flow using a novel compressible streamline formulation and streamline-derived analytic sensitivities. First, we utilize a generalized streamline model to account for compressible flow by introducing an 'effective density' of total fluids along streamlines. Second, we analytically compute parameter sensitivities that define the relationship between the reservoir properties and the production response, viz. water-cut and gas/oil ratio (GOR). These sensitivities are an integral part of history matching, and streamline models permit efficient computation of these sensitivities through a single flow simulation. We calibrate geologic models to production data by matching the water-cut and gas/oil ratio using our previously proposed generalized travel time inversion (GTTI) technique. For field applications, however, the highly non-monotonic profile of the gas/oil ratio data often presents a challenge to this technique. In this work we present a transformation of the field production data that makes it more amenable to GTTI. Further, we generalize the approach to incorporate bottom-hole flowing pressure during three-phase history matching. We examine the practical feasibility of the method using a field-scale synthetic example (SPE-9 comparative study) and a field application. Recently Ensemble Kalman Filtering (EnKF) has gained increased attention for history matching and continuous reservoir model updating using data from permanent downhole sensors. It is a sequential Monte-Carlo approach that works with an ensemble of reservoir models. Specifically, the method
Test of quantum thermalization in the two-dimensional transverse-field Ising model
Blaß, Benjamin; Rieger, Heiko
2016-01-01
We study the quantum relaxation of the two-dimensional transverse-field Ising model after global quenches with a real-time variational Monte Carlo method and address the question whether this non-integrable, two-dimensional system thermalizes or not. We consider both interaction quenches in the paramagnetic phase and field quenches in the ferromagnetic phase and compare the time-averaged probability distributions of non-conserved quantities like magnetization and correlation functions to the thermal distributions according to the canonical Gibbs ensemble obtained with quantum Monte Carlo simulations at temperatures defined by the excess energy in the system. We find that the occurrence of thermalization crucially depends on the quench parameters: While after the interaction quenches in the paramagnetic phase thermalization can be observed, our results for the field quenches in the ferromagnetic phase show clear deviations from the thermal system. These deviations increase with the quench strength and become especially clear comparing the shape of the thermal and the time-averaged distributions, the latter ones indicating that the system does not completely lose the memory of its initial state even for strong quenches. We discuss our results with respect to a recently formulated theorem on generalized thermalization in quantum systems. PMID:27905523
DEFF Research Database (Denmark)
Yeddu, Hemantha Kumar; Shaw, Brian A.; Somers, Marcel A. J.
2017-01-01
A 3D elastoplastic phase-field model is used to study the effect of thermal cycling on martensitic transformationas well as on mechanical strengthening of both austenite and martensite in stainless steel. The results show that with an increasing number of thermal cycles, martensite becomes more...
Modeling of Coastal Effluent Transport: an Approach to Linking of Far-field and Near-field Models
International Nuclear Information System (INIS)
Yang, Zhaoqing; Khangaonkar, Tarang P.
2008-01-01
One of the challenges in effluent transport modeling in coastal tidal environments is the proper calculation of initial dilution in connection with the far-field transport model. In this study, an approach of external linkage of far-field and near-field effluent transport models is presented, and applied to simulate the effluent transport in the Port Angeles Harbor, Washington in the Strait of Juan de Fuca. A near-field plume model was used to calculate the effluent initial dilution and a three-dimensional (3-D) hydrodynamic model was developed to simulate the tidal circulation and far-field effluent transport in the Port Angeles Harbor. In the present study, the hydrodynamic model was driven by tides and surface winds. Observed water surface elevation and velocity data were used to calibrate the model over a period covering the neap-spring tidal cycle. The model was also validated with observed surface drogue trajectory data. The model successfully reproduced the tidal dynamics in the study area and good agreements between model results and observed data were obtained. This study demonstrated that the linkage between the near-field and far-field models in effluent transport modeling can be achieved through iteratively adjusting the model grid sizes such that the far-field modeled dilution ratio and effluent concentration in the effluent discharge model grid cell match the concentration calculated by the near-field plume model
Antikaon condensation in neutron stars by a new nonlinear mean-field model
Miyazaki, K
2005-01-01
We have investigated both the K^- and \\bar{K}^0 condensations in beta-equilibrated neutron star (NS) matter using the relativistic mean-field model with the renormalized meson-baryon coupling constants. Adopting the antikaon optical potential of -120MeV, our model predicts the K^- condensation as the second-order phase transition inside the neutron star of maximum mass, while the deeper potential than -160MeV is ruled out. This is in contrast to the result of the density-dependent hadron field theory. Our model also predicts remarkable softening of the equation of state by the \\bar{K}^0 condensation at high densities. Although this is contrasted with the result of the nonlinear Walecka model, only the K^- condensation can be formed in NSs.
