Lattice Boltzmann solver of Rossler equation
Institute of Scientific and Technical Information of China (English)
GuangwuYAN; LiRUAN
2000-01-01
We proposed a lattice Boltzmann model for the Rossler equation. Using a method of multiscales in the lattice Boltzmann model, we get the diffusion reaction as a special case. If the diffusion effect disappeared, we can obtain the lattice Boltzmann solution of the Rossler equation on the mesescopic scale. The numerical results show the method can be used to simulate Rossler equation.
Quantum corrections for Boltzmann equation
Institute of Scientific and Technical Information of China (English)
M.; Levy; PETER
2008-01-01
We present the lowest order quantum correction to the semiclassical Boltzmann distribution function,and the equation satisfied by this correction is given. Our equation for the quantum correction is obtained from the conventional quantum Boltzmann equation by explicitly expressing the Planck constant in the gradient approximation,and the quantum Wigner distribution function is expanded in pow-ers of Planck constant,too. The negative quantum correlation in the Wigner dis-tribution function which is just the quantum correction terms is naturally singled out,thus obviating the need for the Husimi’s coarse grain averaging that is usually done to remove the negative quantum part of the Wigner distribution function. We also discuss the classical limit of quantum thermodynamic entropy in the above framework.
Lattice Boltzmann equation for relativistic quantum mechanics.
Succi, Sauro
2002-03-15
Relativistic versions of the quantum lattice Boltzmann equation are discussed. It is shown that the inclusion of nonlinear interactions requires the standard collision operator to be replaced by a pair of dynamic fields coupling to the relativistic wave function in a way which can be described by a multicomponent complex lattice Boltzmann equation.
Kinetic Boltzmann, Vlasov and Related Equations
Sinitsyn, Alexander; Vedenyapin, Victor
2011-01-01
Boltzmann and Vlasov equations played a great role in the past and still play an important role in modern natural sciences, technique and even philosophy of science. Classical Boltzmann equation derived in 1872 became a cornerstone for the molecular-kinetic theory, the second law of thermodynamics (increasing entropy) and derivation of the basic hydrodynamic equations. After modifications, the fields and numbers of its applications have increased to include diluted gas, radiation, neutral particles transportation, atmosphere optics and nuclear reactor modelling. Vlasov equation was obtained in
An introduction to the theory of the Boltzmann equation
Harris, Stewart
2011-01-01
Boltzmann's equation (or Boltzmann-like equations) appears extensively in such disparate fields as laser scattering, solid-state physics, nuclear transport, and beyond the conventional boundaries of physics and engineering, in the fields of cellular proliferation and automobile traffic flow. This introductory graduate-level course for students of physics and engineering offers detailed presentations of the basic modern theory of Boltzmann's equation, including representative applications using both Boltzmann's equation and the model Boltzmann equations developed within the text. It emphasizes
The Boltzmann equation in the difference formulation
Energy Technology Data Exchange (ETDEWEB)
Szoke, Abraham [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Brooks III, Eugene D. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
2015-05-06
First we recall the assumptions that are needed for the validity of the Boltzmann equation and for the validity of the compressible Euler equations. We then present the difference formulation of these equations and make a connection with the time-honored Chapman - Enskog expansion. We discuss the hydrodynamic limit and calculate the thermal conductivity of a monatomic gas, using a simplified approximation for the collision term. Our formulation is more consistent and simpler than the traditional derivation.
The Non-Classical Boltzmann Equation, and Diffusion-Based Approximations to the Boltzmann Equation
Frank, Martin; Larsen, Edward W; Vasques, Richard
2014-01-01
We show that several diffusion-based approximations (classical diffusion or SP1, SP2, SP3) to the linear Boltzmann equation can (for an infinite, homogeneous medium) be represented exactly by a non-classical transport equation. As a consequence, we indicate a method to solve diffusion-based approximations to the Boltzmann equation via Monte Carlo, with only statistical errors - no truncation errors.
THREE WAY DECOMPOSITION FOR THE BOLTZMANN EQUATION
Institute of Scientific and Technical Information of China (English)
Ilgis Ibragimov; Sergej Rjasanow
2009-01-01
The initial value problem for the spatially homogeneous Boltzmann equation is considered. A deterministic numerical scheme for this problem is developed by the use of the three way decomposition of the unknown function as well as of the collision integral. On this way, almost linear complexity of the algorithm is achieved. Some numerical examples are presented.
Entropic lattice Boltzmann model for Burgers's equation.
Boghosian, Bruce M; Love, Peter; Yepez, Jeffrey
2004-08-15
Entropic lattice Boltzmann models are discrete-velocity models of hydrodynamics that possess a Lyapunov function. This feature makes them useful as nonlinearly stable numerical methods for integrating hydrodynamic equations. Over the last few years, such models have been successfully developed for the Navier-Stokes equations in two and three dimensions, and have been proposed as a new category of subgrid model of turbulence. In the present work we develop an entropic lattice Boltzmann model for Burgers's equation in one spatial dimension. In addition to its pedagogical value as a simple example of such a model, our result is actually a very effective way to simulate Burgers's equation in one dimension. At moderate to high values of viscosity, we confirm that it exhibits no trace of instability. At very small values of viscosity, however, we report the existence of oscillations of bounded amplitude in the vicinity of the shock, where gradient scale lengths become comparable with the grid size. As the viscosity decreases, the amplitude at which these oscillations saturate tends to increase. This indicates that, in spite of their nonlinear stability, entropic lattice Boltzmann models may become inaccurate when the ratio of gradient scale length to grid spacing becomes too small. Similar inaccuracies may limit the utility of the entropic lattice Boltzmann paradigm as a subgrid model of Navier-Stokes turbulence.
General relativistic Boltzmann equation, I: Covariant treatment
Debbasch, F.; van Leeuwen, W.A.
2009-01-01
This series of two articles aims at dissipating the rather dense haze existing in the present literature around the General Relativistic Boltzmann equation. In this first article, the general relativistic one-particle distribution function in phase space is defined as an average of delta functions.
Full Boltzmann equations for leptogenesis including scattering
Hahn-Woernle, F; Wong, Y Y Y
2009-01-01
We study the evolution of a cosmological baryon asymmetry produced via leptogenesis by means of the full classical Boltzmann equations, without the assumption of kinetic equilibrium and including all quantum statistical factors. Beginning with the full mode equations we derive the usual equations of motion for the right-handed neutrino number density and integrated lepton asymmetry, and show explicitly the impact of each assumption on these quantities. For the first time, we investigate also the effects of scattering of the right-handed neutrino with the top quark to leading order in the Yukawa couplings by means of the full Boltzmann equations. We find that in our full Boltzmann treatment the final lepton asymmetry can be suppressed by as much as a factor of 1.5 in the weak wash-out regime (K1), the full Boltzmann treatment and the integrated approach give nearly identical final lepton asymmetries (within 10 % of each other at K>3). Finally, we show that the opposing effects of quantum statistics on decays/i...
On the full Boltzmann equations for Leptogenesis
Garayoa, J; Pinto, T; Rius, N; Vives, O
2009-01-01
We consider the full Boltzmann equations for standard and soft leptogenesis, instead of the usual integrated Boltzmann equations which assume kinetic equilibrium for all species. Decays and inverse decays may be inefficient for thermalising the heavy-(s)neutrino distribution function, leading to significant deviations from kinetic equilibrium. We analyse the impact of using the full kinetic equations in the case of a previously generated lepton asymmetry, and find that the washout of this initial asymmetry due to the interactions of the right-handed neutrino is larger than when calculated via the integrated equations. We also solve the full Boltzmann equations for soft leptogenesis, where the lepton asymmetry induced by the soft SUSY-breaking terms in sneutrino decays is a purely thermal effect, since at T=0 the asymmetry in leptons cancels the one in sleptons. In this case, we obtain that in the weak washout regime (K ~< 1) the final lepton asymmetry can change up to a factor four with respect to previous...
On the full Boltzmann equations for leptogenesis
Energy Technology Data Exchange (ETDEWEB)
Garayoa, J.; Pastor, S.; Pinto, T.; Rius, N.; Vives, O., E-mail: garayoa@ific.uv.es, E-mail: pastor@ific.uv.es, E-mail: teguayco@gmail.com, E-mail: nuria@ific.uv.es, E-mail: vives@ific.uv.es [Depto. de Física Teórica and IFIC, Universidad de Valencia-CSIC, Edificio de Institutos de Paterna, Apt. 22085, 46071 Valencia (Spain)
2009-09-01
We consider the full Boltzmann equations for standard and soft leptogenesis, instead of the usual integrated Boltzmann equations which assume kinetic equilibrium for all species. Decays and inverse decays may be inefficient for thermalising the heavy-(s)neutrino distribution function, leading to significant deviations from kinetic equilibrium. We analyse the impact of using the full kinetic equations in the case of a previously generated lepton asymmetry, and find that the washout of this initial asymmetry due to the interactions of the right-handed neutrino is larger than when calculated via the integrated equations. We also solve the full Boltzmann equations for soft leptogenesis, where the lepton asymmetry induced by the soft SUSY-breaking terms in sneutrino decays is a purely thermal effect, since at T = 0 the asymmetry in leptons cancels the one in sleptons. In this case, we obtain that in the weak washout regime (K ∼< 1) the final lepton asymmetry can change up to a factor four with respect to previous estimates.
Boltzmann equations for neutrinos with flavor mixings
Yamada, Shoichi
2000-01-01
With a view of applications to the simulations of supernova explosion and proto neutron star cooling, we derive the Boltzmann equations for the neutrino transport with the flavor mixing based on the real time formalism of the nonequilibrium field theory and the gradient expansion of the Green function. The relativistic kinematics is properly taken into account. The advection terms are derived in the mean field approximation for the neutrino self-energy whiles the collision terms are obtained ...
A Fluctuating Lattice Boltzmann Method for the Diffusion Equation
Wagner, Alexander J
2016-01-01
We derive a fluctuating lattice Boltzmann method for the diffusion equation. The derivation removes several shortcomings of previous derivations for fluctuating lattice Boltzmann methods for hydrodynamic systems. The comparative simplicity of this diffusive system highlights the basic features of this first exact derivation of a fluctuating lattice Boltzmann method.
Energy Technology Data Exchange (ETDEWEB)
Stoenescu, M.L.
1977-06-01
The terms in Boltzmann kinetic equation corresponding to elastic short range collisions, inelastic excitational collisions, coulomb interactions and electric field acceleration are evaluated numerically for a standard distribution function minimizing the computational volume by expressing the terms as linear combinations with recalculable coefficients, of the distribution function and its derivatives. The present forms are suitable for spatial distribution calculations.
Hot electrons in superlattices: quantum transport versus Boltzmann equation
DEFF Research Database (Denmark)
Wacker, Andreas; Jauho, Antti-Pekka; Rott, S.;
1999-01-01
A self-consistent solution of the transport equation is presented for semiconductor superlattices within different approaches: (i) a full quantum transport model based on nonequilibrium Green functions, (ii) the semiclassical Boltzmann equation for electrons in a miniband, and (iii) Boltzmann...
Soluble Boltzmann equations for internal state and Maxwell models
Futcher, E.; Hoare, M.R.; Hendriks, E.M.; Ernst, M.H.
1980-01-01
We consider a class of scalar nonlinear Boltzmann equations describing the evolution of a microcanonical ensemble in which sub-systems exchange internal energy ‘randomly’ in binary interactions. In the continuous variable version these models can equally be interpreted as Boltzmann equations for Ma
Comparison of Boltzmann Equations with Quantum Dynamics for Scalar Fields
Lindner, Manfred; Lindner, Manfred; Muller, Markus Michael
2006-01-01
Boltzmann equations are often used to study the thermal evolution of particle reaction networks. Prominent examples are the computation of the baryon asymmetry of the universe and the evolution of the quark-gluon plasma after relativistic heavy ion collisions. However, Boltzmann equations are only a classical approximation of the quantum thermalization process which is described by the so-called Kadanoff-Baym equations. This raises the question how reliable Boltzmann equations are as approximations to the full Kadanoff-Baym equations. Therefore, we present in this paper a detailed comparison between the Kadanoff-Baym and Boltzmann equations in the framework of a scalar Phi^4 quantum field theory in 3+1 space-time dimensions. The obtained numerical solutions reveal significant discrepancies in the results predicted by both types of equations. Most notably, apart from quantitative discrepancies, on a qualitative level the universality observed for the Kadanoff-Baym equations is severely restricted in the case o...
Analysis of Jeans instability from Boltzmann equation
Kremer, Gilberto M
2015-01-01
The dynamics of self-gravitating fluids is analyzed within the framework of a collisionless Boltzmann equation in the presence of gravitational fields and Poisson equation. The equilibrium distribution function takes into account the expansion of the Universe and a pressureless fluid in the matter dominated Universe. Without invoking Jeans "swindle" a dispersion relation is obtained by considering small perturbations of the equilibrium values of the distribution function and gravitational potential. The collapse criterion -- which happens in an unstable region where the solution grows exponentially with time -- is determined from the dispersion relation. The collapse criterion in a static Universe occurs when the wavenumber $k$ is smaller than the Jeans wavenumber $k_J$, which was the solution found by Jeans. For an expanding Universe it is shown that this criterion is $k\\leq\\sqrt{7/6}\\,k_J$. As a consequence the ratio of the mass contained in a sphere of diameter equal to the wavelength $\\lambda=2\\pi/k$ to t...
Thermal equation of state for lattice Boltzmann gases
Institute of Scientific and Technical Information of China (English)
Ran Zheng
2009-01-01
The Galilean invaxiance and the induced thermo-hydrodynamics of the lattice Boltzmann Bhatnagar-Gross-Krook model axe proposed together with their rigorous theoretical background. From the viewpoint of group invariance,recovering the Galilean invariance for the isothermal lattice Boltzmann Bhatnagar-Gross-Krook equation (LBGKE) induces a new natural thermal-dynamical system, which is compatible with the elementary statistical thermodynamics.
General relativistic Boltzmann equation, II: Manifestly covariant treatment
Debbasch, F.; van Leeuwen, W.A.
2009-01-01
In a preceding article we presented a general relativistic treatment of the derivation of the Boltzmann equation. The four-momenta occurring in this formalism were all on-shell four-momenta, verifying the mass-shell restriction p(2) = m(2)c(2). Due to this restriction, the resulting Boltzmann equati
Axisymmetric multiphase lattice Boltzmann method for generic equations of state
Reijers, S.A.; Gelderblom, H.; Toschi, F.
2016-01-01
We present an axisymmetric lattice Boltzmann model based on the Kupershtokh et al. multiphase model that is capable of solving liquid–gas density ratios up to 103. Appropriate source terms are added to the lattice Boltzmann evolution equation to fully recover the axisymmetric multiphase conservation
Upper Maxwellian bounds for the spatially homogeneous Boltzmann equation
Gamba, I. M.; Panferov, V.; Villani, C.
2007-01-01
For the spatially homogeneous Boltzmann equation with cutoff hard potentials it is shown that solutions remain bounded from above, uniformly in time, by a Maxwellian distribution, provided the initial data have a Maxwellian upper bound. The main technique is based on a comparison principle that uses a certain dissipative property of the linear Boltzmann equation. Implications of the technique to propagation of upper Maxwellian bounds in the spatially-inhomogeneous case are discussed.
Analysis of spectral methods for the homogeneous Boltzmann equation
Filbet, Francis
2011-04-01
The development of accurate and fast algorithms for the Boltzmann collision integral and their analysis represent a challenging problem in scientific computing and numerical analysis. Recently, several works were devoted to the derivation of spectrally accurate schemes for the Boltzmann equation, but very few of them were concerned with the stability analysis of the method. In particular there was no result of stability except when the method was modified in order to enforce the positivity preservation, which destroys the spectral accuracy. In this paper we propose a new method to study the stability of homogeneous Boltzmann equations perturbed by smoothed balanced operators which do not preserve positivity of the distribution. This method takes advantage of the "spreading" property of the collision, together with estimates on regularity and entropy production. As an application we prove stability and convergence of spectral methods for the Boltzmann equation, when the discretization parameter is large enough (with explicit bound). © 2010 American Mathematical Society.
Celebrating Cercignani's conjecture for the Boltzmann equation
Villani, Cédric
2011-01-01
Cercignani\\'s conjecture assumes a linear inequality between the entropy and entropy production functionals for Boltzmann\\'s nonlinear integral operator in rarefied gas dynamics. Related to the field of logarithmic Sobolev inequalities and spectral gap inequalities, this issue has been at the core of the renewal of the mathematical theory of convergence to thermodynamical equilibrium for rarefied gases over the past decade. In this review paper, we survey the various positive and negative results which were obtained since the conjecture was proposed in the 1980s. © American Institute of Mathematical Sciences.
Spinor Boltzmann Equation with Two Momenta at the Fermi Level
Institute of Scientific and Technical Information of China (English)
王正川
2012-01-01
Based on the formalism of Keldysh's nonequilibrium Green function, we establish a two momenta spinor Boltzmann equation for longitudinal scalar distribution function and transverse vector distribution function. The lon- gitudinal charge currents, transverse spin currents and the continuity equations satisfied by them are then studied, it indicates that both the charge currents and spin currents decay oscillately along with position, which is due to the momenta integral over the Fermi surface. We also compare our charge currents and spin currents with the corresponding results of one momentum spinor Boltzmann equation, the differences are obvious.
Generalized Relativistic Chapman-Enskog Solution of the Boltzmann Equation
García-Perciante, A L; García-Colin, L S
2007-01-01
The Chapman-Enskog method of solution of the relativistic Boltzmann equation is generalized in order to admit a time-derivative term associated to the thermodynamic force in its first order solution. Both existence and uniqueness of such a solution are proved based on the standard theory of integral equations. The mathematical implications of the generalization here introduced are briefly explored.
Celebrating Cercignani's conjecture for the Boltzmann equation
Desvillettes, Laurent; Villani, Cédric
2010-01-01
Cercignani's conjecture assumes a linear inequality between the entropy and entropy production functionals for Boltzmann's nonlinear integral operator in rarefied gas dynamics. Related to the field of logarithmic Sobolev inequalities and spectral gap inequalities, this issue has been at the core of the renewal of the mathematical theory of convergence to thermodynamical equilibrium for rarefied gases over the past decade. In this review paper, we survey the various positive and negative results which were obtained since the conjecture was proposed in the 1980s.
Acoustic limit of the Boltzmann equation: classical solutions
Jang, Juhi; Jiang, Ning
2009-01-01
We study the acoustic limit from the Boltzmann equation in the framework of classical solutions. For a solution $F_\\varepsilon=\\mu +\\varepsilon \\sqrt{\\mu}f_\\varepsilon$ to the rescaled Boltzmann equation in the acoustic time scaling \\partial_t F_\\varepsilon +\\vgrad F_\\varepsilon =\\frac{1}{\\varepsilon} \\Q(F_\\varepsilon,F_\\varepsilon), inside a periodic box $\\mathbb{T}^3$, we establish the global-in-time uniform energy estimates of $f_\\varepsilon$ in $\\varepsilon$ and prove that $f_\\varepsilon$...
Axisymmetric multiphase Lattice Boltzmann method for generic equations of state
Reijers, Sten A; Toschi, Federico
2015-01-01
We present an axisymmetric lattice Boltzmann model based on the Kupershtokh et al. multiphase model that is capable of solving liquid-gas density ratios up to $10^3$. Appropriate source terms are added to the lattice Boltzmann evolution equation to fully recover the axisymmetric multiphase conservation equations. We validate the model by showing that a stationary droplet obeys the Young-Laplace law, comparing the second oscillation mode of a droplet with respect to an analytical solution and showing correct mass conservation of a propagating density wave.
Numerical solution of Boltzmann's equation
Energy Technology Data Exchange (ETDEWEB)
Sod, G.A.
1976-04-01
The numerical solution of Boltzmann's equation is considered for a gas model consisting of rigid spheres by means of Hilbert's expansion. If only the first two terms of the expansion are retained, Boltzmann's equation reduces to the Boltzmann-Hilbert integral equation. Successive terms in the Hilbert expansion are obtained by solving the same integral equation with a different source term. The Boltzmann-Hilbert integral equation is solved by a new very fast numerical method. The success of the method rests upon the simultaneous use of four judiciously chosen expansions; Hilbert's expansion for the distribution function, another expansion of the distribution function in terms of Hermite polynomials, the expansion of the kernel in terms of the eigenvalues and eigenfunctions of the Hilbert operator, and an expansion involved in solving a system of linear equations through a singular value decomposition. The numerical method is applied to the study of the shock structure in one space dimension. Numerical results are presented for Mach numbers of 1.1 and 1.6. 94 refs, 7 tables, 1 fig.
Metamaterial characterization using Boltzmann's kinetic equation for electrons
DEFF Research Database (Denmark)
Novitsky, Andrey; Zhukovsky, Sergei; Novitsky, D.;
2013-01-01
Statistical properties of electrons in metals are taken into consideration to describe the microscopic motion of electrons. Assuming degenerate electron gas in metal, we introduce the Boltzmann kinetic equation to supplement Maxwell's equations. The solution of these equations clearly shows the r...... the resonant behavior of electronic response to an external electromagnetic field. We demonstrate the approach for planar and circular geometries of the metamolecules....
Thermal creep problems by the discrete Boltzmann equation
Directory of Open Access Journals (Sweden)
L. Preziosi
1991-05-01
Full Text Available This paper deals with an initial-boundary value problem for the discrete Boltzmann equation confined between two moving walls at different temperature. A model suitable for the quantitative analysis of the initial boundary value problem and the relative existence theorem are given.
CORRECTIONS TO THE COLLISION TERM IN THE BGK BOLTZMANN EQUATION
Institute of Scientific and Technical Information of China (English)
FENG SHI-DE; REN RONG-CAI; CUI XIAO-PENG; JI ZHONG-ZHEN
2001-01-01
With the discrete method of the hexagonal cell and three different velocities of particle population in each cell,a two-dimensional lattice Boltzmann model is developed in this paper.[1,2] The collision operator in the Boltzmann equation is expanded to fourth order using the Taylor expansion.[3,4] With this model, good results have been obtained from the numerical simulation of the reflection phenomenon of the shock wave on the surface of an obstacle, and the numerical stability is also good. Thus the applicability of the D2Q19 model is verified.
Classical Boltzmann equation and high-temperature QED
Brandt, F. T.; Ferreira, R. B.; Thuorst, J. F.
2015-01-01
The equivalence between thermal field theory and the Boltzmann transport equation is investigated at higher orders in the context of quantum electrodynamics. We compare the contributions obtained from the collisionless transport equation with the high temperature limit of the one-loop thermal Green's function. Our approach employs the representation of the thermal Green's functions in terms of forward scattering amplitudes. The general structure of these amplitudes clearly indicates that the ...
The Nonclassical Diffusion Approximation to the Nonclassical Linear Boltzmann Equation
Vasques, Richard
2015-01-01
We show that, by correctly selecting the probability distribution function $p(s)$ for a particle's distance-to-collision, the nonclassical diffusion equation can be represented exactly by the nonclassical linear Boltzmann equation for an infinite homogeneous medium. This choice of $p(s)$ preserves the $true$ mean-squared free path of the system, which sheds new light on the results obtained in previous work.
Analysis of Jeans instability from the Boltzmann equation
Kremer, Gilberto M.
2016-11-01
The dynamics of self-gravitating fluids is analyzed within the framework of a collisionless Boltzmann equation in the presence of gravitational fields and Poisson equation. Two cases are analyzed: a system with baryonic and dark matter in a static universe and a single system in an expanding universe. The amplitudes of the perturbed distribution functions are considered as a linear combination of the collision invariants of the Boltzmann equation. For the system of baryonic and dark matter, the Jeans mass of the combined system is smaller than the one of the single system indicating that a smaller mass is needed to initiate the collapse. For the single system in an expanding universe it is not necessary to make use of Jeans "swindle"and it shown that for small wavelengths the density contrast oscillates while for large wavelengths it grows with time and the Jeans instability emerges.
CMB spectral distortions as solutions to the Boltzmann equations
Ota, Atsuhisa
2016-01-01
We newly re-interpret cosmic microwave background spectral distortions as solutions to the Boltzmann equation at second order. This approach makes it possible to solve the equation of the momentum dependent temperature perturbations explicitly. In addition, we define higher order spectral distortions systematically, assuming that the collision term is linear in the photon distribution functions. For example, we find the linear Sunyaev-Zel'dovich effect whose momentum shape is different from the usual $y$ distortion, and show that the higher order spectral distortions are also generated as a result of the diffusion process in a language of higher order Boltzmann equations. The method may be applicable to a wider class of problems and has potential to give a general prescription to non-equilibrium physics.
Classical Boltzmann equation and high-temperature QED
Brandt, F. T.; Ferreira, R. B.; Thuorst, J. F.
2015-02-01
The equivalence between thermal field theory and the Boltzmann transport equation is investigated at higher orders in the context of quantum electrodynamics. We compare the contributions obtained from the collisionless transport equation with the high temperature limit of the one-loop thermal Green's function. Our approach employs the representation of the thermal Green's functions in terms of forward scattering amplitudes. The general structure of these amplitudes clearly indicates that the physics described by the leading high temperature limit of quantum electrodynamics can be obtained from the Boltzman transport equation. We also present some explicit examples of this interesting equivalence.
Classical Boltzmann equation and high-temperature QED
Brandt, F T; Thuorst, J F
2015-01-01
The equivalence between thermal field theory and the Boltzmann transport equation is investigated at higher orders in the context of Quantum Electrodynamics. We compare the contributions obtained from the collisionless transport equation with the high temperature limit of the one-loop thermal Green's function. Our approach employs the representation of the thermal Green's functions in terms of forward scattering amplitudes. The general structure of these amplitudes clearly indicates that the physics described by the leading high temperature limit of Quantum Electrodynamics can be obtained from the Boltzman transport equation. We also present some explicit examples of this interesting equivalence.
Dynamics of annihilation. I. Linearized Boltzmann equation and hydrodynamics.
García de Soria, María Isabel; Maynar, Pablo; Schehr, Grégory; Barrat, Alain; Trizac, Emmanuel
2008-05-01
We study the nonequilibrium statistical mechanics of a system of freely moving particles, in which binary encounters lead either to an elastic collision or to the disappearance of the pair. Such a system of ballistic annihilation therefore constantly loses particles. The dynamics of perturbations around the free decay regime is investigated using the spectral properties of the linearized Boltzmann operator, which characterize linear excitations on all time scales. The linearized Boltzmann equation is solved in the hydrodynamic limit by a projection technique, which yields the evolution equations for the relevant coarse-grained fields and expressions for the transport coefficients. We finally present the results of molecular dynamics simulations that validate the theoretical predictions.
Efficient Asymptotic Preserving Deterministic methods for the Boltzmann Equation
2011-04-01
important role in modelling granular gases (Bobylev et al., 2000), charged particles in semiconductors (Markowich et al., 1989), neutron transport (Jin...1.6 The splitting approach 1 THE BOLTZMANN EQUATION • Granular gas models : particles undergo inelastic collisions . Energy is dissipated by the model ...A model for collision processes in gases i. small amplitute processes in charged and neutral one component systems. Phys. Rev., 94:511–525. 8
Asymptotic stability of the Boltzmann equation with Maxwell boundary conditions
Briant, Marc; Guo, Yan
2016-12-01
In a general C1 domain, we study the perturbative Cauchy theory for the Boltzmann equation with Maxwell boundary conditions with an accommodation coefficient α in (√{ 2 / 3 } , 1 ], and discuss this threshold. We consider polynomial or stretched exponential weights m (v) and prove existence, uniqueness and exponential trend to equilibrium around a global Maxwellian in Lx,v∞ (m). Of important note is the fact that the methods do not involve contradiction arguments.
LATTICE BOLTZMANN EQUATION MODEL IN THE CORIOLIS FIELD
Institute of Scientific and Technical Information of China (English)
FENG SHI-DE; MAO JIANG-YU; ZHANG QIONG
2001-01-01
In a large-scale field of rotational fluid, various unintelligible and surprising dynamic phenomena are produced due to the effect of the Coriolis force. The lattice Boltzmann equation (LBE) model in the Coriolis field is developed based on previous works.[1-4] Geophysical fluid dynamics equations are derived from the model. Numerical simulations have been made on an ideal atmospheric circulation of the Northern Hemisphere by using the model and they reproduce the Rossby wave motion well. Hence the applicability of the model is verified in both theory and experiment.
Lattice Boltzmann method for the fractional advection-diffusion equation
Zhou, J. G.; Haygarth, P. M.; Withers, P. J. A.; Macleod, C. J. A.; Falloon, P. D.; Beven, K. J.; Ockenden, M. C.; Forber, K. J.; Hollaway, M. J.; Evans, R.; Collins, A. L.; Hiscock, K. M.; Wearing, C.; Kahana, R.; Villamizar Velez, M. L.
2016-04-01
Mass transport, such as movement of phosphorus in soils and solutes in rivers, is a natural phenomenon and its study plays an important role in science and engineering. It is found that there are numerous practical diffusion phenomena that do not obey the classical advection-diffusion equation (ADE). Such diffusion is called abnormal or superdiffusion, and it is well described using a fractional advection-diffusion equation (FADE). The FADE finds a wide range of applications in various areas with great potential for studying complex mass transport in real hydrological systems. However, solution to the FADE is difficult, and the existing numerical methods are complicated and inefficient. In this study, a fresh lattice Boltzmann method is developed for solving the fractional advection-diffusion equation (LabFADE). The FADE is transformed into an equation similar to an advection-diffusion equation and solved using the lattice Boltzmann method. The LabFADE has all the advantages of the conventional lattice Boltzmann method and avoids a complex solution procedure, unlike other existing numerical methods. The method has been validated through simulations of several benchmark tests: a point-source diffusion, a boundary-value problem of steady diffusion, and an initial-boundary-value problem of unsteady diffusion with the coexistence of source and sink terms. In addition, by including the effects of the skewness β , the fractional order α , and the single relaxation time τ , the accuracy and convergence of the method have been assessed. The numerical predictions are compared with the analytical solutions, and they indicate that the method is second-order accurate. The method presented will allow the FADE to be more widely applied to complex mass transport problems in science and engineering.
Lattice Boltzmann method for the fractional advection-diffusion equation.
Zhou, J G; Haygarth, P M; Withers, P J A; Macleod, C J A; Falloon, P D; Beven, K J; Ockenden, M C; Forber, K J; Hollaway, M J; Evans, R; Collins, A L; Hiscock, K M; Wearing, C; Kahana, R; Villamizar Velez, M L
2016-04-01
Mass transport, such as movement of phosphorus in soils and solutes in rivers, is a natural phenomenon and its study plays an important role in science and engineering. It is found that there are numerous practical diffusion phenomena that do not obey the classical advection-diffusion equation (ADE). Such diffusion is called abnormal or superdiffusion, and it is well described using a fractional advection-diffusion equation (FADE). The FADE finds a wide range of applications in various areas with great potential for studying complex mass transport in real hydrological systems. However, solution to the FADE is difficult, and the existing numerical methods are complicated and inefficient. In this study, a fresh lattice Boltzmann method is developed for solving the fractional advection-diffusion equation (LabFADE). The FADE is transformed into an equation similar to an advection-diffusion equation and solved using the lattice Boltzmann method. The LabFADE has all the advantages of the conventional lattice Boltzmann method and avoids a complex solution procedure, unlike other existing numerical methods. The method has been validated through simulations of several benchmark tests: a point-source diffusion, a boundary-value problem of steady diffusion, and an initial-boundary-value problem of unsteady diffusion with the coexistence of source and sink terms. In addition, by including the effects of the skewness β, the fractional order α, and the single relaxation time τ, the accuracy and convergence of the method have been assessed. The numerical predictions are compared with the analytical solutions, and they indicate that the method is second-order accurate. The method presented will allow the FADE to be more widely applied to complex mass transport problems in science and engineering.
Generalizing the Boltzmann equation in complex phase space
Zadehgol, Abed
2016-08-01
In this work, a generalized form of the BGK-Boltzmann equation is proposed, where the velocity, position, and time can be represented by real or complex variables. The real representation leads to the conventional BGK-Boltzmann equation, which can recover the continuity and Navier-Stokes equations. We show that the complex representation yields a different set of equations, and it can also recover the conservation and Navier-Stokes equations, at low Mach numbers, provided that the imaginary component of the macroscopic mass can be neglected. We briefly review the Constant Speed Kinetic Model (CSKM), which was introduced in Zadehgol and Ashrafizaadeh [J. Comp. Phys. 274, 803 (2014), 10.1016/j.jcp.2014.06.053] and Zadehgol [Phys. Rev. E 91, 063311 (2015), 10.1103/PhysRevE.91.063311]. The CSKM is then used as a basis to show that the complex-valued equilibrium distribution function of the present model can be identified with a simple singularity in the complex phase space. The virtual particles, in the present work, are concentrated on virtual "branes" which surround the computational nodes. Employing the Cauchy integral formula, it is shown that certain variations of the "branes," in the complex phase space, do not affect the local kinetic states. This property of the new model, which is referred to as the "apparent jumps" in the present work, is used to construct new models. The theoretical findings have been tested by simulating three benchmark flows. The results of the present simulations are in excellent agreement with the previous results reported by others.
Energy Technology Data Exchange (ETDEWEB)
Zabadal, Jorge; Borges, Volnei; Van der Laan, Flavio T., E-mail: jorge.zabadal@ufrgs.br, E-mail: borges@ufrgs.br, E-mail: ftvdl@ufrgs.br [Universidade Federal do Rio Grande do Sul (UFRGS), Porto Alegre, RS (Brazil). Departamento de Engenharia Mecanica. Grupo de Pesquisas Radiologicas; Ribeiro, Vinicius G., E-mail: vinicius_ribeiro@uniritter.edu.br [Centro Universitario Ritter dos Reis (UNIRITTER), Porto Alegre, RS (Brazil); Santos, Marcio G., E-mail: phd.marcio@gmail.com [Universidade Federal do Rio Grande do Sul (UFRGS), Tramandai, RS (Brazil). Departamento Interdisciplinar do Campus Litoral Norte
2015-07-01
This work presents a new analytical method for solving the Boltzmann equation. In this formulation, a linear differential operator is applied over the Boltzmann model, in order to produce a partial differential equation in which the scattering term is absent. This auxiliary equation is solved via reduction of order. The exact solution obtained is employed to define a precursor for the buildup factor. (author)
Nonaligned shocks for discrete velocity models of the Boltzmann equation
Directory of Open Access Journals (Sweden)
J. M. Greenberg
1991-05-01
Full Text Available At the conclusion of I. Bonzani's presentation on the existence of structured shock solutions to the six-velocity, planar, discrete Boltzmann equation (with binary and triple collisions, Greenberg asked whether such solutions were possible in directions e(α=(cosα ,sinα when α was not one of the particle flow directions. This question generated a spirited discussion but the question was still open at the conclusion of the conference. In this note the author will provide a partial resolution to the question raised above. Using formal perturbation arguments he will produce approximate solutions to the equation considered by Bonzani which represent traveling waves propagating in any direction e(α=(cosα ,sinα.
Interplay of Boltzmann equation and continuity equation for accelerated electrons in solar flares
Codispoti, Anna
2015-01-01
During solar flares a large amount of electrons are accelerated within the plasma present in the solar atmosphere. Accurate measurements of the motion of these electrons start becoming available from the analysis of hard X-ray imaging-spectroscopy observations. In this paper, we discuss the linearized perturbations of the Boltzmann kinetic equation describing an ensemble of electrons accelerated by the energy release occurring during solar flares. Either in the limit of high energy or at vanishing background temperature such an equation reduces to a continuity equation equipped with an extra force of stochastic nature. This stochastic force is actually described by the well known energy loss rate due to Coulomb collision with ambient particles, but, in order to match the collision kernel in the linearized Boltzmann equation it needs to be treated in a very specific manner. In the second part of the paper the derived continuity equation is solved with some hyperbolic techniques, and the obtained solution is wr...
Global Solutions of the Boltzmann Equation Over {{R}^D} Near Global Maxwellians with Small Mass
Bardos, Claude; Gamba, Irene M.; Golse, François; Levermore, C. David
2016-09-01
We study the dynamics defined by the Boltzmann equation set in the Euclidean space {{R}^D} in the vicinity of global Maxwellians with finite mass. A global Maxwellian is a special solution of the Boltzmann equation for which the collision integral vanishes identically. In this setting, the dispersion due to the advection operator quenches the dissipative effect of the Boltzmann collision integral. As a result, the large time limit of solutions of the Boltzmann equation in this regime is given by noninteracting, freely transported states and can be described with the tools of scattering theory.
Information Geometry Formalism for the Spatially Homogeneous Boltzmann Equation
Directory of Open Access Journals (Sweden)
Bertrand Lods
2015-06-01
Full Text Available Information Geometry generalizes to infinite dimension by modeling the tangent space of the relevant manifold of probability densities with exponential Orlicz spaces. We review here several properties of the exponential manifold on a suitable set Ɛ of mutually absolutely continuous densities. We study in particular the fine properties of the Kullback-Liebler divergence in this context. We also show that this setting is well-suited for the study of the spatially homogeneous Boltzmann equation if Ɛ is a set of positive densities with finite relative entropy with respect to the Maxwell density. More precisely, we analyze the Boltzmann operator in the geometric setting from the point of its Maxwell’s weak form as a composition of elementary operations in the exponential manifold, namely tensor product, conditioning, marginalization and we prove in a geometric way the basic facts, i.e., the H-theorem. We also illustrate the robustness of our method by discussing, besides the Kullback-Leibler divergence, also the property of Hyvärinen divergence. This requires us to generalize our approach to Orlicz–Sobolev spaces to include derivatives.
Acoustic equations of state for simple lattice Boltzmann velocity sets.
Viggen, Erlend Magnus
2014-07-01
The lattice Boltzmann (LB) method typically uses an isothermal equation of state. This is not sufficient to simulate a number of acoustic phenomena where the equation of state cannot be approximated as linear and constant. However, it is possible to implement variable equations of state by altering the LB equilibrium distribution. For simple velocity sets with velocity components ξ(iα)∈(-1,0,1) for all i, these equilibria necessarily cause error terms in the momentum equation. These error terms are shown to be either correctable or negligible at the cost of further weakening the compressibility. For the D1Q3 velocity set, such an equilibrium distribution is found and shown to be unique. Its sound propagation properties are found for both forced and free waves, with some generality beyond D1Q3. Finally, this equilibrium distribution is applied to a nonlinear acoustics simulation where both mechanisms of nonlinearity are simulated with good results. This represents an improvement on previous such simulations and proves that the compressibility of the method is still sufficiently strong even for nonlinear acoustics.
An Exact Solution to the Two-Particle Boltzmann Equation System for Maxwell Gases
Institute of Scientific and Technical Information of China (English)
布仁满都拉; 赵迎春
2012-01-01
An exact solution to the two-particle Boltzmann equation system for Maxwell gases is obtained with use of Bobylev approach.The relationship between the exact solution and the self-similar solution of the boltzmann equation is also given.
Electric Conductivity from the solution of the Relativistic Boltzmann Equation
Puglisi, A; Greco, V
2014-01-01
We present numerical results of electric conductivity $\\sigma_{el}$ of a fluid obtained solving the Relativistic Transport Boltzmann equation in a box with periodic boundary conditions. We compute $\\sigma_{el}$ using two methods: the definition itself, i.e. applying an external electric field, and the evaluation of the Green-Kubo relation based on the time evolution of the current-current correlator. We find a very good agreement between the two methods. We also compare numerical results with analytic formulas in Relaxation Time Approximation (RTA) where the relaxation time for $\\sigma_{el}$ is determined by the transport cross section $\\sigma_{tr}$, i.e. the differential cross section weighted with the collisional momentum transfer. We investigate the electric conductivity dependence on the microscopic details of the 2-body scatterings: isotropic and anisotropic cross-section, and massless and massive particles. We find that the RTA underestimates considerably $\\sigma_{el}$; for example at screening masses $...
Discretization of the velocity space in solution of the Boltzmann equation
Shan, X; Shan, Xiaowen; He, Xiaoyi
1998-01-01
We point out an equivalence between the discrete velocity method of solving the Boltzmann equation, of which the lattice Boltzmann equation method is a special example, and the approximations to the Boltzmann equation by a Hermite polynomial expansion. Discretizing the Boltzmann equation with a BGK collision term at the velocities that correspond to the nodes of a Hermite quadrature is shown to be equivalent to truncating the Hermite expansion of the distribution function to the corresponding order. The truncated part of the distribution has no contribution to the moments of low orders and is negligible at small Mach numbers. Higher order approximations to the Boltzmann equation can be achieved by using more velocities in the quadrature.
On kinetic Boltzmann equations and related hydrodynamic flows with dry viscosity
Directory of Open Access Journals (Sweden)
Nikolai N. Bogoliubov (Jr.