Kholmetskii, A. L.; Missevitch, O. V.; Yarman, T.
2018-05-01
We point out that the known quantum phases for an electric/magnetic dipole moving in an electromagnetic (EM) field must be presented as the superposition of more fundamental quantum phases emerging for elementary charges. Using this idea, we find two new fundamental quantum phases for point-like charges, next to the known electric and magnetic Aharonov-Bohm (A-B) phases, named by us as the complementary electric and magnetic phases, correspondingly. We further demonstrate that these new phases can indeed be derived via the Schrödinger equation for a particle in an EM field, where however the operator of momentum is re-defined via the replacement of the canonical momentum of particle by the sum of its mechanical momentum and interactional field momentum for a system "charged particle and a macroscopic source of EM field". The implications of the obtained results are discussed.
Heisenberg Model in a Rotating Magnetic Field
Institute of Scientific and Technical Information of China (English)
LIN Qiong-Gui
2005-01-01
We study the Heisenberg model under the influence of a rotating magnetic field. By using a time-dependent unitary transformation, the time evolution operator for the Schrodinger equation is obtained, which involves no chronological product. The spin vectors (mean values of the spin operators) are obtained as explicit functions of time in the most general case. A series of cyclic solutions are presented. The nonadiabatic geometric phases of these cyclic solutions are calculated, and are expressed in terms of the solid angle subtended by the closed trace of the total spin vector, as well as in terms of those of the individual spins.
Geometric Phase of the Gyromotion for Charged Particles in a Time-dependent Magnetic Field
International Nuclear Information System (INIS)
Liu, Jian; Qin, Hong
2011-01-01
We study the dynamics of the gyrophase of a charged particle in a magnetic field which is uniform in space but changes slowly with time. As the magnetic field evolves slowly with time, the changing of the gyrophase is composed of two parts. The rst part is the dynamical phase, which is the time integral of the instantaneous gyrofrequency. The second part, called geometric gyrophase, is more interesting, and it is an example of the geometric phase which has found many important applications in different branches of physics. If the magnetic field returns to the initial value after a loop in the parameter space, then the geometric gyrophase equals the solid angle spanned by the loop in the parameter space. This classical geometric gyrophase is compared with the geometric phase (the Berry phase) of the spin wave function of an electron placed in the same adiabatically changing magnetic field. Even though gyromotion is not the classical counterpart of the quantum spin, the similarities between the geometric phases of the two cases nevertheless reveal the similar geometric nature of the different physics laws governing these two physics phenomena.
Mathematical modelling of two-phase flows
International Nuclear Information System (INIS)
Komen, E.M.J.; Stoop, P.M.
1992-11-01
A gradual shift from methods based on experimental correlations to methods based on mathematical models to study 2-phase flows can be observed. The latter can be used to predict dynamical behaviour of 2-phase flows. This report discusses various mathematical models for the description of 2-phase flows. An important application of these models can be found in thermal-hydraulic computer codes used for analysis of the thermal-hydraulic behaviour of water cooled nuclear power plants. (author). 17 refs., 7 figs., 6 tabs
International Nuclear Information System (INIS)
Lippert, Matthew
2009-01-01
We investigated the Sakai-Sugimoto model of large N QCD at nonzero temperature and baryon chemical potential and in the presence of background electric and magnetic fields. We studied the holographic representation of baryons and the deconfinement, chiral-symmetry breaking, and nuclear matter phase transitions. In a background electric field, chiral-symmetry breaking corresponds to an insulator-conductor transition. A magnetic field both catalyzes chiral-symmetry breaking and generates, in the confined phase, a pseudo-scalar gradient or, in the deconfined phase, an axial current. The resulting phase diagram is in qualitative agreement with studies of hot, dense QCD.