2007-01-01
Full Text Available A two-component particle model of Boltzmann-Vlasov type kinetic equations in the form of special nonlinear integro-differential hydrodynamic systems on an infinite-dimensional functional manifold is discussed. We show that such systems are naturally connected with the nonlinear kinetic Boltzmann-Vlasov equations for some one-dimensional particle flows with pointwise interaction potential between particles. A new type of hydrodynamic two-component Benney equations is constructed and their Hamiltonian structure is analyzed.
A Lattice Boltzmann Model and Simulation of KdV-Burgers Equation
Institute of Scientific and Technical Information of China (English)
ZHANGChao-Ying; TANHui-Li; LIUMu-Ren; KONGLing-Jiang
2004-01-01
A lattice Boltzmann model of KdV-Burgers equation is derived by using the single-relaxation form of the lattice Boltzmann equation. With the present model, we simulate the traveling-wave solutions, the solitary-wave solutions, and the sock-wave solutions of KdV-Burgers equation, and calculate the decay factor and the wavelength of the sock-wave solution, which has exponential decay. The numerical results agree with the analytical solutions quite well.
A New Lattice Boltzmann Model for KdV-Burgers Equation
Institute of Scientific and Technical Information of China (English)
MA Chang-Feng
2005-01-01
@@ A new lattice Boltzmann model with amending-function for KdV-Burgers equation, ut +uux - αuxx +βuxxx = 0,is presented by using the single-relaxation form of the lattice Boltzmann equation. Applying the proposed model,we simulate the solutions ofa kind of KdV-Burgers equations, and the numerical results agree with the analytical solutions quite well.
Distributional Monte Carlo Methods for the Boltzmann Equation
2013-03-01
become the first to possess non - Maxwellian distributions, and therefore become the only location where 112 collisions are required to be calculated... Maxwellian . . . . . . . . . . . . . . . . . 16 fMB Maxwell-Boltzmann Density . . . . . . . . . . . . . . . . . . . . . . . . 16 nMB Maxwell-Boltzmann...is equivalent to assuming that millions of actual particles all share the exact velocity vector. This assumption is non -physical in the sense that
An introduction to the Boltzmann equation and transport processes in gases
Energy Technology Data Exchange (ETDEWEB)
Kremer, Gilberto Medeiros [Universidade Federal do Parana, Curitiba (Brazil). Dept. de Fisica
2010-07-01
This book deals with the classical kinetic theory of gases. Its aim is to present the basic principles of this theory within an elementary framework and from a more rigorous approach based on the Boltzmann equation. The subjects are presented in a self-contained manner such that the readers can understand and learn some methods used in the kinetic theory of gases in order to investigate the Boltzmann equation. It is expected that this book could be useful as a textbook for students and researchers who are interested in the principles of the Boltzmann equation and in the methods used in the kinetic theory of gases. (orig.)
A Stability Notion for the viscous Shallow Water Lattice Boltzmann Equations
Banda, Mapundi K
2015-01-01
The stability of Lattice Boltzmann Equations modelling Shallow Water Equations in the special case of reduced gravity is investigated theoretically. A stability notion is defined as applied in incompressible Navier-Stokes equations in Banda, M. K., Yong, W.- A. and Klar, A: A stability notion for lattice Boltzmann equations. SIAM J. Sci. Comput. {\\bf 27(6)}, 2098-2111 (2006). It is found that to maintain stability a careful choice of the value of the reduced gravity must be made. The stability notion is employed to investigate different shallow water lattice Boltzmann Equations. The effect of the reduced gravity on the mechanism of instability is investigated. Results are tested using the Lattice Boltzmann Method for various values of the governing parameters of the flow. It is observed that even for the discrete model the reduced gravity has a significant effect on the stability.
Equations of motion of test particles for solving the spin-dependent Boltzmann-Vlasov equation
Xia, Yin; Li, Bao-An; Shen, Wen-Qing
2016-01-01
A consistent derivation of the equations of motion (EOMs) of test particles for solving the spin-dependent Boltzmann-Vlasov equation is presented. Though the obtained EOMs are general, they are particularly useful in simulating nucleon spinor transport in heavy-ion collisions at intermediate energies. It is shown that the nucleon transverse flow in heavy-ion collisions especially those involving polarized projectile and/or target nuclei depends strongly on the spin-orbit coupling. Future comparisons of model simulations with experimental data will help constrain the poorly known in-medium nucleon spin-orbit coupling relevant for understanding properties of rare isotopes and their astrophysical impacts.
Equivalence Between Forward and Backward Boltzmann Equations in Multi-Component Medium
Institute of Scientific and Technical Information of China (English)
张竹林
2002-01-01
The author generalized the propagator function theory introduced first by Sigmund, and gave a explicitly proof of a equivalence between forward and backward Boltzmann equations in a multi-component medium by using the generalized propagator function theory.
Gevrey Regularity for the Noncutoff Nonlinear Homogeneous Boltzmann Equation with Strong Singularity
Directory of Open Access Journals (Sweden)
Shi-you Lin
2014-01-01
Full Text Available The Cauchy problem of the nonlinear spatially homogeneous Boltzmann equation without angular cutoff is studied. By using analytic techniques, one proves the Gevrey regularity of the C∞ solutions in non-Maxwellian and strong singularity cases.
Computational Aeroacoustics Using the Generalized Lattice Boltzmann Equation Project
National Aeronautics and Space Administration — The overall objective of the proposed project is to develop a generalized lattice Boltzmann (GLB) approach as a potential computational aeroacoustics (CAA) tool for...
Note on Invariance of One-Dimensional Lattice-Boltzmann Equation
Institute of Scientific and Technical Information of China (English)
RAN Zheng
2007-01-01
Invariance of the one-dimensional lattice Boltzmann model is proposed together with its rigorous theoretical background.It is demonstrated that the symmetry inherent in Navier-Stokes equations is not really recovered in the one-dimensional lattice Boltzmann equation (LBE),especially for shock calculation.Symmetry breaking may be the inherent cause for the non-physical oscillations in the vicinity of the shock for LBE calculation.
THE NON-CUTOFF BOLTZMANN EQUATION WITH POTENTIAL FORCE IN THE WHOLE SPACE
Institute of Scientific and Technical Information of China (English)
Yuanjie LEI
2014-01-01
This paper is concerned with the non-cutoff Boltzmann equation for full-range interactions with potential force in the whole space. We establish the global existence and optimal temporal convergence rates of classical solutions to the Cauchy problem when initial data is a small perturbation of the stationary solution. The analysis is based on the time-weighted energy method building also upon the recent studies of the non-cutoff Boltzmann equation in [1-3, 15] and the non-cutoff Vlasov-Poisson-Boltzmann system [6].
A Stability notion for the viscous Shallow Water Discrete-Velocity Boltzmann Equations
Banda, Mapundi K.; Uoane, Tumelo R. A.
2015-01-01
The stability of Lattice Boltzmann Equations modelling Shallow Water Equations in the special case of reduced gravity is investigated theoretically. A stability notion is defined as applied in incompressible Navier-Stokes equations in Banda, M. K., Yong, W.- A. and Klar, A: A stability notion for lattice Boltzmann equations. SIAM J. Sci. Comput. {\\bf 27(6)}, 2098-2111 (2006). It is found that to maintain stability a careful choice of the value of the reduced gravity must be made. The stabilit...
Lattice Boltzmann Model for The Volume-Averaged Navier-Stokes Equations
Zhang, Jingfeng; Ouyang, Jie
2014-01-01
A numerical method, based on discrete lattice Boltzmann equation, is presented for solving the volume-averaged Navier-Stokes equations. With a modified equilibrium distribution and an additional forcing term, the volume-averaged Navier-Stokes equations can be recovered from the lattice Boltzmann equation in the limit of small Mach number by the Chapman-Enskog analysis and Taylor expansion. Due to its advantages such as explicit solver and inherent parallelism, the method appears to be more competitive with traditional numerical techniques. Numerical simulations show that the proposed model can accurately reproduce both the linear and nonlinear drag effects of porosity in the fluid flow through porous media.
Energy Technology Data Exchange (ETDEWEB)
Uchaikin, V V; Sibatov, R T, E-mail: vuchaikin@gmail.com, E-mail: ren_sib@bk.ru [Ulyanovsk State University, 432000, 42 Leo Tolstoy str., Ulyanovsk (Russian Federation)
2011-04-08
The fractional Boltzmann equation for resonance radiation transport in plasma is proposed. We start with the standard Boltzmann equation; averaging over photon frequencies leads to the appearance of a fractional derivative. This fact is in accordance with the conception of latent variables leading to hereditary and non-local dynamics (in particular, fractional dynamics). The presence of a fractional material derivative in the equation is concordant with heavy tailed distribution of photon path lengths and with spatiotemporal coupling peculiar to the process. We discuss some methods of solving the obtained equation and demonstrate numerical results in some simple cases.
Bazow, D; Heinz, U; Martinez, M; Noronha, J
2016-01-01
The dissipative dynamics of an expanding massless gas with constant cross section in a spatially flat Friedmann-Lema\\^itre-Robertson-Walker (FLRW) universe is studied. The mathematical problem of solving the full nonlinear relativistic Boltzmann equation is recast into an infinite set of nonlinear ordinary differential equations for the moments of the one-particle distribution function. Momentum-space resolution is determined by the number of non-hydrodynamic modes included in the moment hierarchy, i.e., by the truncation order. We show that in the FLRW spacetime the non-hydrodynamic modes decouple completely from the hydrodynamic degrees of freedom. This results in the system flowing as an ideal fluid while at the same time producing entropy. The solutions to the nonlinear Boltzmann equation exhibit transient tails of the distribution function with nontrivial momentum dependence. The evolution of this tail is not correctly captured by the relaxation time approximation nor by the linearized Boltzmann equation...
Discrete Boltzmann model of shallow water equations with polynomial equilibria
Meng, Jianping; Emerson, David R; Peng, Yong; Zhang, Jianmin
2016-01-01
A hierarchy of discrete Boltzmann model is proposed for simulating shallow water flows. By using the Hermite expansion and Gauss-Hermite quadrature, the conservation laws are automatically satisfied without extra effort. Moreover, the expansion order and quadrature can be chosen flexibly according to the problem for striking the balance of accuracy and efficiency. The models are then tested using the classical one-dimensional dam-breaking problem, and successes are found for both supercritical and subcritical flows.
A New Regularization Mechanism for the Boltzmann Equation Without Cut-Off
Silvestre, Luis
2016-11-01
We apply recent results on regularity for general integro-differential equations to derive a priori estimates in Hölder spaces for the space homogeneous Boltzmann equation in the non cut-off case. We also show an a priori estimate in {L^∞} which applies in the space inhomogeneous case as well, provided that the macroscopic quantities remain bounded.
An H Theorem for Boltzmann's Equation for the Yard-Sale Model of Asset Exchange
Boghosian, Bruce M.; Johnson, Merek; Marcq, Jeremy A.
2015-12-01
In recent work (Boghosian, Phys Rev E 89:042804-042825, 2014; Boghosian, Int J Mod Phys 25:1441008-1441015, 2014), Boltzmann and Fokker-Planck equations were derived for the "Yard-Sale Model" of asset exchange. For the version of the model without redistribution, it was conjectured, based on numerical evidence, that the time-asymptotic state of the model was oligarchy—complete concentration of wealth by a single individual. In this work, we prove that conjecture by demonstrating that the Gini coefficient, a measure of inequality commonly used by economists, is an H function of both the Boltzmann and Fokker-Planck equations for the model.
Green, B. I.; Vedula, Prakash
2013-07-01
An alternative approach for solution of the collisional Boltzmann equation for a lattice architecture is presented. In the proposed method, termed the collisional lattice Boltzmann method (cLBM), the effects of spatial transport are accounted for via a streaming operator, using a lattice framework, and the effects of detailed collisional interactions are accounted for using the full collision operator of the Boltzmann equation. The latter feature is in contrast to the conventional lattice Boltzmann methods (LBMs) where collisional interactions are modeled via simple equilibrium based relaxation models (e.g. BGK). The underlying distribution function is represented using weights and fixed velocity abscissas according to the lattice structure. These weights are evolved based on constraints on the evolution of generalized moments of velocity according to the collisional Boltzmann equation. It can be shown that the collision integral can be reduced to a summation of elementary integrals, which can be analytically evaluated. The proposed method is validated using studies of canonical microchannel Couette and Poiseuille flows (both body force and pressure driven) and the results are found to be in good agreement with those obtained from conventional LBMs and experiments where available. Unlike conventional LBMs, the proposed method does not involve any equilibrium based approximations and hence can be useful for simulation of highly nonequilibrium flows (for a range of Knudsen numbers) using a lattice framework.
Flavoured quantum Boltzmann equations from cQPA
Fidler, Christian; Kainulainen, Kimmo; Rahkila, Pyry Matti
2011-01-01
We develop a Boltzmann-type quantum transport theory for interacting fermion and scalar fields including both flavour and particle-antiparticle mixing. Our formalism is based on the coherent quasiparticle approximation (cQPA) for the 2-point correlation functions, whose extended phase-space structure contains new spectral shells for flavour- and particle-antiparticle coherence. We derive explicit cQPA propagators and Feynman rules for the transport theory. In particular the nontrivial Wightman functions can be written as composite operators $\\sim {\\cal A} F {\\cal A}$, which generalize the usual Kadanoff-Baym ansatz. Our numerical results show that particle-antiparticle coherence can strongly influence CP-violating flavour mixing even for relatively slowly-varying backgrounds. Thus, unlike recently suggested, these correlations cannot be neglected when studying asymmetry generation due to time-varying mass transition, for example in electroweak-type baryogenesis models. Finally, we show that the cQPA coherence...
Kinetic Description for a Suspension of Inelastic Spheres - Boltzmann and BGK Equations
2007-11-02
Kinetic description for a suspension of inelastic spheres - Boltzmann and BGK equations Cedric Croizet and Renee Gatignol Laboratoire de Modelisation ...Organization Name(s) and Address(es) Laboratoire de Modelisation en Mecanique - Universite Pierre et Marie Curie (Paris 6) et CNRS UMR 7607 - 4) place
Convergence Rate to Stationary Solutions for Boltzmann Equation with External Force
Institute of Scientific and Technical Information of China (English)
Seiji UKAI; Tong YANG; Huijiang ZHAO
2006-01-01
For the Boltzmann equation with an external force in the form of the gradient of a potential function in space variable, the stability of its stationary solutions as local Maxwellians was studied by S. Ukai et al. (2005) through the energy method. Based on this stability analysis and some techniques on analyzing the convergence rates to stationary solutions for the compressible Navier-Stokes equations, in this paper, we study the convergence rate to the above stationary solutions for the Boltzmann equation which is a fundamental equation in statistical physics for non-equilibrium rarefied gas. By combining the dissipation from the viscosity and heat conductivity on the fluid components and the dissipation on the non-fluid component through the celebrated H-theorem, a convergence rate of the same order as the one for the compressible Navier-Stokes is obtained by constructing some energy functionals.
Serov, S A
2013-01-01
In the article correct method for the kinetic Boltzmann equation asymptotic solution is formulated, the Hilbert's and Enskog's methods are discussed. The equations system of multicomponent non-equilibrium gas dynamics is derived, that corresponds to the first order in the approximate (asymptotic) method for solution of the system of kinetic Boltzmann equations. It is shown, that the velocity distribution functions of particles, obtained by the proposed method and by Enskog's method, within Enskog's approach, are equivalent up to the infinitesimal first order terms of the asymptotic expansion, but, generally speaking, differ in the next order. Interpretation of turbulent gas flow is proposed, as stratified on components gas flow, which is described by the derived equations system of multicomponent non-equilibrium gas dynamics.
A unified lattice Boltzmann model for some nonlinear partial differential equations
Energy Technology Data Exchange (ETDEWEB)
Chai Zhenhua [State Key Laboratory of Coal Combustion, Huazhong University of Science and Technology, Wuhan 430074 (China); Shi Baochang [Department of Mathematics, Huazhong University of Science and Technology, Wuhan 430074 (China)], E-mail: sbchust@126.com; Zheng Lin [Department of Mathematics, Huazhong University of Science and Technology, Wuhan 430074 (China)
2008-05-15
In this paper, a unified and novel lattice Boltzmann model is proposed for solving nonlinear partial differential equation that has the form DU{sub t} + {alpha}UU{sub x} + {beta}U{sup n}U{sub x} - {gamma}U{sub xx} + {delta} U{sub xxx} = F(x,t). Numerical results agree well with the analytical solutions and results derived by existing literature, which indicates the present model is satisfactory and efficient on solving nonlinear partial differential equations.
Steady detonation waves via the Boltzmann equation for a reacting mixture
Conforto, F; Schürrer, F; Ziegler, I
2003-01-01
Based on the Boltzmann equation, the detonation problem is dealt with on a mesoscopic level. The model is based on the assumption that ahead of a shock an explosive gas mixture is in meta stable equilibrium. Starting from the Von Neumann point the chemical reaction, initiated by the pressure jump, proceeds until the chemical equilibrium is reached. Numerical solutions of the derived macroscopic equations as well as the corresponding Hugoniot diagrams which reveal the physical relevance of the mathematical model are provided.
Generalized Poisson—Boltzmann Equation Taking into Account Ionic Interaction and Steric Effects
Liu, Xin-Min; Li, Hang; Li, Rui; Tian, Rui; Xu, Chen-Yang
2012-09-01
Generalized Poisson—Boltzmann equation which takes into account both ionic interaction in bulk solution and steric effects of adsorbed ions has been suggested. We found that, for inorganic cations adsorption on negatively charged surface, the steric effect is not significant for surface charge density 0.15 mol/l in bulk solution. We conclude that for most actual cases the original PB equation can give reliable result in describing inorganic cation adsorption.
Electric-field conditions for Landauer and Boltzmann-Drude conductance equations
Fenton, E. W.
1992-08-01
It is shown explicitly in a unified theory of conductance, for bulk metals and mesoscopic systems, that a Landauer type of conductance equation is compatible with a spatially localized continuous-q-spectrum electric field that is unidirectional, but not with a homogeneous q=0 field. The reverse field condition holds for the Boltzmann-Drude conductance equation for an inhomogeneous bulk metal that has no inelastic scattering. A Feynman-diagram form of Green-function theory shows explicitly the virtual processes and repeated quantum scattering from a single object that occur with Feynman path integrals. The distinction between repeated scattering of current and repeated one-electron scattering is important. For a mesoscopic system, infinite conduction would occur if scattering were to be exactly zero-there is no necessity for postulated contact potentials between lead wires and thermal reservoirs. This is because just in this translationally invariant case a q=0 electric field must occur, and for this the Landauer equation must be replaced by the Boltzmann-Drude equation with zero scattering. In contrast to the strong frequency dependence of the Boltzmann-Drude equation, it is shown that no frequency dependence of the conductance occurs in the Landauer type of equation for frequencies much smaller than the inverse of the electron transit time across the electric-field region.
The Boltzmann Equation for a Multi-species Mixture Close to Global Equilibrium
Briant, Marc; Daus, Esther S.
2016-12-01
We study the Cauchy theory for a multi-species mixture, where the different species can have different masses, in a perturbative setting on the three dimensional torus. The ultimate aim of this work is to obtain the existence, uniqueness and exponential trend to equilibrium of solutions to the multi-species Boltzmann equation in {L^1_vL^∞_x(m)}, where {m˜ (1+ |v|^k)} is a polynomial weight. We prove the existence of a spectral gap for the linear multi-species Boltzmann operator allowing different masses, and then we establish a semigroup property thanks to a new explicit coercive estimate for the Boltzmann operator. Then we develop an {L^2-L^∞} theory à la Guo for the linear perturbed equation. Finally, we combine the latter results with a decomposition of the multi-species Boltzmann equation in order to deal with the full equation. We emphasize that dealing with different masses induces a loss of symmetry in the Boltzmann operator which prevents the direct adaptation of standard mono-species methods (for example Carleman representation, Povzner inequality). Of important note is the fact that all methods used and developed in this work are constructive. Moreover, they do not require any Sobolev regularity and the {L^1_vL^∞_x} framework is dealt with for any {k > k_0}, recovering the optimal physical threshold of finite energy {k_0=2} in the particular case of a multi-species hard spheres mixture with the same masses.
Sels, Dries; Brosens, Fons
2013-10-01
The equation of motion for the reduced Wigner function of a system coupled to an external quantum system is presented for the specific case when the external quantum system can be modeled as a set of harmonic oscillators. The result is derived from the Wigner function formulation of the Feynman-Vernon influence functional theory. It is shown how the true self-energy for the equation of motion is connected with the influence functional for the path integral. Explicit expressions are derived in terms of the bare Wigner propagator. Finally, we show under which approximations the resulting equation of motion reduces to the Wigner-Boltzmann equation.