Prediction of transport phenomena in near and far field: interaction solid phase/fluid phase
International Nuclear Information System (INIS)
Mingarro, E.
1995-01-01
The prediction of transport phenomena in near and far field is presented in the present report. The study begins with the analysis of solid phases stability: solubility of storage waste: UO 2 and solubility of radionuclides the redox and sorption-desorption conditions are the last aspects studied to predict the transport phenomena
Energy Technology Data Exchange (ETDEWEB)
Pasrija, Kanika, E-mail: kanikapasrija@iisermohali.ac.in; Kumar, Sanjeev, E-mail: sanjeev@iisermohali.ac.in [Indian Institute of Science Education and Research (IISER) Mohali, Sector 81, S. A. S. Nagar, Manauli PO 140306 (India)
2016-05-06
We present a Monte Carlo simulation study of a bilinear-biquadratic Heisenberg model on a two-dimensional square lattice in the presence of an external magnetic field. The study is motivated by the relevance of this simple model to the non-collinear magnetism and the consequent ferroelectric behavior in the recently discovered high-temperature multiferroic, cupric oxide (CuO). We show that an external magnetic field stabilizes a non-coplanar magnetic phase, which is characterized by a finite ferromagnetic moment along the direction of the applied magnetic field and a spiral spin texture if projected in the plane perpendicular to the magnetic field. Real-space analysis highlights a coexistence of non-collinear regions with ferromagnetic clusters. The results are also supported by simple variational calculations.
International Nuclear Information System (INIS)
Acharyya, Muktish
2011-01-01
The dynamical responses of Ising metamagnet (layered antiferromagnet) in the presence of a sinusoidally oscillating magnetic field are studied by Monte Carlo simulation. The time average staggered magnetisation plays the role of dynamic order parameter. A dynamical phase transition was observed and a phase diagram was plotted in the plane formed by field amplitude and temperature. The dynamical phase boundary is observed to shrink inward as the relative antiferromagnetic strength decreases. The results are compared with that obtained from pure ferromagnetic system. The shape of dynamic phase boundary observed to be qualitatively similar to that obtained from previous meanfield calculations. - Highlights: → The time average staggered magnetisation plays the role of dynamic order parameter. → A dynamical phase transition was observed and a phase diagram was plotted in the plane formed by field amplitude and temperature. → The dynamical phase boundary is observed to shrink inward as the relative antiferromagnetic strength decreases. → The results are compared with that obtained from pure ferromagnetic system. → The shape of dynamic phase boundary observed to be qualitatively similar to that obtained from previous meanfield calculation.
Phased Array Excitations For Efficient Near Field Wireless Power Transmission
2016-09-01
channeled to the battery or power plant. Figure 2. WPT System Block Diagram for Battery Charging. Source : [2]. Wireless power transfer has gained...EXCITATIONS FOR EFFICIENT NEAR-FIELD WIRELESS POWER TRANSMISSION by Sean X. Hong September 2016 Thesis Advisor: David Jenn Second Reader...TYPE AND DATES COVERED Master’s thesis 4. TITLE AND SUBTITLE PHASED ARRAY EXCITATIONS FOR EFFICIENT NEAR-FIELD WIRELESS POWER TRANSMISSION 5
Wavelet-Fuzzy Speed Indirect Field Oriented Controller for Three-Phase AC Motor Drive
DEFF Research Database (Denmark)
Sanjeevikumar, Padmanaban; Daya, Febin; Blaabjerg, Frede
2016-01-01
Three-phase voltage source inverter driven induction motor are used in many medium- and high-power applications. Precision in speed of the motor play vital role, i.e. popular methods of direct/indirect field-oriented control (FOC) are applied. FOC is employed with proportional-integral (P...... wavelet transform and the fuzzy logic controller, to generate the scaled gains for the indirect FOC induction motor. Complete model of the proposed ac motor drive is developed with numerical simulation Matlab/Simulink software and tested under different working conditions. For experimental verification...