Analytical solution of the Boltzmann-Poisson equation and its application to MIS tunneling junctions
Institute of Scientific and Technical Information of China (English)
Zhang Li-Zhi; Wang Zheng-Chuan
2009-01-01
In order to consider quantum transport under the influence of an electron-electron (e-e) interaction in a mesoscopic conductor, the Boltzmann equation and Poisson equation are investigated jointly. The analytical expressions of the distribution function for the Boltzmann equation and the self-consistent average potential concerned with e-e interaction are obtained, and the dielectric function appearing in the self-consistent average potential is naturally generalized beyond the Thomas-Fermi approximation. Then we apply these results to the tunneling junctions of a metal-insulatorsemiconductor (MIS) in which the electrons are accumulated near the interface of the semiconductor, and we find that the e-e interaction plays an important role in the transport procedure of this system. The electronic density, electric current as well as screening Coulombic potential in this case are studied, and we reveal the time and position dependence of these physical quantities explicitly affected by the e-e interaction.
Formulating Weak Lensing from the Boltzmann Equation and Application to Lens-lens Couplings
Su, S -C
2014-01-01
The Planck mission has conclusively detected lensing of the Cosmic Microwave Background (CMB) radiation from foreground sources to an overall significance of greater than $25\\sigma$. The high precision of this measurement motivates the development of a more complete formulation of the calculation of this effect. While most effects on the CMB anisotropies are widely studied through direct solutions of the Boltzmann equation, the non-linear effect of CMB lensing is formulated through the solutions of the geodesic equation. In this paper, we present a new formalism to the calculation of the lensing effect by \\emph{directly solving the Boltzmann equation}, as we did in the calculation of the CMB anisotropies at recombination. In particular, we developed a diagrammatic approach to efficiently keep track of all the interaction terms and calculate all possible non-trivial correlations to arbitrary high orders. Using this formalism, we explicitly articulate the approximations required to recover the usual remapping a...
Diffusive Boltzmann equation, its fluid dynamics, Couette flow and Knudsen layers
Abramov, Rafail V
2016-01-01
In the current work we propose a diffusive modification of the Boltzmann equation. This naturally leads to the corresponding diffusive fluid dynamics equations, which we numerically investigate in a simple Couette flow setting. This diffusive modification is based on the assumption of the "imperfect" model collision term, which is unable to track all collisions in the corresponding real gas particle system. The effect of missed collisions is then modeled by an appropriately scaled long-term homogenization process of the particle dynamics. The corresponding diffusive fluid dynamics equations are produced in a standard way by closing the hierarchy of the moment equations using either the Euler or the Grad closure. In the numerical experiments with the Couette flow, we discover that the diffusive Euler equations behave similarly to the conventional Navier-Stokes equations, while the diffusive Grad equations additionally exhibit Knudsen-like velocity boundary layers. We compare the simulations with the correspond...
Global solutions in the critical Besov space for the non-cutoff Boltzmann equation
Morimoto, Yoshinori; Sakamoto, Shota
2016-10-01
The Boltzmann equation is studied without the cutoff assumption. Under a perturbative setting, a unique global solution of the Cauchy problem of the equation is established in a critical Chemin-Lerner space. In order to analyze the collisional term of the equation, a Chemin-Lerner norm is combined with a non-isotropic norm with respect to a velocity variable, which yields an a priori estimate for an energy estimate. Together with local existence following from commutator estimates and the Hahn-Banach extension theorem, the desired solution is obtained.
A novel protocol for linearization of the Poisson-Boltzmann equation
Tsekov, R
2014-01-01
A new protocol for linearization of the Poisson-Boltzmann equation is proposed and the resultant electrostatic equation coincides formally with the Debye-Huckel equation, the solution of which is well known for many electrostatic problems. The protocol is examined on the example of electrostatically stabilized nano-bubbles and it is shown that stable nano-bubbles could be present in aqueous solutions of anionic surfactants near the critical temperature, if the surface potential is constant. At constant surface charge non nano-bubbles could exist.
Energy Technology Data Exchange (ETDEWEB)
EL Safadi, M
2007-03-15
We study the regularity of kinetic equations of Boltzmann type.We use essentially Littlewood-Paley method from harmonic analysis, consisting mainly in working with dyadics annulus. We shall mainly concern with the homogeneous case, where the solution f(t,x,v) depends only on the time t and on the velocities v, while working with realistic and singular cross-sections (non cutoff). In the first part, we study the particular case of Maxwellian molecules. Under this hypothesis, the structure of the Boltzmann operator and his Fourier transform write in a simple form. We show a global C{sup {infinity}} regularity. Then, we deal with the case of general cross-sections with 'hard potential'. We are interested in the Landau equation which is limit equation to the Boltzmann equation, taking in account grazing collisions. We prove that any weak solution belongs to Schwartz space S. We demonstrate also a similar regularity for the case of Boltzmann equation. Let us note that our method applies directly for all dimensions, and proofs are often simpler compared to other previous ones. Finally, we finish with Boltzmann-Dirac equation. In particular, we adapt the result of regularity obtained in Alexandre, Desvillettes, Wennberg and Villani work, using the dissipation rate connected with Boltzmann-Dirac equation. (author)
Premnath, Kannan N; Banerjee, Sanjoy
2008-01-01
Several applications exist in which lattice Boltzmann methods (LBM) are used to compute stationary states of fluid motions, particularly those driven or modulated by external forces. Standard LBM, being explicit time-marching in nature, requires a long time to attain steady state convergence, particularly at low Mach numbers due to the disparity in characteristic speeds of propagation of different quantities. In this paper, we present a preconditioned generalized lattice Boltzmann equation (GLBE) with forcing term to accelerate steady state convergence to flows driven by external forces. The use of multiple relaxation times in the GLBE allows enhancement of the numerical stability. Particular focus is given in preconditioning external forces, which can be spatially and temporally dependent. In particular, correct forms of moment-projections of source/forcing terms are derived such that they recover preconditioned Navier-Stokes equations with non-uniform external forces. As an illustration, we solve an extende...
Phonon Boltzmann equation-based discrete unified gas kinetic scheme for multiscale heat transfer
Guo, Zhaoli
2016-01-01
Numerical prediction of multiscale heat transfer is a challenging problem due to the wide range of time and length scales involved. In this work a discrete unified gas kinetic scheme (DUGKS) is developed for heat transfer in materials with different acoustic thickness based on the phonon Boltzmann equation. With discrete phonon direction, the Boltzmann equation is discretized with a second-order finite-volume formulation, in which the time-step is fully determined by the Courant-Friedrichs-Lewy (CFL) condition. The scheme has the asymptotic preserving (AP) properties for both diffusive and ballistic regimes, and can present accurate solutions in the whole transition regime as well. The DUGKS is a self-adaptive multiscale method for the capturing of local transport process. Numerical tests for both heat transfers with different Knudsen numbers are presented to validate the current method.
Xie, Dexuan; Jiang, Yi
2016-10-01
The nonlocal dielectric approach has been studied for more than forty years but only limited to water solvent until the recent work of Xie et al. (2013) [20]. As the development of this recent work, in this paper, a nonlocal modified Poisson-Boltzmann equation (NMPBE) is proposed to incorporate nonlocal dielectric effects into the classic Poisson-Boltzmann equation (PBE) for protein in ionic solvent. The focus of this paper is to present an efficient finite element algorithm and a related software package for solving NMPBE. Numerical results are reported to validate this new software package and demonstrate its high performance for protein molecules. They also show the potential of NMPBE as a better predictor of electrostatic solvation and binding free energies than PBE.
Asinari, Pietro
2010-01-01
The homogeneous isotropic Boltzmann equation (HIBE) is a fundamental dynamic model for many applications in thermodynamics, econophysics and sociodynamics. Despite recent hardware improvements, the solution of the Boltzmann equation remains extremely challenging from the computational point of view, in particular by deterministic methods (free of stochastic noise). This work aims to improve a deterministic direct method recently proposed [V.V. Aristov, Kluwer Academic Publishers, 2001] for solving the HIBE with a generic collisional kernel and, in particular, for taking care of the late dynamics of the relaxation towards the equilibrium. Essentially (a) the original problem is reformulated in terms of particle kinetic energy (exact particle number and energy conservation during microscopic collisions) and (b) the computation of the relaxation rates is improved by the DVM-like correction, where DVM stands for Discrete Velocity Model (ensuring that the macroscopic conservation laws are exactly satisfied). Both ...
Adaptive Finite Element Modeling Techniques for the Poisson-Boltzmann Equation
Holst, Michael; Yu, Zeyun; Zhou, Yongcheng; Zhu, Yunrong
2010-01-01
We develop an efficient and reliable adaptive finite element method (AFEM) for the nonlinear Poisson-Boltzmann equation (PBE). We first examine the regularization technique of Chen, Holst, and Xu; this technique made possible the first a priori pointwise estimates and the first complete solution and approximation theory for the Poisson-Boltzmann equation. It also made possible the first provably convergent discretization of the PBE, and allowed for the development of a provably convergent AFEM for the PBE. However, in practice the regularization turns out to be numerically ill-conditioned. In this article, we examine a second regularization, and establish a number of basic results to ensure that the new approach produces the same mathematical advantages of the original regularization, without the ill-conditioning property. We then design an AFEM scheme based on the new regularized problem, and show that the resulting AFEM scheme is accurate and reliable, by proving a contraction result for the error. This res...
A new lattice Boltzmann equation to simulate density-driven convection of carbon dioxide
Allen, Rebecca
2013-01-01
The storage of CO2 in fluid-filled geological formations has been carried out for more than a decade in locations around the world. After CO2 has been injected into the aquifer and has moved laterally under the aquifer\\'s cap-rock, density-driven convection becomes an important transport process to model. However, the challenge lies in simulating this transport process accurately with high spatial resolution and low CPU cost. This issue can be addressed by using the lattice Boltzmann equation (LBE) to formulate a model for a similar scenario when a solute diffuses into a fluid and density differences lead to convective mixing. The LBE is a promising alternative to the traditional methods of computational fluid dynamics. Rather than discretizing the system of partial differential equations of classical continuum mechanics directly, the LBE is derived from a velocity-space truncation of the Boltzmann equation of classical kinetic theory. We propose an extension to the LBE, which can accurately predict the transport of dissolved CO2 in water, as a step towards fluid-filled porous media simulations. This is achieved by coupling two LBEs, one for the fluid flow and one for the convection and diffusion of CO2. Unlike existing lattice Boltzmann equations for porous media flow, our model is derived from a system of moment equations and a Crank-Nicolson discretization of the velocity-truncated Boltzmann equation. The forcing terms are updated locally without the need for additional central difference approximation. Therefore our model preserves all the computational advantages of the single-phase lattice Boltzmann equation and is formally second-order accurate in both space and time. Our new model also features a novel implementation of boundary conditions, which is simple to implement and does not suffer from the grid-dependent error that is present in the standard "bounce-back" condition. The significance of using the LBE in this work lies in the ability to efficiently
Deterministic numerical solutions of the Boltzmann equation using the fast spectral method
Wu, Lei; White, Craig; Scanlon, Thomas J.; Reese, Jason M.; Zhang, Yonghao
2013-10-01
The Boltzmann equation describes the dynamics of rarefied gas flows, but the multidimensional nature of its collision operator poses a real challenge for its numerical solution. In this paper, the fast spectral method [36], originally developed by Mouhot and Pareschi for the numerical approximation of the collision operator, is extended to deal with other collision kernels, such as those corresponding to the soft, Lennard-Jones, and rigid attracting potentials. The accuracy of the fast spectral method is checked by comparing our numerical solutions of the space-homogeneous Boltzmann equation with the exact Bobylev-Krook-Wu solutions for a gas of Maxwell molecules. It is found that the accuracy is improved by replacing the trapezoidal rule with Gauss-Legendre quadrature in the calculation of the kernel mode, and the conservation of momentum and energy are ensured by the Lagrangian multiplier method without loss of spectral accuracy. The relax-to-equilibrium processes of different collision kernels with the same value of shear viscosity are then compared; the numerical results indicate that different forms of the collision kernels can be used as long as the shear viscosity (not only the value, but also its temperature dependence) is recovered. An iteration scheme is employed to obtain stationary solutions of the space-inhomogeneous Boltzmann equation, where the numerical errors decay exponentially. Four classical benchmarking problems are investigated: the normal shock wave, and the planar Fourier/Couette/force-driven Poiseuille flows. For normal shock waves, our numerical results are compared with a finite difference solution of the Boltzmann equation for hard sphere molecules, experimental data, and molecular dynamics simulation of argon using the realistic Lennard-Jones potential. For planar Fourier/Couette/force-driven Poiseuille flows, our results are compared with the direct simulation Monte Carlo method. Excellent agreements are observed in all test cases
EXISTENCE OF INFINITE ENERGY SOLUTION TO THE INELASTIC BOLTZMANN EQUATION WITH EXTERNAL FORCE
Institute of Scientific and Technical Information of China (English)
Wei Jinbo; Zhang Xianwen
2012-01-01
In this paper,the Cauchy problem for the inelastic Boltzmann equation with external force is considered in the case of initial data with infinite energy.More precisely,under the assumptions on the bicharacteristic generated by external force,we prove the global existence of solution for small initial data compared to the local Maxwellian exp{-p|x-v|2},which has infinite mass and energy.
Inhomogeneous relativistic Boltzmann equation near vacuum in the Robertson-Walker space-time
Takou, Etienne
2016-01-01
In this paper, we consider the Cauchy problem for the relativistic Boltzmann equation with near vacuum initial data where the distribution function depends on the time, the position and the impulsion. The collision kernel considered here is for the hard potentials case and the background space-time in which the study is done is the Robertson-Walker space-time. Unique global (in time) mild solution is obtained in a suitable weighted space.
A new exact solution of the relativistic Boltzmann equation and its hydrodynamic limit
Denicol, Gabriel S; Martinez, Mauricio; Noronha, Jorge; Strickland, Michael
2014-01-01
We present an exact solution of the relativistic Boltzmann equation for a system undergoing boost-invariant longitudinal and azimuthally symmetric transverse flow ("Gubser flow"). The resulting exact non-equilibrium dynamics is compared to 1st- and 2nd-order relativistic hydrodynamic approximations for various shear viscosity to entropy density ratios. This novel solution can be used to test the validity and accuracy of different hydrodynamic approximations in conditions similar to those generated in relativistic heavy-ion collisions.
Gas kinetic algorithm for flows in Poiseuille-like microchannels using Boltzmann model equation
Institute of Scientific and Technical Information of China (English)
LI; Zhihui; ZHANG; Hanxin; FU; Song
2005-01-01
The gas-kinetic unified algorithm using Boltzmann model equation have been extended and developed to solve the micro-scale gas flows in Poiseuille-like micro-channels from Micro-Electro-Mechanical Systems (MEMS). The numerical modeling of the gas kinetic boundary conditions suitable for micro-scale gas flows is presented. To test the present method, the classical Couette flows with various Knudsen numbers, the gas flows from short microchannels like plane Poiseuille and the pressure-driven gas flows in two-dimensional short microchannels have been simulated and compared with the approximate solutions of the Boltzmann equation, the related DSMC results, the modified N-S solutions with slip-flow boundary theory, the gas-kinetic BGK-Burnett solutions and the experimental data. The comparisons show that the present gas-kinetic numerical algorithm using the mesoscopic Boltzmann simplified velocity distribution function equation can effectively simulate and reveal the gas flows in microchannels. The numerical experience indicates that this method may be a powerful tool in the numerical simulation of micro-scale gas flows from MEMS.
Solution Poisson-Boltzmann equation: Application in the Human Neuron Membrane
Soares, M A G; Cortez, C M
2008-01-01
With already demonstrated in previous work the equations that describe the space dependence of the electric potential are determined by the solution of the equation of Poisson-Boltzmann. In this work we consider these solutions for the membrane of the human neuron, using a model simplified for this structure considering the distribution of electrolytes in each side of the membrane, as well as the effect of glycocalyx and the lipidic bilayer. It was assumed that on both sides of the membrane the charges are homogeneously distributed and that the potential depends only on coordinate z.
Denicol, Gabriel S; Martinez, Mauricio; Noronha, Jorge; Strickland, Michael
2014-01-01
We present an exact solution to the Boltzmann equation which describes a system undergoing boost-invariant longitudinal and azimuthally symmetric radial expansion for arbitrary shear viscosity to entropy density ratio. This new solution is constructed by considering the conformal map between Minkowski space and the direct product of three dimensional de Sitter space with a line. The resulting solution respects SO(3)_q x SO(1,1) x Z_2 symmetry. We compare the exact kinetic solution with exact solutions of the corresponding macroscopic equations with the same symmetry that were obtained from the kinetic theory in ideal and second-order viscous hydrodynamic approximations.
From Newton's Law to the Linear Boltzmann Equation Without Cut-Off
Ayi, Nathalie
2017-01-01
We provide a rigorous derivation of the linear Boltzmann equation without cut-off starting from a system of particles interacting via a potential with infinite range as the number of particles N goes to infinity under the Boltzmann-Grad scaling. More particularly, we will describe the motion of a tagged particle in a gas close to global equilibrium. The main difficulty in our context is that, due to the infinite range of the potential, a non-integrable singularity appears in the angular collision kernel, making no longer valid the single-use of Lanford's strategy. Our proof relies then on a combination of Lanford's strategy, of tools developed recently by Bodineau, Gallagher and Saint-Raymond to study the collision process, and of new duality arguments to study the additional terms associated with the long-range interaction, leading to some explicit weak estimates.
From Newton's Law to the Linear Boltzmann Equation Without Cut-Off
Ayi, Nathalie
2017-03-01
We provide a rigorous derivation of the linear Boltzmann equation without cut-off starting from a system of particles interacting via a potential with infinite range as the number of particles N goes to infinity under the Boltzmann-Grad scaling. More particularly, we will describe the motion of a tagged particle in a gas close to global equilibrium. The main difficulty in our context is that, due to the infinite range of the potential, a non-integrable singularity appears in the angular collision kernel, making no longer valid the single-use of Lanford's strategy. Our proof relies then on a combination of Lanford's strategy, of tools developed recently by Bodineau, Gallagher and Saint-Raymond to study the collision process, and of new duality arguments to study the additional terms associated with the long-range interaction, leading to some explicit weak estimates.
Theory of the Lattice Boltzmann Equation: Symmetry properties of Discrete Velocity Sets
Rubinstein, Robert; Luo, Li-Shi
2007-01-01
In the lattice Boltzmann equation, continuous particle velocity space is replaced by a finite dimensional discrete set. The number of linearly independent velocity moments in a lattice Boltzmann model cannot exceed the number of discrete velocities. Thus, finite dimensionality introduces linear dependencies among the moments that do not exist in the exact continuous theory. Given a discrete velocity set, it is important to know to exactly what order moments are free of these dependencies. Elementary group theory is applied to the solution of this problem. It is found that by decomposing the velocity set into subsets that transform among themselves under an appropriate symmetry group, it becomes relatively straightforward to assess the behavior of moments in the theory. The construction of some standard two- and three-dimensional models is reviewed from this viewpoint, and procedures for constructing some new higher dimensional models are suggested.
Perturbative and non-perturbative aspects non-Abelian Boltzmann-Langevin equation
Energy Technology Data Exchange (ETDEWEB)
Boedeker, Dietrich. E-mail: bodeker@physik.uni-bielefeld.de
2002-12-30
We study the Boltzmann-Langevin equation which describes the dynamics of hot Yang-Mills fields with typical momenta of order of the magnetic screening scale g{sup 2}T. It is transformed into a path integral and Feynman rules are obtained. We find that the leading log Langevin equation can be systematically improved in a well behaved expansion in log(1/g){sup -1}. The result by Arnold and Yaffe that the leading log Langevin equation is still valid at next-to-leading-log order is confirmed. We also confirm their result for the next-to-leading-log damping coefficient, or color conductivity, which is shown to be gauge fixing independent for a certain class of gauges. The frequency scale g{sup 2}T does not contribute to this result, but it does contribute, by power counting, to the transverse gauge field propagator. Going beyond a perturbative expansion we find 1-loop ultraviolet divergences which cannot be removed by renormalizing the parameters in the Boltzmann-Langevin equation.
Asinari, P.
2011-03-01
Boltzmann equation is one the most powerful paradigms for explaining transport phenomena in fluids. Since early fifties, it received a lot of attention due to aerodynamic requirements for high altitude vehicles, vacuum technology requirements and nowadays, micro-electro-mechanical systems (MEMs). Because of the intrinsic mathematical complexity of the problem, Boltzmann himself started his work by considering first the case when the distribution function does not depend on space (homogeneous case), but only on time and the magnitude of the molecular velocity (isotropic collisional integral). The interest with regards to the homogeneous isotropic Boltzmann equation goes beyond simple dilute gases. In the so-called econophysics, a Boltzmann type model is sometimes introduced for studying the distribution of wealth in a simple market. Another recent application of the homogeneous isotropic Boltzmann equation is given by opinion formation modeling in quantitative sociology, also called socio-dynamics or sociophysics. The present work [1] aims to improve the deterministic method for solving homogenous isotropic Boltzmann equation proposed by Aristov [2] by two ideas: (a) the homogeneous isotropic problem is reformulated first in terms of particle kinetic energy (this allows one to ensure exact particle number and energy conservation during microscopic collisions) and (b) a DVM-like correction (where DVM stands for Discrete Velocity Model) is adopted for improving the relaxation rates (this allows one to satisfy exactly the conservation laws at macroscopic level, which is particularly important for describing the late dynamics in the relaxation towards the equilibrium).
Fokker-Planck Equation for Boltzmann-type and Active Particles transfer probability approach
Trigger, S A
2002-01-01
Fokker-Planck equation with the velocity-dependent coefficients is considered for various isotropic systems on the basis of probability transition (PT) approach. This method provides the self-consistent and universal description of friction and diffusion for Brownian particles. Renormalization of the friction coefficient is shown to occur for two dimensional (2-D) and three dimensional (3-D) cases, due to the tensorial character of diffusion. The specific forms of PT are calculated for the Boltzmann-type of collisions and for the absorption-type of collisions (the later are typical for dusty plasmas and some other systems). Validity of the Einstein's relation for the Boltzmann-type collisions is proved for the velocity-dependent friction and diffusion coefficients. For non-Boltzmann collisions, such as, e.g., absorption collisions, the Einstein relation is violated, although some other relations (determined by the structure of PT) can exist. The collecting part of the ion drag force in a dusty plasma, arising...
Energy Technology Data Exchange (ETDEWEB)
Ayissi, Raoul Domingo, E-mail: raoulayissi@yahoo.fr; Noutchegueme, Norbert, E-mail: nnoutch@yahoo.fr [Department of Mathematics, Faculty of Science, University of Yaounde I, P.O. Box 812, Yaounde (Cameroon)
2015-01-15
Global solutions regular for the Einstein-Boltzmann equation on a magnetized Bianchi type-I cosmological model with the cosmological constant are investigated. We suppose that the metric is locally rotationally symmetric. The Einstein-Boltzmann equation has been already considered by some authors. But, in general Bancel and Choquet-Bruhat [Ann. Henri Poincaré XVIII(3), 263 (1973); Commun. Math. Phys. 33, 83 (1973)], they proved only the local existence, and in the case of the nonrelativistic Boltzmann equation. Mucha [Global existence of solutions of the Einstein-Boltzmann equation in the spatially homogeneous case. Evolution equation, existence, regularity and singularities (Banach Center Publications, Institute of Mathematics, Polish Academy of Science, 2000), Vol. 52] obtained a global existence result, for the relativistic Boltzmann equation coupled with the Einstein equations and using the Yosida operator, but confusing unfortunately with the nonrelativistic case. Noutchegueme and Dongho [Classical Quantum Gravity 23, 2979 (2006)] and Noutchegueme, Dongho, and Takou [Gen. Relativ. Gravitation 37, 2047 (2005)], have obtained a global solution in time, but still using the Yosida operator and considering only the uncharged case. Noutchegueme and Ayissi [Adv. Stud. Theor. Phys. 4, 855 (2010)] also proved a global existence of solutions to the Maxwell-Boltzmann system using the characteristic method. In this paper, we obtain using a method totally different from those used in the works of Noutchegueme and Dongho [Classical Quantum Gravity 23, 2979 (2006)], Noutchegueme, Dongho, and Takou [Gen. Relativ. Gravitation 37, 2047 (2005)], Noutchegueme and Ayissi [Adv. Stud. Theor. Phys. 4, 855 (2010)], and Mucha [Global existence of solutions of the Einstein-Boltzmann equation in the spatially homogeneous case. Evolution equation, existence, regularity and singularities (Banach Center Publications, Institute of Mathematics, Polish Academy of Science, 2000), Vol. 52] the
A novel incompressible finite-difference lattice Boltzmann equation for particle-laden flow
Institute of Scientific and Technical Information of China (English)
Sheng Chen; Zhaohui Liu; Baochang Shi; Zhu He; Chuguang Zheng
2005-01-01
In this paper, we propose a novel incompressible finite-difference lattice Boltzmann Equation (FDLBE). Because source terms that reflect the interaction between phases can be accurately described, the new model is suitable for simulating two-way coupling incompressible multiphase flow.The 2-D particle-laden flow over a backward-facing step is chosen as a test case to validate the present method. Favorable results are obtained and the present scheme is shown to have good prospects in practical applications.
Measure Valued Solutions to the Spatially Homogeneous Boltzmann Equation Without Angular Cutoff
Morimoto, Yoshinori; Wang, Shuaikun; Yang, Tong
2016-12-01
A uniform approach is introduced to study the existence of measure valued solutions to the homogeneous Boltzmann equation for both hard potential with finite energy, and soft potential with finite or infinite energy, by using Toscani metric. Under the non-angular cutoff assumption on the cross-section, the solutions obtained are shown to be in the Schwartz space in the velocity variable as long as the initial data is not a single Dirac mass without any extra moment condition for hard potential, and with the boundedness on moments of any order for soft potential.
Numerical solution of the Boltzmann equation for the shock wave in a gas mixture
Raines, A A
2014-01-01
We study the structure of a shock wave for a two-, three- and four-component gas mixture on the basis of numerical solution of the Boltzmann equation for the model of hard sphere molecules. For the evaluation of collision integrals we use the Conservative Projection Method developed by F.G. Tscheremissine which we extended to gas mixtures in cylindrical coordinates. The transition from the upstream to downstream uniform state is presented by macroscopic values and distribution functions. The obtained results were compared with numerical and experimental results of other authors.
Heinz, U; Denicol, G S; Martinez, M; Nopoush, M; Noronha, J; Ryblewski, R; Strickland, M
2015-01-01
Several recent results are reported from work aiming to improve the quantitative precision of relativistic viscous fluid dynamics for relativistic heavy-ion collisions. The dense matter created in such collisions expands in a highly anisotropic manner. Due to viscous effects this also renders the local momentum distribution anisotropic. Optimized hydrodynamic approaches account for these anisotropies already at leading order in a gradient expansion. Recently discovered exact solutions of the relativistic Boltzmann equation in anisotropically expanding systems provide a powerful testbed for such improved hydrodynamic approximations. We present the latest status of our quest for a formulation of relativistic viscous fluid dynamics that is optimized for applications to relativistic heavy-ion collisions.
On measure solutions of the Boltzmann equation, part I: Moment production and stability estimates
Lu, Xuguang; Mouhot, Clément
The spatially homogeneous Boltzmann equation with hard potentials is considered for measure valued initial data having finite mass and energy. We prove the existence of weak measure solutions, with and without angular cutoff on the collision kernel; the proof in particular makes use of an approximation argument based on the Mehler transform. Moment production estimates in the usual form and in the exponential form are obtained for these solutions. Finally for the Grad angular cutoff, we also establish uniqueness and strong stability estimate on these solutions.
Solution of the Boltzmann Equation for Electrons in Laser-Heated Metals
Pietanza, L. D.; Colonna, G.; Capitelli, M.
2005-05-01
A kinetic study of the electron relaxation dynamic inside a noble metal film (Ag) subjected to a femtosecond laser pulse has been performed. A time dependent numerical algorithm for the solution of the Boltzmann equations for electrons and phonons inside the film has been developped, considering electron-electron and electron-phonon collisions and the laser perturbation. The dependence of electron-electron and electron-phonon characteristic time-scales on the screening parameter values has been investigated. Electron-electron relaxation times are also compared with experimental data obtained through time-resolved two-photon photoemission technique.
Tervo, J; Frank, M; Herty, M
2016-01-01
The paper considers a coupled system of linear Boltzmann transport equation (BTE), and its Continuous Slowing Down Approximation (CSDA). This system can be used to model the relevant transport of particles used e.g. in dose calculation in radiation therapy. The evolution of charged particles (e.g. electrons and positrons) are in practice often modelled using the CSDA version of BTE because of the so-called forward peakedness of scattering events contributing to the particle fluencies (or particle densities), which causes severe problems for numerical methods. First, we prove the existence and uniqueness of solutions, under sufficient criteria and in appropriate $L^2$-based spaces, of a single (particle) CSDA-equation by using two complementary techniques, the Lions-Lax-Milgram Theorem (variational approach), and the theory evolution operators (semigroup approach). The necessary a priori estimates are shown. In addition, we prove the corresponding results and estimates for the system of coupled transport equat...
Leptogenesis with heavy neutrino flavours: from density matrix to Boltzmann equations
Blanchet, Steve; Di Bari, Pasquale; Marzola, Luca
2011-01-01
Leptogenesis with heavy neutrino flavours is discussed within a density matrix formalism. We write the density matrix equation that describes the generation of the matter-antimatter asymmetry, for an arbitrary choice of the right-handed (RH) neutrino masses. For hierarchical RH neutrino masses lying in the fully flavoured regimes, the density matrix equation reduces to multiple-stage Boltzmann equations. In this case we recover and extend results previously derived within a quantum state collapse description. We confirm the generic existence of phantom terms, which are not washed out at production and contribute to the flavoured asymmetries proportionally to the initial RH neutrino abundances. Even in the N_1-dominated scenario they can give rise to lepton flavour asymmetries much larger than the baryon asymmetry with potential applications. We also confirm that there is a (orthogonal) component in the asymmetry produced by the heavier RH neutrinos which completely escapes the washout from the lighter RH neut...
Cobos, Agustín C.; Poma, Ana L.; Alvarez, Guillermo D.; Sanz, Darío E.
2016-10-01
We introduce an alternative method to calculate the steady state solution of the angular photon flux after a numerical evolution of the time-dependent Boltzmann transport equation (BTE). After a proper discretization the transport equation was converted into an ordinary system of differential equations that can be iterated as a weighted Richardson algorithm. As a different approach, in this work the time variable regulates the iteration process and convergence criteria is based on physical parameters. Positivity and convergence was assessed from first principles and a modified Courant-Friedrichs-Lewy condition was devised to guarantee convergence. The Penelope Monte Carlo method was used to test the convergence and accuracy of our approach for different phase space discretizations. Benchmarking was performed by calculation of total fluence and photon spectra in different one-dimensional geometries irradiated with 60Co and 6 MV photon beams and radiological applications were devised.
Wang, Huimin
2017-01-01
In this paper, a new lattice Boltzmann model for the Korteweg-de Vries (KdV) equation is proposed. By using the Chapman-Enskog expansion and the multi-scale time expansion, a series of partial differential equations in different time scales and several higher- order moments of equilibrium distribution functions are obtained. In order to make the scheme obey the three conservation laws of the KdV equation, two equilibrium distribution functions are used and a correlation between the first conservation law and the second conservation law is constructed. In numerical examples, the numerical results of the KdV equation obtained by this scheme are compared with those results obtained by the previous lattice Boltzmann model. Numerical experiments demonstrate this scheme can be used to reduce the truncation error of the lattice Boltzmann scheme and preserve the three conservation laws.
Thermal transport at the nanoscale: A Fourier's law vs. phonon Boltzmann equation study
Kaiser, J.; Feng, T.; Maassen, J.; Wang, X.; Ruan, X.; Lundstrom, M.
2017-01-01
Steady-state thermal transport in nanostructures with dimensions comparable to the phonon mean-free-path is examined. Both the case of contacts at different temperatures with no internal heat generation and contacts at the same temperature with internal heat generation are considered. Fourier's law results are compared to finite volume method solutions of the phonon Boltzmann equation in the gray approximation. When the boundary conditions are properly specified, results obtained using Fourier's law without modifying the bulk thermal conductivity are in essentially exact quantitative agreement with the phonon Boltzmann equation in the ballistic and diffusive limits. The errors between these two limits are examined in this paper. For the four cases examined, the error in the apparent thermal conductivity as deduced from a correct application of Fourier's law is less than 6%. We also find that the Fourier's law results presented here are nearly identical to those obtained from a widely used ballistic-diffusive approach but analytically much simpler. Although limited to steady-state conditions with spatial variations in one dimension and to a gray model of phonon transport, the results show that Fourier's law can be used for linear transport from the diffusive to the ballistic limit. The results also contribute to an understanding of how heat transport at the nanoscale can be understood in terms of the conceptual framework that has been established for electron transport at the nanoscale.
Düring, Bertram
2015-01-01
We propose and investigate different kinetic models for opinion formation, when the opinion formation process depends on an additional independent variable, e.g. a leadership or a spatial variable. More specifically, we consider:(i) opinion dynamics under the effect of opinion leadership, where each individual is characterised not only by its opinion, but also by another independent variable which quantifies leadership qualities; (ii) opinion dynamics modelling political segregation in the `The Big Sort', a phenomenon that US citizens increasingly prefer to live in neighbourhoods with politically like-minded individuals. Based on microscopic opinion consensus dynamics such models lead to inhomogeneous Boltzmann-type equations for the opinion distribution. We derive macroscopic Fokker-Planck-type equations in a quasi-invariant opinion limit and present results of numerical experiments.
A New 2D-Transport, 1D-Diffusion Approximation of the Boltzmann Transport equation
Energy Technology Data Exchange (ETDEWEB)
Larsen, Edward
2013-06-17
The work performed in this project consisted of the derivation, implementation, and testing of a new, computationally advantageous approximation to the 3D Boltz- mann transport equation. The solution of the Boltzmann equation is the neutron flux in nuclear reactor cores and shields, but solving this equation is difficult and costly. The new “2D/1D” approximation takes advantage of a special geometric feature of typical 3D reactors to approximate the neutron transport physics in a specific (ax- ial) direction, but not in the other two (radial) directions. The resulting equation is much less expensive to solve computationally, and its solutions are expected to be sufficiently accurate for many practical problems. In this project we formulated the new equation, discretized it using standard methods, developed a stable itera- tion scheme for solving the equation, implemented the new numerical scheme in the MPACT code, and tested the method on several realistic problems. All the hoped- for features of this new approximation were seen. For large, difficult problems, the resulting 2D/1D solution is highly accurate, and is calculated about 100 times faster than a 3D discrete ordinates simulation.
AQUASOL: An efficient solver for the dipolar Poisson-Boltzmann-Langevin equation.
Koehl, Patrice; Delarue, Marc
2010-02-14
The Poisson-Boltzmann (PB) formalism is among the most popular approaches to modeling the solvation of molecules. It assumes a continuum model for water, leading to a dielectric permittivity that only depends on position in space. In contrast, the dipolar Poisson-Boltzmann-Langevin (DPBL) formalism represents the solvent as a collection of orientable dipoles with nonuniform concentration; this leads to a nonlinear permittivity function that depends both on the position and on the local electric field at that position. The differences in the assumptions underlying these two models lead to significant differences in the equations they generate. The PB equation is a second order, elliptic, nonlinear partial differential equation (PDE). Its response coefficients correspond to the dielectric permittivity and are therefore constant within each subdomain of the system considered (i.e., inside and outside of the molecules considered). While the DPBL equation is also a second order, elliptic, nonlinear PDE, its response coefficients are nonlinear functions of the electrostatic potential. Many solvers have been developed for the PB equation; to our knowledge, none of these can be directly applied to the DPBL equation. The methods they use may adapt to the difference; their implementations however are PBE specific. We adapted the PBE solver originally developed by Holst and Saied [J. Comput. Chem. 16, 337 (1995)] to the problem of solving the DPBL equation. This solver uses a truncated Newton method with a multigrid preconditioner. Numerical evidences suggest that it converges for the DPBL equation and that the convergence is superlinear. It is found however to be slow and greedy in memory requirement for problems commonly encountered in computational biology and computational chemistry. To circumvent these problems, we propose two variants, a quasi-Newton solver based on a simplified, inexact Jacobian and an iterative self-consistent solver that is based directly on the PBE
Institute of Scientific and Technical Information of China (English)
YUAN Hongjun; YAN Han
2009-01-01
The existence and uniqueness of the solutions for the Boltzmann equations with measures as initial value are still an open problem which is posed by P. L. Lions (2000). The aim of this paper is to discuss the Cauchy problem of the system of discrete Boltzmann equations of the form etf∫i+(∫mii)x=Qi(∫1,∫2,…,∫n), (mi1, i=1,…,n) with non-negative finite Radon measures as initial conditions. In particular, the existence and uniqueness of BV solutions for the above problem are obtained.
A Combined MPI-CUDA Parallel Solution of Linear and Nonlinear Poisson-Boltzmann Equation
Directory of Open Access Journals (Sweden)
José Colmenares
2014-01-01
Full Text Available The Poisson-Boltzmann equation models the electrostatic potential generated by fixed charges on a polarizable solute immersed in an ionic solution. This approach is often used in computational structural biology to estimate the electrostatic energetic component of the assembly of molecular biological systems. In the last decades, the amount of data concerning proteins and other biological macromolecules has remarkably increased. To fruitfully exploit these data, a huge computational power is needed as well as software tools capable of exploiting it. It is therefore necessary to move towards high performance computing and to develop proper parallel implementations of already existing and of novel algorithms. Nowadays, workstations can provide an amazing computational power: up to 10 TFLOPS on a single machine equipped with multiple CPUs and accelerators such as Intel Xeon Phi or GPU devices. The actual obstacle to the full exploitation of modern heterogeneous resources is efficient parallel coding and porting of software on such architectures. In this paper, we propose the implementation of a full Poisson-Boltzmann solver based on a finite-difference scheme using different and combined parallel schemes and in particular a mixed MPI-CUDA implementation. Results show great speedups when using the two schemes, achieving an 18.9x speedup using three GPUs.
A combined MPI-CUDA parallel solution of linear and nonlinear Poisson-Boltzmann equation.
Colmenares, José; Galizia, Antonella; Ortiz, Jesús; Clematis, Andrea; Rocchia, Walter
2014-01-01
The Poisson-Boltzmann equation models the electrostatic potential generated by fixed charges on a polarizable solute immersed in an ionic solution. This approach is often used in computational structural biology to estimate the electrostatic energetic component of the assembly of molecular biological systems. In the last decades, the amount of data concerning proteins and other biological macromolecules has remarkably increased. To fruitfully exploit these data, a huge computational power is needed as well as software tools capable of exploiting it. It is therefore necessary to move towards high performance computing and to develop proper parallel implementations of already existing and of novel algorithms. Nowadays, workstations can provide an amazing computational power: up to 10 TFLOPS on a single machine equipped with multiple CPUs and accelerators such as Intel Xeon Phi or GPU devices. The actual obstacle to the full exploitation of modern heterogeneous resources is efficient parallel coding and porting of software on such architectures. In this paper, we propose the implementation of a full Poisson-Boltzmann solver based on a finite-difference scheme using different and combined parallel schemes and in particular a mixed MPI-CUDA implementation. Results show great speedups when using the two schemes, achieving an 18.9x speedup using three GPUs.
Arnab, Sarkar; Manjeet, Singh
2017-02-01
We report spectroscopic studies on plasma electron number density of laser-induced plasma produced by ns-Nd:YAG laser light pulses on an aluminum sample in air at atmospheric pressure. The effect of different laser energy and the effect of different laser wavelengths were compared. The experimentally observed line profiles of neutral aluminum have been used to extract the excitation temperature using the Boltzmann plot method, whereas the electron number density has been determined from the Stark broadened as well as using the Saha-Boltzmann equation (SBE). Each approach was also carried out by using the Al emission line and Mg emission lines. It was observed that the SBE method generated a little higher electron number density value than the Stark broadening method, but within the experimental uncertainty range. Comparisons of N e determined by the two methods show the presence of a linear relation which is independent of laser energy or laser wavelength. These results show the applicability of the SBE method for N e determination, especially when the system does not have any pure emission lines whose electron impact factor is known. Also use of Mg lines gives superior results than Al lines.