Ta, Na; Zhang, Lijun; Du, Yong
2014-04-01
An attempt to design the heat treatment schedule for binary Ni-Al alloys with optimal mechanical properties was made in the present work. A series of quantitative three-dimensional (3-D) phase-field simulations of microstructure evolution in Ni-Al alloys during the precipitation process were first performed using MICRESS (MICRostructure Evolution Simulation Software) package developed in the formalism of the multi-phase field model. The coupling to CALPHAD (CALculation of PHAse Diagram) thermodynamic and atomic mobility databases was realized via TQ interface. Moreover, the temperature-dependent lattice misfits and elastic constants were utilized for simulation. The effect of the alloy composition and aging temperature on microstructure evolution was extensively studied with the aid of statistical analysis. After that, an evaluation function was proposed for evaluating the optimal heat treatment schedule by choosing the phase fraction, grain size, and shape factor of γ' precipitate as the evaluation indicators. Based on 50 groups of phase-field-simulated and experimental microstructure information, as well as the proposed evaluation function, the optimal alloy composition, aging temperature, and aging time for binary Ni-Al alloy with optimal mechanical properties were finally chosen. The successful application in the present Ni-Al alloys indicates that it is possible to design the optimal alloy composition and heat treatment for other binary and even multicomponent alloys with optimal mechanical properties based on the evaluation function and the sufficient microstructure information. Additionally, the combination of the present method and the key experiments can definitely accelerate the material design and improve the efficiency and accuracy.
Energy Technology Data Exchange (ETDEWEB)
Chung, Ting-Yi, E-mail: chung.albert@nsrrc.org.tw [National Synchrotron Radiation Research Center, Hsinchu Science Park, Hsinchu 30076, Taiwan (China); Yang, Chih-Sheng; Chu, Yun-Liang; Lin, Fu-Yuan; Jan, Jyh-Chyuan [National Synchrotron Radiation Research Center, Hsinchu Science Park, Hsinchu 30076, Taiwan (China); Hwang, Ching-Shiang [National Synchrotron Radiation Research Center, Hsinchu Science Park, Hsinchu 30076, Taiwan (China); Department of Electrophysics, National Chiao Tung University, Hsinchu 30050, Taiwan (China)
2017-04-01
To enhance the flux density or to control polarization, a phase shifter was designed and used to modulate the phase matching between segmented undulators. A larger hysteresis loop causes, however, a repeatability issue in the phase matching; the fringe field of the phase shifter creates an extra magnetic-field error. The design of the phase shifter must therefore minimize the hysteresis loop and fringe field to maintain the phases exact and to ignore the crosstalk effect. Two critical issues are the hysteresis-loop problem and the fringe-field effect, which determine the radiation performance and the stability of the ring. To investigate these issues, a phase shifter was constructed to operate in accordance with electromagnetic- and permanent-type magnets; the results from the field measurements and shims are discussed here. The shimming algorithm and a compact permanent-magnet phase shifter that eliminates the issues are also presented.
Developing two-phase flow modelling concepts for rock fractures
Energy Technology Data Exchange (ETDEWEB)
Keto, V. (Fortum Nuclear Services Oy, Espoo (Finland))
2010-01-15
The Finnish nuclear waste disposal company, Posiva Oy, is planning an underground repository for spent nuclear fuel to be constructed on the island of Olkiluoto on the south-west coast of Finland. One element of the site investigations conducted at Olkiluoto is the excavation of the underground rock characterisation facility (ONKALO) that will be extended to the final disposal depth (approximately -400 m). The bedrock around the excavated tunnel volume is fully saturated with groundwater, which water commonly contains a mixture of dissolved gases. These gases remain dissolved due to the high hydrostatic pressure. During tunnel excavation work the natural hydrostatic pressure field is disturbed and the water pressure will decrease close to the atmospheric pressure in the immediate vicinity of the tunnel. During this pressure drop two-phase flow conditions (combined flow of both water and gas) may develop in the vicinity of the underground opening, as the dissolved gas is exsoluted under the low pressure (the term exsolution refers here to release of the dissolved gas molecules from the water phase into a separate gas phase). This report steers towards concept development for numerical two-phase flow modeling for fractured rock. The focus is on the description of gas phase formation process under disturbed hydraulic conditions by exsolution of dissolved gases from groundwater, and on understanding the effects of a possibly formed gas phase on groundwater flow conditions in rock fractures. A mathematical model of three mutually coupled nonlinear partial differential equations for two-phase flow is presented and corresponding constitutional relationships are introduced and discussed. Illustrative numerical simulations are performed in a simplified setting using COMSOL Multiphysics 3.5a - software package. Shortcomings and conceptual problems are discussed. (orig.)
Developing two-phase flow modelling concepts for rock fractures
International Nuclear Information System (INIS)
Keto, V.
2010-01-01
The Finnish nuclear waste disposal company, Posiva Oy, is planning an underground repository for spent nuclear fuel to be constructed on the island of Olkiluoto on the south-west coast of Finland. One element of the site investigations conducted at Olkiluoto is the excavation of the underground rock characterisation facility (ONKALO) that will be extended to the final disposal depth (approximately -400 m). The bedrock around the excavated tunnel volume is fully saturated with groundwater, which water commonly contains a mixture of dissolved gases. These gases remain dissolved due to the high hydrostatic pressure. During tunnel excavation work the natural hydrostatic pressure field is disturbed and the water pressure will decrease close to the atmospheric pressure in the immediate vicinity of the tunnel. During this pressure drop two-phase flow conditions (combined flow of both water and gas) may develop in the vicinity of the underground opening, as the dissolved gas is exsoluted under the low pressure (the term exsolution refers here to release of the dissolved gas molecules from the water phase into a separate gas phase). This report steers towards concept development for numerical two-phase flow modeling for fractured rock. The focus is on the description of gas phase formation process under disturbed hydraulic conditions by exsolution of dissolved gases from groundwater, and on understanding the effects of a possibly formed gas phase on groundwater flow conditions in rock fractures. A mathematical model of three mutually coupled nonlinear partial differential equations for two-phase flow is presented and corresponding constitutional relationships are introduced and discussed. Illustrative numerical simulations are performed in a simplified setting using COMSOL Multiphysics 3.5a - software package. Shortcomings and conceptual problems are discussed. (orig.)
Field-induced magnetic phases and electric polarization in LiNiPO4
DEFF Research Database (Denmark)
Jensen, Thomas Bagger Stibius; Christensen, Niels Bech; Kenzelmann, M.
2009-01-01
Neutron diffraction is used to probe the (H,T) phase diagram of magnetoelectric (ME) LiNiPO4 for magnetic fields along the c axis. At zero field the Ni spins order in two antiferromagnetic phases. One has commensurate (C) structures and general ordering vectors k(C)=(0,0,0); the other one...... is incommensurate (IC) with k(IC)=(0,q,0). At low temperatures the C order collapses above mu H-0=12 T and adopts an IC structure with modulation vector parallel to k(IC). We show that C order is required for the ME effect and establish how electric polarization results from a field-induced reduction in the total...
Travelling-wave amplitudes as solutions of the phase-field crystal equation
Nizovtseva, I. G.; Galenko, P. K.
2018-01-01
The dynamics of the diffuse interface between liquid and solid states is analysed. The diffuse interface is considered as an envelope of atomic density amplitudes as predicted by the phase-field crystal model (Elder et al. 2004 Phys. Rev. E 70, 051605 (doi:10.1103/PhysRevE.70.051605); Elder et al. 2007 Phys. Rev. B 75, 064107 (doi:10.1103/PhysRevB.75.064107)). The propagation of crystalline amplitudes into metastable liquid is described by the hyperbolic equation of an extended Allen-Cahn type (Galenko & Jou 2005 Phys. Rev. E 71, 046125 (doi:10.1103/PhysRevE.71.046125)) for which the complete set of analytical travelling-wave solutions is obtained by the method (Malfliet & Hereman 1996 Phys. Scr. 15, 563-568 (doi:10.1088/0031-8949/54/6/003); Wazwaz 2004 Appl. Math. Comput. 154, 713-723 (doi:10.1016/S0096-3003(03)00745-8)). The general solution of travelling waves is based on the function of hyperbolic tangent. Together with its set of particular solutions, the general solution is analysed within an example of specific task about the crystal front invading metastable liquid (Galenko et al. 2015 Phys. D 308, 1-10 (doi:10.1016/j.physd.2015.06.002)). The influence of the driving force on the phase-field profile, amplitude velocity and correlation length is investigated for various relaxation times of the gradient flow. This article is part of the theme issue `From atomistic interfaces to dendritic patterns'.