Energy Technology Data Exchange (ETDEWEB)
Hagelaar, G J M; Pitchford, L C [Centre de Physique des Plasmas et de leurs Applications de Toulouse, Universite Paul Sabatier, 118 route de Narbonne, 31062 Toulouse Cedex 9 (France)
2005-11-15
Fluid models of gas discharges require the input of transport coefficients and rate coefficients that depend on the electron energy distribution function. Such coefficients are usually calculated from collision cross-section data by solving the electron Boltzmann equation (BE). In this paper we present a new user-friendly BE solver developed especially for this purpose, freely available under the name BOLSIG+, which is more general and easier to use than most other BE solvers available. The solver provides steady-state solutions of the BE for electrons in a uniform electric field, using the classical two-term expansion, and is able to account for different growth models, quasi-stationary and oscillating fields, electron-neutral collisions and electron-electron collisions. We show that for the approximations we use, the BE takes the form of a convection-diffusion continuity-equation with a non-local source term in energy space. To solve this equation we use an exponential scheme commonly used for convection-diffusion problems. The calculated electron transport coefficients and rate coefficients are defined so as to ensure maximum consistency with the fluid equations. We discuss how these coefficients are best used in fluid models and illustrate the influence of some essential parameters and approximations.
LATTICE BOLTZMANN METHOD SIMULATIONS FOR MULTIPHASE FLUIDS WITH REDICH-KWONG EQUATION OF STATE
Institute of Scientific and Technical Information of China (English)
WEI Yi-kun; QIAN Yue-hong
2011-01-01
In this article we state that the compression factor of the Redlich-Kwong Equation Of State (EOS) is smaller than that of van der Waals EOS.The Redlich-Kwong EOS is in better agreement with experimental data on coexistence curves at the critical point than the van der Waals EOS.We implement the Redlich-Kwong EOS in the Lattice Boltzmann Method (LBM) simulations via a pseudo-potential approach.We propose a new force,which can obtain computational stationary and reach larger density ratio.As a result,multi-phase flows with large density ratio (up to 1012 in the stationary case) can be simulated.We perform four numerical simulations,which are respectively related to single liquid droplet,vapor-liquid separation,surface tension and liquid coalescence of two droplets.
Wu, Lei; Liu, Haihu; Zhang, Yonghao; Reese, Jason M.
2015-08-01
The Boltzmann equation with an arbitrary intermolecular potential is solved by the fast spectral method. As examples, noble gases described by the Lennard-Jones potential are considered. The accuracy of the method is assessed by comparing both transport coefficients with variational solutions and mass/heat flow rates in Poiseuille/thermal transpiration flows with results from the discrete velocity method. The fast spectral method is then applied to Fourier and Couette flows between two parallel plates, and the influence of the intermolecular potential on various flow properties is investigated. It is found that for gas flows with the same rarefaction parameter, differences in the heat flux in Fourier flow and the shear stress in Couette flow are small. However, differences in other quantities such as density, temperature, and velocity can be very large.
Exponential Runge-Kutta schemes for inhomogeneous Boltzmann equations with high order of accuracy
Li, Qin
2012-01-01
We consider the development of exponential methods for the robust time discretization of space inhomogeneous Boltzmann equations in stiff regimes. Compared to the space homogeneous case, or more in general to the case of splitting based methods, studied in Dimarco Pareschi (SIAM J. Num. Anal. 2011) a major difficulty is that the local Maxwellian equilibrium state is not constant in a time step and thus needs a proper numerical treatment. We show how to derive asymptotic preserving (AP) schemes of arbitrary order and in particular using the Shu-Osher representation of Runge-Kutta methods we explore the monotonicity properties of such schemes, like strong stability preserving (SSP) and positivity preserving. Several numerical results confirm our analysis.
Institute of Scientific and Technical Information of China (English)
Du Gang; Liu Xiao-Yan; Han Ru-Qi
2006-01-01
A two-dimensional (2D) full band self-consistent ensemble Monte Carlo (MC) method for solving the quantum Boltzmann equation, including collision broadening and quantum potential corrections, is developed to extend the MC method to the study of nano-scale semiconductor devices with obvious quantum mechanical (QM) effects. The quantum effects both in real space and momentum space in nano-scale semiconductor devices can be simulated. The effective mobility in the inversion layer of n and p channel MOSFET is simulated and compared with experimental data to verify this method. With this method 50nm ultra thin body silicon on insulator MOSFET are simulated. Results indicate that this method can be used to simulate the 2D QM effects in semiconductor devices including tunnelling effect.
Mirzadeh, Mohammad; Squires, Todd; Gibou, Frederic
2010-11-01
We present a finite difference discretization of the non-linear Poisson-Boltzmann (PB) equation over complex geometries that has second order accurracy. The level-set method is adopted to represent the interface and Octree (in three dimensions) or Quadtree (in two dimensions) data stuructures are used to generate adaptive grids. Such an approach garanties that the finest grid resolution is located near the interface where EDL forms and creates very large electric field. Several numerical experiments are carried which indicate the second order accuracy both in the case of Dirichlet and Neumann boundary conditions in L2 and L∞ norms. Finally, we use our method to study the electrostatic interaction of double layers between charged particles in an unbounded bulk electrolyte as well as in a channel where the channel width is of the order of Debye length.
Fillion-Gourdeau, F; Herrmann, H J; Mendoza, M; Palpacelli, S; Succi, S
2013-10-18
We point out a formal analogy between the Dirac equation in Majorana form and the discrete-velocity version of the Boltzmann kinetic equation. By a systematic analysis based on the theory of operator splitting, this analogy is shown to turn into a concrete and efficient computational method, providing a unified treatment of relativistic and nonrelativistic quantum mechanics. This might have potentially far-reaching implications for both classical and quantum computing, because it shows that, by splitting time along the three spatial directions, quantum information (Dirac-Majorana wave function) propagates in space-time as a classical statistical process (Boltzmann distribution).
Bazow, D.; Denicol, G. S.; Heinz, U.; Martinez, M.; Noronha, J.
2016-12-01
The dissipative dynamics of an expanding massless gas with constant cross section in a spatially flat Friedmann-Lemaître-Robertson-Walker (FLRW) universe is studied. The mathematical problem of solving the full nonlinear relativistic Boltzmann equation is recast into an infinite set of nonlinear ordinary differential equations for the moments of the one-particle distribution function. Momentum-space resolution is determined by the number of nonhydrodynamic modes included in the moment hierarchy, i.e., by the truncation order. We show that in the FLRW spacetime the nonhydrodynamic modes decouple completely from the hydrodynamic degrees of freedom. This results in the system flowing as an ideal fluid while at the same time producing entropy. The solutions to the nonlinear Boltzmann equation exhibit transient tails of the distribution function with nontrivial momentum dependence. The evolution of this tail is not correctly captured by the relaxation time approximation nor by the linearized Boltzmann equation. However, the latter probes additional high-momentum details unresolved by the relaxation time approximation. While the expansion of the FLRW spacetime is slow enough for the system to move towards (and not away from) local thermal equilibrium, it is not sufficiently slow for the system to actually ever reach complete local equilibrium. Equilibration is fastest in the relaxation time approximation, followed, in turn, by kinetic evolution with a linearized and a fully nonlinear Boltzmann collision term.
Dujko, S.; Ebert, U.; White, R.D.; Petrović, Z.L.
2010-01-01
A comprehensive investigation of electron transport in N$_{2}$-O$_{2}$ mixtures has been carried out using a multi term theory for solving the Boltzmann equation and Monte Carlo simulation technique instead of conventional two-term theory often employed in plasma modeling community. We focus on the
Noutchegueme, N; Noutchegueme, Norbert; Tetsadjio, Mesmin Erick
2003-01-01
We prove, for the relativistic Boltzmann equation in the homogeneous case, on the Minkowski space-time, a global in time existence and uniqueness theorem. The method we develop extends to the cases of some curved space-times such as the flat Robertson-Walker space-time and some Bianchi type I space-times.
Improved lattice Boltzmann modeling of binary flow based on the conservative Allen-Cahn equation
Ren, Feng; Song, Baowei; Sukop, Michael C.; Hu, Haibao
2016-08-01
The primary and key task of binary fluid flow modeling is to track the interface with good accuracy, which is usually challenging due to the sharp-interface limit and numerical dispersion. This article concentrates on further development of the conservative Allen-Cahn equation (ACE) [Geier et al., Phys. Rev. E 91, 063309 (2015), 10.1103/PhysRevE.91.063309] under the framework of the lattice Boltzmann method (LBM), with incorporation of the incompressible hydrodynamic equations [Liang et al., Phys. Rev. E 89, 053320 (2014), 10.1103/PhysRevE.89.053320]. Utilizing a modified equilibrium distribution function and an additional source term, this model is capable of correctly recovering the conservative ACE through the Chapman-Enskog analysis. We also simulate four phase-tracking benchmark cases, including one three-dimensional case; all show good accuracy as well as low numerical dispersion. By coupling the incompressible hydrodynamic equations, we also simulate layered Poiseuille flow and the Rayleigh-Taylor instability, illustrating satisfying performance in dealing with complex flow problems, e.g., high viscosity ratio, high density ratio, and high Reynolds number situations. The present work provides a reliable and efficient solution for binary flow modeling.
Ion strength limit of computed excess functions based on the linearized Poisson-Boltzmann equation.
Fraenkel, Dan
2015-12-01
The linearized Poisson-Boltzmann (L-PB) equation is examined for its κ-range of validity (κ, Debye reciprocal length). This is done for the Debye-Hückel (DH) theory, i.e., using a single ion size, and for the SiS treatment (D. Fraenkel, Mol. Phys. 2010, 108, 1435), which extends the DH theory to the case of ion-size dissimilarity (therefore dubbed DH-SiS). The linearization of the PB equation has been claimed responsible for the DH theory's failure to fit with experiment at > 0.1 m; but DH-SiS fits with data of the mean ionic activity coefficient, γ± (molal), against m, even at m > 1 (κ > 0.33 Å(-1) ). The SiS expressions combine the overall extra-electrostatic potential energy of the smaller ion, as central ion-Ψa>b (κ), with that of the larger ion, as central ion-Ψb>a (κ); a and b are, respectively, the counterion and co-ion distances of closest approach. Ψa>b and Ψb>a are derived from the L-PB equation, which appears to conflict with their being effective up to moderate electrolyte concentrations (≈1 m). However, the L-PB equation can be valid up to κ ≥ 1.3 Å(-1) if one abandons the 1/κ criterion for its effectiveness and, instead, use, as criterion, the mean-field electrostatic interaction potential of the central ion with its ion cloud, at a radial distance dividing the cloud charge into two equal parts. The DH theory's failure is, thus, not because of using the L-PB equation; the lethal approximation is assigning a single size to the positive and negative ions.
Energy Technology Data Exchange (ETDEWEB)
Merton, S.R. [Computational Physics Group, AWE, Aldermaston, Reading, Berkshire RG7 4PR (United Kingdom)], E-mail: simon.merton@awe.co.uk; Pain, C.C. [Computational Physics and Geophysics Group, Department of Earth Science and Engineering, Imperial College London, London SW7 2A7 (United Kingdom); Smedley-Stevenson, R.P. [Computational Physics Group, AWE, Aldermaston, Reading, Berkshire RG7 4PR (United Kingdom); Buchan, A.G.; Eaton, M.D. [Computational Physics and Geophysics Group, Department of Earth Science and Engineering, Imperial College London, London SW7 2A7 (United Kingdom)
2008-09-15
This paper describes the development of two optimal discontinuous finite element (FE) Riemann methods and their application to the one-speed Boltzmann transport equation in the steady-state. The proposed methods optimise the amount of dissipation applied in the streamline direction. This dissipation is applied within an element using a novel Riemann FE method, which is based on an analogy between control volume discretisation methods and finite element methods when integration by parts is applied to the transport terms. In one-dimension the optimal finite element solutions match the analytical solution exactly at each outlet node. Both schemes couple elements in space via a Riemann approach. The first of the two schemes is a Petrov-Galerkin (PG) method which introduces dissipation via the equation residual. The second scheme uses a streamline diffusion stabilisation term in the discretisation. These two methods provide a discontinuous Petrov-Galerkin (DPG) scheme that can stabilise an element across the full range of radiation regimes, obtaining robust solutions with suppressed oscillation. Three basis functions in angle of particle travel have been implemented in an optimal DPG Riemann solver, which include the P{sub N} (spherical harmonic), S{sub N} (discrete ordinate) and LW{sub N} (linear octahedral wavelet) angular expansions. These methods are applied to a series of demanding two-dimensional radiation transport problems.
Robson, R E; Winkler, R; Sigeneger, F
2002-05-01
The Boltzmann equation corresponding to a general "multiterm" representation of the phase space distribution function f(r,c,t) for charged particles in a gas in an electric field was reformulated entirely in terms of spherical tensors f(l)(m) some time ago, and numerous applications, including extension to time varying and crossed electric and magnetic fields, have followed. However, these applications have, by and large, been limited to the hydrodynamic conditions that prevail in swarm experiments and the full potential of the tensor formalism has thus never been realized. This paper resumes the discussion in the context of the more general nonhydrodynamic situation. Geometries for which a simple Legendre polynomial expansion suffices to represent f are discussed briefly, but the emphasis is upon cylindrical geometry, where such simplification does not arise. In particular, we consider an axisymmetric cylindrical column of weakly ionized plasma, and derive an infinite hierarchy of integrodifferential equations for the expansion coefficients of the phase space distribution function, valid for both electrons and ions, and for all types of binary interaction with neutral gas molecules.
Boltzmann-equation simulations of radio-frequency-driven, low-temperature plasmas
Energy Technology Data Exchange (ETDEWEB)
Drallos, P.J.; Riley, M.E.
1995-01-01
We present a method for the numerical solution of the Boltzmann equation (BE) describing plasma electrons. We apply the method to a capacitively-coupled, radio-frequency-driven He discharge in parallel-plate (quasi-1D) geometry which contains time scales for physical processes spanning six orders of magnitude. Our BE solution procedure uses the method of characteristics for the Vlasov operator with interpolation in phase space at early time, allowing storage of the distribution function on a fixed phase-space grid. By alternating this BE method with a fluid description of the electrons, or with a novel time-cycle-average equation method, we compute the periodic steady state of a He plasma by time evolution from startup conditions. We find that the results compare favorably with measured current-voltage, plasma density, and ``cited state densities in the ``GEC`` Reference Cell. Our atomic He model includes five levels (some are summed composites), 15 electronic transitions, radiation trapping, and metastable-metastable collisions.
Directory of Open Access Journals (Sweden)
Nilson C. Roberty
2011-01-01
Full Text Available We introduce algorithms marching over a polygonal mesh with elements consistent with the propagation directions of the particle (radiation flux. The decision for adopting this kind of mesh to solve the one-speed Boltzmann transport equation is due to characteristics of the domain of the transport operator which controls derivatives only in the direction of propagation of the particles (radiation flux in the absorbing and scattering media. This a priori adaptivity has the advantages that it formulates a consistent scheme which makes appropriate the application of the Lax equivalence theorem framework to the problem. In this work, we present the main functional spaces involved in the formalism and a description of the algorithms for the mesh generation and the transport equation solution. Some numerical examples related to the solution of a transmission problem in a high-contrast model with absorption and scattering are presented. Also, a comparison with benchmarks problems for source and reactor criticality simulations shows the compatibility between calculations with the algorithms proposed here and theoretical results.
Khajepor, Sorush; Chen, Baixin
2016-01-01
A method is developed to analytically and consistently implement cubic equations of state into the recently proposed multipseudopotential interaction (MPI) scheme in the class of two-phase lattice Boltzmann (LB) models [S. Khajepor, J. Wen, and B. Chen, Phys. Rev. E 91, 023301 (2015)]10.1103/PhysRevE.91.023301. An MPI forcing term is applied to reduce the constraints on the mathematical shape of the thermodynamically consistent pseudopotentials; this allows the parameters of the MPI forces to be determined analytically without the need of curve fitting or trial and error methods. Attraction and repulsion parts of equations of state (EOSs), representing underlying molecular interactions, are modeled by individual pseudopotentials. Four EOSs, van der Waals, Carnahan-Starling, Peng-Robinson, and Soave-Redlich-Kwong, are investigated and the results show that the developed MPI-LB system can satisfactorily recover the thermodynamic states of interest. The phase interface is predicted analytically and controlled via EOS parameters independently and its effect on the vapor-liquid equilibrium system is studied. The scheme is highly stable to very high density ratios and the accuracy of the results can be enhanced by increasing the interface resolution. The MPI drop is evaluated with regard to surface tension, spurious velocities, isotropy, dynamic behavior, and the stability dependence on the relaxation time.
A unified gas-kinetic scheme for continuum and rarefied flows IV: Full Boltzmann and model equations
Liu, Chang; Xu, Kun; Sun, Quanhua; Cai, Qingdong
2016-06-01
Fluid dynamic equations are valid in their respective modeling scales, such as the particle mean free path scale of the Boltzmann equation and the hydrodynamic scale of the Navier-Stokes (NS) equations. With a variation of the modeling scales, theoretically there should have a continuous spectrum of fluid dynamic equations. Even though the Boltzmann equation is claimed to be valid in all scales, many Boltzmann solvers, including direct simulation Monte Carlo method, require the cell resolution to the order of particle mean free path scale. Therefore, they are still single scale methods. In order to study multiscale flow evolution efficiently, the dynamics in the computational fluid has to be changed with the scales. A direct modeling of flow physics with a changeable scale may become an appropriate approach. The unified gas-kinetic scheme (UGKS) is a direct modeling method in the mesh size scale, and its underlying flow physics depends on the resolution of the cell size relative to the particle mean free path. The cell size of UGKS is not limited by the particle mean free path. With the variation of the ratio between the numerical cell size and local particle mean free path, the UGKS recovers the flow dynamics from the particle transport and collision in the kinetic scale to the wave propagation in the hydrodynamic scale. The previous UGKS is mostly constructed from the evolution solution of kinetic model equations. Even though the UGKS is very accurate and effective in the low transition and continuum flow regimes with the time step being much larger than the particle mean free time, it still has space to develop more accurate flow solver in the region, where the time step is comparable with the local particle mean free time. In such a scale, there is dynamic difference from the full Boltzmann collision term and the model equations. This work is about the further development of the UGKS with the implementation of the full Boltzmann collision term in the region
Energy Technology Data Exchange (ETDEWEB)
Siewert, C.E. [North Carolina State Univ., Dept. Mathematics, Raleigh, NC (United States)
2002-10-01
A synthetic-kernel model (CES model) of the linearized Boltzmann equation is used along with an analytical discrete-ordinates method (ADO) to solve three fundamental problems concerning flow of a rarefied gas in a plane channel. More specifically, the problems of Couette flow, Poiseuille flow and thermal-creep flow are solved in terms of the CES model equation for an arbitrary mixture of specular and diffuse reflection at the walls confining the flow, and numerical results for the basic quantities of interest are reported. The comparisons made with results derived from solutions based on computationally intensive methods applied to the linearized Boltzmann equation are used to conclude that the CES model can be employed with confidence to improve the accuracy of results available from simpler approximations such as the BGK model or the S model. (author)
Energy Technology Data Exchange (ETDEWEB)
Ortega J, R.; Valle G, E. del [IPN-ESFM, 07738 Mexico D.F. (Mexico)]. e-mail: roj@correo.azc.uam.mx
2003-07-01
There are carried out charge and energy calculations deposited due to the interaction of electrons with a plate of a certain material, solving numerically the electron transport equation for the Boltzmann-Fokker-Planck approach of first order in plate geometry with a computer program denominated TEOD-NodExp (Transport of Electrons in Discreet Ordinates, Nodal Exponentials), using the proposed method by the Dr. J. E. Morel to carry out the discretization of the variable energy and several spatial discretization schemes, denominated exponentials nodal. It is used the Fokker-Planck equation since it represents an approach of the Boltzmann transport equation that is been worth whenever it is predominant the dispersion of small angles, that is to say, resulting dispersion in small dispersion angles and small losses of energy in the transport of charged particles. Such electrons could be those that they face with a braking plate in a device of thermonuclear fusion. In the present work its are considered electrons of 1 MeV that impact isotropically on an aluminum plate. They were considered three different thickness of plate that its were designated as problems 1, 2 and 3. In the calculations it was used the discrete ordinate method S{sub 4} with expansions of the dispersion cross sections until P{sub 3} order. They were considered 25 energy groups of uniform size between the minimum energy of 0.1 MeV and the maximum of 1.0 MeV; the one spatial intervals number it was considered variable and it was assigned the values of 10, 20 and 30. (Author)
Lattice Boltzmann method for convection-diffusion equations with general interfacial conditions
Hu, Zexi; Huang, Juntao; Yong, Wen-An
2016-04-01
In this work, we propose an interfacial scheme accompanying the lattice Boltzmann method for convection-diffusion equations with general interfacial conditions, including conjugate conditions with or without jumps in heat and mass transfer, continuity of macroscopic variables and normal fluxes in ion diffusion in porous media with different porosity, and the Kapitza resistance in heat transfer. The construction of this scheme is based on our boundary schemes [Huang and Yong, J. Comput. Phys. 300, 70 (2015), 10.1016/j.jcp.2015.07.045] for Robin boundary conditions on straight or curved boundaries. It gives second-order accuracy for straight interfaces and first-order accuracy for curved ones. In addition, the new scheme inherits the advantage of the boundary schemes in which only the current lattice nodes are involved. Such an interfacial scheme is highly desirable for problems with complex geometries or in porous media. The interfacial scheme is numerically validated with several examples. The results show the utility of the constructed scheme and very well support our theoretical predications.