Soliton mass and surface tension in the(lambda/phi/4)2quantum field model
International Nuclear Information System (INIS)
Bellissard, J.; Froehlich, J.; Gidas, B.
1978-01-01
The spectrum of the mass operator on the soliton sectors of the anisotropic (lambda/phi 4 ) 2 - and the (lambda phi 4 ) 2 -quantum field models in the two phase region is analyzed. It is proven that, for small enough lambda>O, the mass gap m(lambda) on the soliton sector is positive, and m(lambda) = O(lambda -1 ). In principle, our methods apply to any two dimensional quantum field model with a spontaneously broken, internal symmetry group. (orig.) [de
International Nuclear Information System (INIS)
Elizalde, E.; Gavrilov, S.P.; Shil'nov, Yu.I.
2000-01-01
A four-fermion model with additional higher-derivative terms is investigated in an external electromagnetic field. The effective potential in the leading order of large-N expansion is calculated in external constant magnetic and electric fields. It is shown that, in contrast to the former results concerning the universal character of 'magnetic catalysis' in dynamical symmetry breaking, in the present higher-derivative model the magnetic field restores chiral symmetry broken initially on the tree level. Numerical results describing a second-order phase transition that accompanies the symmetry restoration at the quantum level are presented. (author)
Singla, Neeru; Dubey, Kavita; Srivastava, Vishal; Ahmad, Azeem; Mehta, D. S.
2018-02-01
We developed an automated high-resolution full-field spatial coherence tomography (FF-SCT) microscope for quantitative phase imaging that is based on the spatial, rather than the temporal, coherence gating. The Red and Green color laser light was used for finding the quantitative phase images of unstained human red blood cells (RBCs). This study uses morphological parameters of unstained RBCs phase images to distinguish between normal and infected cells. We recorded the single interferogram by a FF-SCT microscope for red and green color wavelength and average the two phase images to further reduced the noise artifacts. In order to characterize anemia infected from normal cells different morphological features were extracted and these features were used to train machine learning ensemble model to classify RBCs with high accuracy.
Mendonça, J. Ricardo G.
We investigate the nonequilibrium roughening transition of a one-dimensional restricted solid-on-solid model by directly sampling the stationary probability density of a suitable order parameter as the surface adsorption rate varies. The shapes of the probability density histograms suggest a typical Ginzburg-Landau scenario for the phase transition of the model, and estimates of the "magnetic" exponent seem to confirm its mean-field critical behavior. We also found that the flipping times between the metastable phases of the model scale exponentially with the system size, signaling the breaking of ergodicity in the thermodynamic limit. Incidentally, we discovered that a closely related model not considered before also displays a phase transition with the same critical behavior as the original model. Our results support the usefulness of off-critical histogram techniques in the investigation of nonequilibrium phase transitions. We also briefly discuss in the appendix a good and simple pseudo-random number generator used in our simulations.
Spiking patterns of a hippocampus model in electric fields
International Nuclear Information System (INIS)
Men Cong; Wang Jiang; Qin Ying-Mei; Wei Xi-Le; Deng Bin; Che Yan-Qiu
2011-01-01
We develop a model of CA3 neurons embedded in a resistive array to mimic the effects of electric fields from a new perspective. Effects of DC and sinusoidal electric fields on firing patterns in CA3 neurons are investigated in this study. The firing patterns can be switched from no firing pattern to burst or from burst to fast periodic firing pattern with the increase of DC electric field intensity. It is also found that the firing activities are sensitive to the frequency and amplitude of the sinusoidal electric field. Different phase-locking states and chaotic firing regions are observed in the parameter space of frequency and amplitude. These findings are qualitatively in accordance with the results of relevant experimental and numerical studies. It is implied that the external or endogenous electric field can modulate the neural code in the brain. Furthermore, it is helpful to develop control strategies based on electric fields to control neural diseases such as epilepsy. (interdisciplinary physics and related areas of science and technology)