Energy Technology Data Exchange (ETDEWEB)
Buchan, Andrew G., E-mail: andrew.buchan@imperial.ac.uk [Applied Modelling and Computational Group, Department of Earth Science and Engineering, Imperial College of Science, Technology and Medicine (United Kingdom); Merton, Simon R. [AWE, Aldermaston, Reading RG7 4PR (United Kingdom); Pain, Christopher C. [Applied Modelling and Computational Group, Department of Earth Science and Engineering, Imperial College of Science, Technology and Medicine (United Kingdom); Smedley-Stevenson, Richard P. [AWE, Aldermaston, Reading RG7 4PR (United Kingdom)
2011-05-15
In this paper a method for resolving the various boundary conditions (BCs) for the first order Boltzmann transport equation (BTE) is described. The approach has been formulated to resolve general BCs using an arbitrary angular approximation method within any weighted residual finite element formulation. The method is based on a Riemann decomposition which is used to decompose the particles' angular dependence into in-coming and out-going information through a surface. This operation recasts the flux into a Riemann space which is used directly to remove any incoming information, and thus satisfy void boundary conditions. The method is then extended by its coupling with a set of mapping operators that redirect the outgoing flux to form incoming images resembling other specified boundary conditions. These operators are based on Galerkin projections and are defined to enable reflective and diffusive (white) BCs to be resolved. A small number of numerical examples are then presented to demonstrate the method's ability in resolving void, reflective and white BCs. These examples have been chosen in order to show the method working for arbitrary angled surfaces. Furthermore, as the method has been designed for an arbitrary angular approximation, both S{sub N} and P{sub N} calculations are presented.
Romano, Giuseppe; Esfarjani, Keivan; Strubbe, David A.; Broido, David; Kolpak, Alexie M.
2016-01-01
Nanostructured materials exhibit low thermal conductivity because of the additional scattering due to phonon-boundary interactions. As these interactions are highly sensitive to the mean free path (MFP) of phonons, MFP distributions in nanostructures can be dramatically distorted relative to bulk. Here we calculate the MFP distribution in periodic nanoporous Si for different temperatures, using the recently developed MFP-dependent Boltzmann transport equation. After analyzing the relative contribution of each phonon branch to thermal transport in nanoporous Si, we find that at room temperature optical phonons contribute 17 % to heat transport, compared to 5 % in bulk Si. Interestingly, we observe a constant thermal conductivity over the range 200 K acoustic phonons with long intrinsic MFP and the temperature dependence of the heat capacity. Our findings, which are in qualitative agreement with the temperature trend of thermal conductivities measured in nanoporous Si-based systems, shed light on the origin of the reduction of thermal conductivity in nanostructured materials and demonstrate the necessity of multiscale heat transport engineering, in which the bulk material and geometry are optimized concurrently.
On anisotropy function in crystal growth simulations using Lattice Boltzmann equation
Younsi, Amina
2016-01-01
In this paper, we present the ability of the Lattice Boltzmann (LB) equation, usually applied to simulate fluid flows, to simulate various shapes of crystals. Crystal growth is modeled with a phase-field model for a pure substance, numerically solved with a LB method in 2D and 3D. This study focuses on the anisotropy function that is responsible for the anisotropic surface tension between the solid phase and the liquid phase. The anisotropy function involves the unit normal vectors of the interface, defined by gradients of phase-field. Those gradients have to be consistent with the underlying lattice of the LB method in order to avoid unwanted effects of numerical anisotropy. Isotropy of the solution is obtained when the directional derivatives method, specific for each lattice, is applied for computing the gradient terms. With the central finite differences method, the phase-field does not match with its rotation and the solution is not any more isotropic. Next, the method is applied to simulate simultaneous...
Kernels of the linear Boltzmann equation for spherical particles and rough hard sphere particles.
Khurana, Saheba; Thachuk, Mark
2013-10-28
Kernels for the collision integral of the linear Boltzmann equation are presented for several cases. First, a rigorous and complete derivation of the velocity kernel for spherical particles is given, along with reductions to the smooth, rigid sphere case. This combines and extends various derivations for this kernel which have appeared previously in the literature. In addition, the analogous kernel is derived for the rough hard sphere model, for which a dependence upon both velocity and angular velocity is required. This model can account for exchange between translational and rotational degrees of freedom. Finally, an approximation to the exact rough hard sphere kernel is presented which averages over the rotational degrees of freedom in the system. This results in a kernel depending only upon velocities which retains a memory of the exchange with rotational states. This kernel tends towards the smooth hard sphere kernel in the limit when translational-rotational energy exchange is attenuated. Comparisons are made between the smooth and approximate rough hard sphere kernels, including their dependence upon velocity and their eigenvalues.
Shrinkage of bubbles and drops in the lattice Boltzmann equation method for nonideal gases
Zheng, Lin; Lee, Taehun; Guo, Zhaoli; Rumschitzki, David
2014-03-01
One characteristic of multiphase lattice Boltzmann equation (LBE) methods is that the interfacial region has a finite (i.e., noninfinitesimal) thickness known as a diffuse interface. In simulations of, e.g., bubble or drop dynamics, for problems involving nonideal gases, one frequently observes that the diffuse interface method produces a spontaneous, nonphysical shrinkage of the bubble or drop radius. In this paper, we analyze in detail a single-fluid two-phase model and use a LBE model for nonideal gases in order to explain this fundamental problem. For simplicity, we only investigate the static bubble or droplet problem. We find that the method indeed produces a density shift, bubble or droplet shrinkage, as well as a critical radius below which the bubble or droplet eventually vanishes. Assuming that the ratio between the interface thickness D and the initial bubble or droplet radius r0 is small, we analytically show the existence of this density shift, bubble or droplet radius shrinkage, and critical bubble or droplet survival radius. Numerical results confirm our analysis. We also consider droplets on a solid surface with different curvatures, contact angles, and initial droplet volumes. Numerical results show that the curvature, contact angle, and the initial droplet volume have an effect on this spontaneous shrinkage process, consistent with the survival criterion.
Li, Zhihui; Wu, Junlin; Ma, Qiang; Jiang, Xinyu; Zhang, Hanxin
2014-12-01
Based on the Gas-Kinetic Unified Algorithm (GKUA) directly solving the Boltzmann model equation, the effect of rotational non-equilibrium is investigated recurring to the kinetic Rykov model with relaxation property of rotational degrees of freedom. The spin movement of diatomic molecule is described by moment of inertia, and the conservation of total angle momentum is taken as a new Boltzmann collision invariant. The molecular velocity distribution function is integrated by the weight factor on the internal energy, and the closed system of two kinetic controlling equations is obtained with inelastic and elastic collisions. The optimization selection technique of discrete velocity ordinate points and numerical quadrature rules for macroscopic flow variables with dynamic updating evolvement are developed to simulate hypersonic flows, and the gas-kinetic numerical scheme is constructed to capture the time evolution of the discretized velocity distribution functions. The gas-kinetic boundary conditions in thermodynamic non-equilibrium and numerical procedures are studied and implemented by directly acting on the velocity distribution function, and then the unified algorithm of Boltzmann model equation involving non-equilibrium effect is presented for the whole range of flow regimes. The hypersonic flows involving non-equilibrium effect are numerically simulated including the inner flows of shock wave structures in nitrogen with different Mach numbers of 1.5-Ma-25, the planar ramp flow with the whole range of Knudsen numbers of 0.0009-Kn-10 and the three-dimensional re-entering flows around tine double-cone body.
Fiorentini, Mattia; Bonini, Nicola
2016-08-01
We present a first-principles computational approach to calculate thermoelectric transport coefficients via the exact solution of the linearized Boltzmann transport equation, also including the effect of nonequilibrium phonon populations induced by a temperature gradient. We use density functional theory and density functional perturbation theory for an accurate description of the electronic and vibrational properties of a system, including electron-phonon interactions; carriers' scattering rates are computed using standard perturbation theory. We exploit Wannier interpolation (both for electronic bands and electron-phonon matrix elements) for an efficient sampling of the Brillouin zone, and the solution of the Boltzmann equation is achieved via a fast and stable conjugate gradient scheme. We discuss the application of this approach to n -doped silicon. In particular, we discuss a number of thermoelectric properties such as the thermal and electrical conductivities of electrons, the Lorenz number and the Seebeck coefficient, including the phonon drag effect, in a range of temperatures and carrier concentrations. This approach gives results in good agreement with experimental data and provides a detailed characterization of the nature and the relative importance of the individual scattering mechanisms. Moreover, the access to the exact solution of the Boltzmann equation for a realistic system provides a direct way to assess the accuracy of different flavors of relaxation time approximation, as well as of models that are popular in the thermoelectric community to estimate transport coefficients.
Energy Technology Data Exchange (ETDEWEB)
Li, Zhihui; Ma, Qiang [Hypervelocity Aerodynamics Institute, China Aerodynamics Research and Development Center, P.O.Box 211, Mianyang 621000, China and National Laboratory for Computational Fluid Dynamics, No.37 Xueyuan Road, Beijing 100191 (China); Wu, Junlin; Jiang, Xinyu [Hypervelocity Aerodynamics Institute, China Aerodynamics Research and Development Center, P.O.Box 211, Mianyang 621000 (China); Zhang, Hanxin [National Laboratory for Computational Fluid Dynamics, No.37 Xueyuan Road, Beijing 100191 (China)
2014-12-09
Based on the Gas-Kinetic Unified Algorithm (GKUA) directly solving the Boltzmann model equation, the effect of rotational non-equilibrium is investigated recurring to the kinetic Rykov model with relaxation property of rotational degrees of freedom. The spin movement of diatomic molecule is described by moment of inertia, and the conservation of total angle momentum is taken as a new Boltzmann collision invariant. The molecular velocity distribution function is integrated by the weight factor on the internal energy, and the closed system of two kinetic controlling equations is obtained with inelastic and elastic collisions. The optimization selection technique of discrete velocity ordinate points and numerical quadrature rules for macroscopic flow variables with dynamic updating evolvement are developed to simulate hypersonic flows, and the gas-kinetic numerical scheme is constructed to capture the time evolution of the discretized velocity distribution functions. The gas-kinetic boundary conditions in thermodynamic non-equilibrium and numerical procedures are studied and implemented by directly acting on the velocity distribution function, and then the unified algorithm of Boltzmann model equation involving non-equilibrium effect is presented for the whole range of flow regimes. The hypersonic flows involving non-equilibrium effect are numerically simulated including the inner flows of shock wave structures in nitrogen with different Mach numbers of 1.5-Ma-25, the planar ramp flow with the whole range of Knudsen numbers of 0.0009-Kn-10 and the three-dimensional re-entering flows around tine double-cone body.
Chakavorty, Arghya; Li, Lin; Alexov, Emil
2016-10-30
Macromolecular interactions are essential for understanding numerous biological processes and are typically characterized by the binding free energy. Important component of the binding free energy is the electrostatics, which is frequently modeled via the solutions of the Poisson-Boltzmann Equations (PBE). However, numerous works have shown that the electrostatic component (ΔΔGelec ) of binding free energy is very sensitive to the parameters used and modeling protocol. This prompted some researchers to question the robustness of PBE in predicting ΔΔGelec . We argue that the sensitivity of the absolute ΔΔGelec calculated with PBE using different input parameters and definitions does not indicate PBE deficiency, rather this is what should be expected. We show how the apparent sensitivity should be interpreted in terms of the underlying changes in several numerous and physical parameters. We demonstrate that PBE approach is robust within each considered force field (CHARMM-27, AMBER-94, and OPLS-AA) once the corresponding structures are energy minimized. This observation holds despite of using two different molecular surface definitions, pointing again that PBE delivers consistent results within particular force field. The fact that PBE delivered ΔΔGelec values may differ if calculated with different modeling protocols is not a deficiency of PBE, but natural results of the differences of the force field parameters and potential functions for energy minimization. In addition, while the absolute ΔΔGelec values calculated with different force field differ, their ordering remains practically the same allowing for consistent ranking despite of the force field used. © 2016 Wiley Periodicals, Inc.
Lattice Boltzmann Model for the Coupled Korteweg-de Vries Equations%耦合KdV方程组的格子Boltzmann模型
Institute of Scientific and Technical Information of China (English)
王慧敏; 刘艳红
2012-01-01
用格子Boltzmann方法研究耦合KdV方程组.构建耦合KdV方程组的格子Boltzmann模型并进行了数值实验,同时将格子Boltzmann解与其他传统数值方法得到的数值解进行比较.结果表明,格子Boltzmann方法是一种求解耦合KdV方程组的有效方法.%We used the lattice Boltzmann method to study the coupled Korteweg-de Vries equations. We constructed a lattice Boltzmann model for the coupled Korteweg-de Vries equations, and performed numerical experiments. Comparing the lattice Boltzmann solution with other numerical solutions, we obtained that the lattice Boltzmann method is an effective method for simulating the coupled Korteweg-de Vries equations.
Energy Technology Data Exchange (ETDEWEB)
Lloyd, S. A. M.; Ansbacher, W. [Department of Physics and Astronomy, University of Victoria, Victoria, British Columbia V8W 3P6 (Canada); Department of Physics and Astronomy, University of Victoria, Victoria, British Columbia V8W 3P6 (Canada) and Department of Medical Physics, British Columbia Cancer Agency-Vancouver Island Centre, Victoria, British Columbia V8R 6V5 (Canada)
2013-01-15
Purpose: Acuros external beam (Acuros XB) is a novel dose calculation algorithm implemented through the ECLIPSE treatment planning system. The algorithm finds a deterministic solution to the linear Boltzmann transport equation, the same equation commonly solved stochastically by Monte Carlo methods. This work is an evaluation of Acuros XB, by comparison with Monte Carlo, for dose calculation applications involving high-density materials. Existing non-Monte Carlo clinical dose calculation algorithms, such as the analytic anisotropic algorithm (AAA), do not accurately model dose perturbations due to increased electron scatter within high-density volumes. Methods: Acuros XB, AAA, and EGSnrc based Monte Carlo are used to calculate dose distributions from 18 MV and 6 MV photon beams delivered to a cubic water phantom containing a rectangular high density (4.0-8.0 g/cm{sup 3}) volume at its center. The algorithms are also used to recalculate a clinical prostate treatment plan involving a unilateral hip prosthesis, originally evaluated using AAA. These results are compared graphically and numerically using gamma-index analysis. Radio-chromic film measurements are presented to augment Monte Carlo and Acuros XB dose perturbation data. Results: Using a 2% and 1 mm gamma-analysis, between 91.3% and 96.8% of Acuros XB dose voxels containing greater than 50% the normalized dose were in agreement with Monte Carlo data for virtual phantoms involving 18 MV and 6 MV photons, stainless steel and titanium alloy implants and for on-axis and oblique field delivery. A similar gamma-analysis of AAA against Monte Carlo data showed between 80.8% and 87.3% agreement. Comparing Acuros XB and AAA evaluations of a clinical prostate patient plan involving a unilateral hip prosthesis, Acuros XB showed good overall agreement with Monte Carlo while AAA underestimated dose on the upstream medial surface of the prosthesis due to electron scatter from the high-density material. Film measurements
Lattice Boltzmann equation calculation of internal, pressure-driven turbulent flow
Hammond, L A; Care, C M; Stevens, A
2002-01-01
We describe a mixing-length extension of the lattice Boltzmann approach to the simulation of an incompressible liquid in turbulent flow. The method uses a simple, adaptable, closure algorithm to bound the lattice Boltzmann fluid incorporating a law-of-the-wall. The test application, of an internal, pressure-driven and smooth duct flow, recovers correct velocity profiles for Reynolds number to 1.25 x 10 sup 5. In addition, the Reynolds number dependence of the friction factor in the smooth-wall branch of the Moody chart is correctly recovered. The method promises a straightforward extension to other curves of the Moody chart and to cylindrical pipe flow.
Conjugate heat and mass transfer in the lattice Boltzmann equation method.
Li, Like; Chen, Chen; Mei, Renwei; Klausner, James F
2014-04-01
An interface treatment for conjugate heat and mass transfer in the lattice Boltzmann equation method is proposed based on our previously proposed second-order accurate Dirichlet and Neumann boundary schemes. The continuity of temperature (concentration) and its flux at the interface for heat (mass) transfer is intrinsically satisfied without iterative computations, and the interfacial temperature (concentration) and their fluxes are conveniently obtained from the microscopic distribution functions without finite-difference calculations. The present treatment takes into account the local geometry of the interface so that it can be directly applied to curved interface problems such as conjugate heat and mass transfer in porous media. For straight interfaces or curved interfaces with no tangential gradient, the coupling between the interfacial fluxes along the discrete lattice velocity directions is eliminated and thus the proposed interface schemes can be greatly simplified. Several numerical tests are conducted to verify the applicability and accuracy of the proposed conjugate interface treatment, including (i) steady convection-diffusion in a channel containing two different fluids, (ii) unsteady convection-diffusion in the channel, (iii) steady heat conduction inside a circular domain with two different solid materials, and (iv) unsteady mass transfer from a spherical droplet in an extensional creeping flow. The accuracy and order of convergence of the simulated interior temperature (concentration) field, the interfacial temperature (concentration), and heat (mass) flux are examined in detail and compared with those obtained from the "half-lattice division" treatment in the literature. The present analysis and numerical results show that the half-lattice division scheme is second-order accurate only when the interface is fixed at the center of the lattice links, while the present treatment preserves second-order accuracy for arbitrary link fractions. For curved
A Discussion on Whether 15-20C Are All Skin Nuclei via Isospin-dependent Boltzmann-Langevin Equation
Institute of Scientific and Technical Information of China (English)
CHEN Yu; ZHANG Feng-Shou; SU Jun
2009-01-01
A new attempt of calculation for the total reaction cross sections (σR) has been carried out within the isospin-dependent Boltzmann-Langevin equation in the intermediate energy heavy-ion collision of isotopes of G. The σR of both stable and exotic nuclei are reproduced rather well. The incident energy and isospin dependencies of σR have been investigated. It is found that the isospin effect is comparatively remarkable at intermediate energy. It is also found that ~(15-18)C are neutron skin nuclei but for ~(19)C and ~(20)C we cannot draw a conclusion whether they have halo structures.
Di, Shaoyan; Shen, Lei; Chang, Pengying; Zhao, Kai; Lu, Tiao; Du, Gang; Liu, Xiaoyan
2017-04-01
A deterministic time-dependent Boltzmann transport equation (BTE) solver is employed to carry out a comparison work among 10 nm double-gate n-type MOSFETs with channel materials of Si, In0.53Ga0.47As, and GaSb in different surface orientations. Results show that the GaSb device has the highest drive current, while scattering affects carrier transport in the Si device the most. The InGaAs device exhibits the highest injection velocity but suffers from the density of state (DOS) bottleneck seriously.
Hu, Kainan; Geng, Shaojuan
2016-01-01
A decoupled scheme based on the Hermite expansion to construct lattice Boltzmann models for the compressible Navier-Stokes equations with arbitrary specific heat ratio is proposed. The local equilibrium distribution function including the rotational velocity of particle is decoupled into two parts, i.e. the local equilibrium distribution function of the translational velocity of particle and that of the rotational velocity of particle. From these two local equilibrium functions, two lattice Boltzmann models are derived via the Hermite expansion, namely one is in relation to the translational velocity and the other is connected with the rotational velocity. Accordingly, the distribution function is also decoupled. After this, the evolution equation is decoupled into the evolution equation of the translational velocity and that of the rotational velocity. The two evolution equations evolve separately. The lattice Boltzmann models used in the scheme proposed by this work are constructed via the Hermite expansion...
Ying, Jinyong
2016-01-01
The size-modified Poisson-Boltzmann equation (SMPBE) is one important variant of the popular dielectric model, the Poisson-Boltzmann equation (PBE), to reflect ionic size effects in the prediction of electrostatics for a biomolecule in an ionic solvent. In this paper, a new SMPBE hybrid solver is developed using a solution decomposition, the Schwartz's overlapped domain decomposition, finite element, and finite difference. It is then programmed as a software package in C, Fortran, and Python based on the state-of-the-art finite element library DOLFIN from the FEniCS project. This software package is well validated on a Born ball model with analytical solution and a dipole model with a known physical properties. Numerical results on six proteins with different net charges demonstrate its high performance. Finally, this new SMPBE hybrid solver is shown to be numerically stable and convergent in the calculation of electrostatic solvation free energy for 216 biomolecules and binding free energy for a DNA-drug com...
Energy Technology Data Exchange (ETDEWEB)
Mirza, Anwar M. [Department of Computer Science, National University of Computer and Emerging Sciences, NUCES-FAST, A.K. Brohi Road, H-11, Islamabad (Pakistan)], E-mail: anwar.m.mirza@gmail.com; Iqbal, Shaukat [Faculty of Computer Science and Engineering, Ghulam Ishaq Khan (GIK) Institute of Engineering Science and Technology, Topi-23460, Swabi (Pakistan)], E-mail: shaukat@giki.edu.pk; Rahman, Faizur [Department of Physics, Allama Iqbal Open University, H-8 Islamabad (Pakistan)
2007-07-15
A spatially adaptive grid-refinement approach has been investigated to solve the even-parity Boltzmann transport equation. A residual based a posteriori error estimation scheme has been utilized for checking the approximate solutions for various finite element grids. The local particle balance has been considered as an error assessment criterion. To implement the adaptive approach, a computer program ADAFENT (adaptive finite elements for neutron transport) has been developed to solve the second order even-parity Boltzmann transport equation using K{sup +} variational principle for slab geometry. The program has a core K{sup +} module which employs Lagrange polynomials as spatial basis functions for the finite element formulation and Legendre polynomials for the directional dependence of the solution. The core module is called in by the adaptive grid generator to determine local gradients and residuals to explore the possibility of grid refinements in appropriate regions of the problem. The a posteriori error estimation scheme has been implemented in the outer grid refining iteration module. Numerical experiments indicate that local errors are large in regions where the flux gradients are large. A comparison of the spatially adaptive grid-refinement approach with that of uniform meshing approach for various benchmark cases confirms its superiority in greatly enhancing the accuracy of the solution without increasing the number of unknown coefficients. A reduction in the local errors of the order of 10{sup 2} has been achieved using the new approach in some cases.
Lahiri, T.; Pal Majumder, T.; Ghosh, N. K.
2014-07-01
Commercialization of ferroelectric liquid crystal displays (FLCDs) suffers from mechanical and electro-convective instabilities. Impurity ions play a pivotal role in the latter case, and therefore we developed a mean-field type model to understand the complex role of space charges, particularly ions in a ferroelectric liquid crystal. Considering an effective ion-chirality relation, we obtained a modified Poisson-Boltzmann equation for ions dissolved into a chiral solvent like the ferroelectric smectic phase. A nonuniform director profile induced by the mean electrostatic potential of the ions is then calculated by solving an Euler-Lagrange equation for a helically twisted smectic state. A combination of effects resulting from molecular chirality and an electrostatically driven twist created by the ions seems to produce this nonuniform fluctuation in the director orientation. Finally, both theoretical and experimental points of view are presented on the prediction of this mean-field model.
Coarse-grained transport of a turbulent flow via moments of the Reynolds-averaged Boltzmann equation
Abramov, Rafail V
2015-01-01
Here we introduce new coarse-grained variables for a turbulent flow in the form of moments of its Reynolds-averaged Boltzmann equation. With the exception of the collision moments, the transport equations for the new variables are identical to the usual moment equations, and thus naturally lend themselves to the variety of already existing closure methods. Under the anelastic turbulence approximation, we derive equations for the Reynolds-averaged turbulent fluctuations around the coarse-grained state. We show that the global relative entropy of the coarse-grained state is bounded from above by the Reynolds average of the fine-grained global relative entropy, and thus obeys the time decay bound of Desvillettes and Villani. This is similar to what is observed in the rarefied gas dynamics, which makes the Grad moment closure a good candidate for truncating the hierarchy of the coarse-grained moment equations. We also show that, under additional assumptions on the form of the coarse-grained collision terms, one a...
Jungemann, C.; Pham, A. T.; Meinerzhagen, B.; Ringhofer, C.; Bollhöfer, M.
2006-07-01
The Boltzmann equation for transport in semiconductors is projected onto spherical harmonics in such a way that the resultant balance equations for the coefficients of the distribution function times the generalized density of states can be discretized over energy and real spaces by box integration. This ensures exact current continuity for the discrete equations. Spurious oscillations of the distribution function are suppressed by stabilization based on a maximum entropy dissipation principle avoiding the H transformation. The derived formulation can be used on arbitrary grids as long as box integration is possible. The approach works not only with analytical bands but also with full band structures in the case of holes. Results are presented for holes in bulk silicon based on a full band structure and electrons in a Si NPN bipolar junction transistor. The convergence of the spherical harmonics expansion is shown for a device, and it is found that the quasiballistic transport in nanoscale devices requires an expansion of considerably higher order than the usual first one. The stability of the discretization is demonstrated for a range of grid spacings in the real space and bias points which produce huge gradients in the electron density and electric field. It is shown that the resultant large linear system of equations can be solved in a memory efficient way by the numerically robust package ILUPACK.
Xiong, Yuan
2014-04-28
Spurious current emerging in the vicinity of phase interfaces is a well-known disadvantage of the lattice Boltzmann equation (LBE) for two-phase flows. Previous analysis shows that this unphysical phenomenon comes from the force imbalance at discrete level inherited in LBE (Guo et al 2011 Phys. Rev. E 83 036707). Based on the analysis of the LBE free of checkerboard effects, in this work we further show that the force imbalance is caused by the different discretization stencils: the implicit one from the streaming process and the explicit one from the discretization of the force term. Particularly, the total contribution includes two parts, one from the difference between the intrinsically discretized density (or ideal gas pressure) gradient and the explicit ones in the force term, and the other from the explicit discretized chemical potential gradients in the intrinsically discretized force term. The former contribution is a special feature of LBE which was not realized previously.
A multi-term solution of the space-time Boltzmann equation for electrons in gaseous and liquid Argon
Boyle, G J; Tattersall, W J; McEachran, R P; White, R D
2015-01-01
In a recent paper [1] the scattering and transport of excess electrons in liquid argon in the hydrodynamic regime was investigated, generalizing the seminal works of Lekner and Cohen [2,3] with modern scattering theory techniques and kinetic theory. In this paper, the discussion is extended to the non-hydrodynamic regime through the development of a full multi-term space-time solution of Boltzmann's equation for electron transport in gases and liquids using a novel operator-splitting method. A Green's function formalism is considered that enables flexible adaptation to various experimental systems. The spatio-temporal evolution of electrons in liquids in the hydrodynamic regime is studied for a benchmark model Percus-Yevick liquid as well as for liquid argon. The temporal evolution of Franck-Hertz oscillations are observed for liquids, with striking differences in the spatio-temporal development of the velocity distribution function components between the uncorrelated gas and true liquid approximations in arg...
Langevin Poisson-Boltzmann equation: point-like ions and water dipoles near a charged surface.
Gongadze, Ekaterina; van Rienen, Ursula; Kralj-Iglič, Veronika; Iglič, Aleš
2011-06-01
Water ordering near a charged membrane surface is important for many biological processes such as binding of ligands to a membrane or transport of ions across it. In this work, the mean-field Poisson-Boltzmann theory for point-like ions, describing an electrolyte solution in contact with a planar charged surface, is modified by including the orientational ordering of water. Water molecules are considered as Langevin dipoles, while the number density of water is assumed to be constant everywhere in the electrolyte solution. It is shown that the dielectric permittivity of an electrolyte close to a charged surface is decreased due to the increased orientational ordering of water dipoles. The dielectric permittivity close to the charged surface is additionally decreased due to the finite size of ions and dipoles.
Stable Equilibrium Based on Lévy Statistics:A Linear Boltzmann Equation Approach
Barkai, Eli
2004-06-01
To obtain further insight on possible power law generalizations of Boltzmann equilibrium concepts, we consider stochastic collision models. The models are a generalization of the Rayleigh collision model, for a heavy one dimensional particle M interacting with ideal gas particles with a mass mlaw equilibrium. We show, under certain conditions, that the velocity distribution function of the heavy particle is Lévy stable, the Maxwellian distribution being a special case. We demonstrate our results with numerical examples. The relation of the power law equilibrium obtained here to thermodynamics is discussed. In particular we compare between two models: a thermodynamic and an energy scaling approaches. These models yield insight into questions like the meaning of temperature for power law equilibrium, and into the issue of the universality of the equilibrium (i.e., is the width of the generalized Maxwellian distribution functions obtained here, independent of coupling constant to the bath).
Institute of Scientific and Technical Information of China (English)
无
2009-01-01
The Boltzmann simplified velocity distribution function equation describing the gas transfer phenomena from various flow regimes will be explored and solved numerically in this study. The discrete velocity ordinate method of the gas kinetic theory is studied and applied to simulate the complex multi-scale flows. Based on the uncoupling technique on molecular movement and colliding in the DSMC method, the gas-kinetic finite difference scheme is constructed to directly solve the discrete velocity distribution functions by extending and applying the unsteady time-splitting method from computational fluid dynamics. The Gauss-type discrete velocity numerical quadrature technique for different Mach number flows is developed to evaluate the macroscopic flow parameters in the physical space. As a result, the gas-kinetic numerical algorithm is established to study the three-dimensional complex flows from rarefied transition to continuum regimes. The parallel strategy adapted to the gas-kinetic numerical algorithm is investigated by analyzing the inner parallel degree of the algorithm, and then the HPF parallel processing program is developed. To test the reliability of the present gas-kinetic numerical method, the three-dimensional complex flows around sphere and spacecraft shape with various Knudsen numbers are simulated by HPF parallel computing. The computational results are found in high resolution of the flow fields and good agreement with the theoretical and experimental data. The computing practice has confirmed that the present gas-kinetic algorithm probably provides a promising approach to resolve the hypersonic aerothermodynamic problems with the complete spectrum of flow regimes from the gas-kinetic point of view of solving the Boltzmann model equation.
Ahrens, Cory D
2014-01-01
The classical $S_n$ equations of Carlson and Lee have been a mainstay in multi-dimensional radiation transport calculations. In this paper, an alternative to the $S_n$ equations, the "Lagrange Discrete Ordinate" (LDO) equations are derived. These equations are based on an interpolatory framework for functions on the unit sphere in three dimensions. While the LDO equations retain the formal structure of the classical $S_n$ equations, they have a number of important differences. The LDO equations naturally allow the angular flux to be evaluated in directions other than those found in the quadrature set. To calculate the scattering source in the LDO equations, no spherical harmonic moments are needed--only values of the angular flux. Moreover, the LDO scattering source preserves the eigenstructure of the continuous scattering operator. The formal similarity of the LDO equations with the $S_n$ equations should allow easy modification of mature 3D $S_n$ codes such as PARTISN or PENTRAN to solve the LDO equations. ...
Ender, I A; Flegontova, E Yu; Gerasimenko, A B
2016-01-01
An algorithm for sequential calculation of non-isotropic matrix elements of the collision integral which are necessary for the solution of the non-linear Boltzmann equation by moment method is proposed. Isotropic matrix elements that we believe are known, are starting ones. The procedure is valid for any interaction law and any mass ratio of the colliding particles.
Ringe, Stefan; Oberhofer, Harald; Hille, Christoph; Matera, Sebastian; Reuter, Karsten
2016-08-01
The size-modified Poisson-Boltzmann (MPB) equation is an efficient implicit solvation model which also captures electrolytic solvent effects. It combines an account of the dielectric solvent response with a mean-field description of solvated finite-sized ions. We present a general solution scheme for the MPB equation based on a fast function-space-oriented Newton method and a Green's function preconditioned iterative linear solver. In contrast to popular multigrid solvers, this approach allows us to fully exploit specialized integration grids and optimized integration schemes. We describe a corresponding numerically efficient implementation for the full-potential density-functional theory (DFT) code FHI-aims. We show that together with an additional Stern layer correction the DFT+MPB approach can describe the mean activity coefficient of a KCl aqueous solution over a wide range of concentrations. The high sensitivity of the calculated activity coefficient on the employed ionic parameters thereby suggests to use extensively tabulated experimental activity coefficients of salt solutions for a systematic parametrization protocol.
Generalized Poisson-Boltzmann Equation Taking into Account Ionic Interaction and Steric Effects
Institute of Scientific and Technical Information of China (English)
刘新敏; 李航; 李睿; 田锐; 许晨阳
2012-01-01
Generalized Poisson l3oltzmann equation which takes into account both ionic interaction in bulk solution and steric effects of adsorbed ions has been suggested. We found that, for inorganic cations adsorption on negatively charged surface, the steric effect is not significant for surface charge density 〈 0.0032 C/dm2, while the ionic interaction is an important effect for electrolyte concentration 〉 0.15 tool/1 in bulk solution. We conclude that for most actual cases the original PB equation can give reliable result in describing inorganic cation adsorption.
Hu, Kainan; Zhang, Hongwu; Geng, Shaojuan
2016-10-01
A decoupled scheme based on the Hermite expansion to construct lattice Boltzmann models for the compressible Navier-Stokes equations with arbitrary specific heat ratio is proposed. The local equilibrium distribution function including the rotational velocity of particle is decoupled into two parts, i.e., the local equilibrium distribution function of the translational velocity of particle and that of the rotational velocity of particle. From these two local equilibrium functions, two lattice Boltzmann models are derived via the Hermite expansion, namely one is in relation to the translational velocity and the other is connected with the rotational velocity. Accordingly, the distribution function is also decoupled. After this, the evolution equation is decoupled into the evolution equation of the translational velocity and that of the rotational velocity. The two evolution equations evolve separately. The lattice Boltzmann models used in the scheme proposed by this work are constructed via the Hermite expansion, so it is easy to construct new schemes of higher-order accuracy. To validate the proposed scheme, a one-dimensional shock tube simulation is performed. The numerical results agree with the analytical solutions very well.
Illg, Christian; Haag, Michael; Teeny, Nicolas; Wirth, Jens; Fähnle, Manfred
2016-03-01
Scatterings of electrons at quasiparticles or photons are very important for many topics in solid-state physics, e.g., spintronics, magnonics or photonics, and therefore a correct numerical treatment of these scatterings is very important. For a quantum-mechanical description of these scatterings, Fermi's golden rule is used to calculate the transition rate from an initial state to a final state in a first-order time-dependent perturbation theory. One can calculate the total transition rate from all initial states to all final states with Boltzmann rate equations involving Brillouin zone integrations. The numerical treatment of these integrations on a finite grid is often done via a replacement of the Dirac delta distribution by a Gaussian. The Dirac delta distribution appears in Fermi's golden rule where it describes the energy conservation among the interacting particles. Since the Dirac delta distribution is a not a function it is not clear from a mathematical point of view that this procedure is justified. We show with physical and mathematical arguments that this numerical procedure is in general correct, and we comment on critical points.
Energy Technology Data Exchange (ETDEWEB)
Bankovic, A., E-mail: ana.bankovic@gmail.com [Institute of Physics, University of Belgrade, Pregrevica 118, 11080 Belgrade (Serbia); Dujko, S. [Institute of Physics, University of Belgrade, Pregrevica 118, 11080 Belgrade (Serbia); Centrum Wiskunde and Informatica (CWI), P.O. Box 94079, 1090 GB Amsterdam (Netherlands); ARC Centre for Antimatter-Matter Studies, School of Engineering and Physical Sciences, James Cook University, Townsville, QLD 4810 (Australia); White, R.D. [ARC Centre for Antimatter-Matter Studies, School of Engineering and Physical Sciences, James Cook University, Townsville, QLD 4810 (Australia); Buckman, S.J. [ARC Centre for Antimatter-Matter Studies, Australian National University, Canberra, ACT 0200 (Australia); Petrovic, Z.Lj. [Institute of Physics, University of Belgrade, Pregrevica 118, 11080 Belgrade (Serbia)
2012-05-15
This work reports on a new series of calculations of positron transport properties in molecular hydrogen under the influence of spatially homogeneous electric field. Calculations are performed using a Monte Carlo simulation technique and multi term theory for solving the Boltzmann equation. Values and general trends of the mean energy, drift velocity and diffusion coefficients as a function of the reduced electric field E/n{sub 0} are reported here. Emphasis is placed on the explicit and implicit effects of positronium (Ps) formation on the drift velocity and diffusion coefficients. Two important phenomena arise; first, for certain regions of E/n{sub 0} the bulk and flux components of the drift velocity and longitudinal diffusion coefficient are markedly different, both qualitatively and quantitatively. Second, and contrary to previous experience in electron swarm physics, there is negative differential conductivity (NDC) effect in the bulk drift velocity component with no indication of any NDC for the flux component. In order to understand this atypical manifestation of the drift and diffusion of positrons in H{sub 2} under the influence of electric field, the spatially dependent positron transport properties such as number of positrons, average energy and velocity and spatially resolved rate for Ps formation are calculated using a Monte Carlo simulation technique. The spatial variation of the positron average energy and extreme skewing of the spatial profile of positron swarm are shown to play a central role in understanding the phenomena.
Priimak, Dmitri
2014-01-01
We present finite differences numerical algorithm for solving 2D spatially homogeneous Boltzmann transport equation for semiconductor superlattices (SL) subject to time dependant electric field along SL axis and constant perpendicular magnetic field. Algorithm is implemented in C language targeted to CPU and in CUDA C language targeted to commodity NVidia GPUs. We compare performance and merits of one implementation versus another and discuss various methods of optimization.
Energy Technology Data Exchange (ETDEWEB)
Mikell, Justin K. [Department of Radiation Physics, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); University of Texas Graduate School of Biomedical Sciences at Houston, Houston, Texas (United States); Klopp, Ann H. [Department of Radiation Oncology, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Gonzalez, Graciela M.N. [Department of Biostatistics, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Kisling, Kelly D. [Department of Radiation Physics-Patient Care, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); University of Texas Graduate School of Biomedical Sciences at Houston, Houston, Texas (United States); Price, Michael J. [Department of Physics and Astronomy, Louisiana State University and Agricultural and Mechanical College, Baton Rouge, Louisiana, and Mary Bird Perkins Cancer Center, Baton Rouge, Louisiana (United States); Berner, Paula A. [Department of Radiation Physics, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Eifel, Patricia J. [Department of Radiation Oncology, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Mourtada, Firas, E-mail: fmourtad@christianacare.org [Department of Radiation Physics-Patient Care, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Department of Experimental Diagnostic Imaging, University of Texas MD Anderson Cancer Center, Houston, Texas (United States); Department of Radiation Oncology, Helen F. Graham Cancer Center, Newark, Delaware (United States)
2012-07-01
Purpose: To investigate the dosimetric impact of the heterogeneity dose calculation Acuros (Transpire Inc., Gig Harbor, WA), a grid-based Boltzmann equation solver (GBBS), for brachytherapy in a cohort of cervical cancer patients. Methods and Materials: The impact of heterogeneities was retrospectively assessed in treatment plans for 26 patients who had previously received {sup 192}Ir intracavitary brachytherapy for cervical cancer with computed tomography (CT)/magnetic resonance-compatible tandems and unshielded colpostats. The GBBS models sources, patient boundaries, applicators, and tissue heterogeneities. Multiple GBBS calculations were performed with and without solid model applicator, with and without overriding the patient contour to 1 g/cm{sup 3} muscle, and with and without overriding contrast materials to muscle or 2.25 g/cm{sup 3} bone. Impact of source and boundary modeling, applicator, tissue heterogeneities, and sensitivity of CT-to-material mapping of contrast were derived from the multiple calculations. American Association of Physicists in Medicine Task Group 43 (TG-43) guidelines and the GBBS were compared for the following clinical dosimetric parameters: Manchester points A and B, International Commission on Radiation Units and Measurements (ICRU) report 38 rectal and bladder points, three and nine o'clock, and {sub D2cm3} to the bladder, rectum, and sigmoid. Results: Points A and B, D{sub 2} cm{sup 3} bladder, ICRU bladder, and three and nine o'clock were within 5% of TG-43 for all GBBS calculations. The source and boundary and applicator account for most of the differences between the GBBS and TG-43 guidelines. The D{sub 2cm3} rectum (n = 3), D{sub 2cm3} sigmoid (n = 1), and ICRU rectum (n = 6) had differences of >5% from TG-43 for the worst case incorrect mapping of contrast to bone. Clinical dosimetric parameters were within 5% of TG-43 when rectal and balloon contrast were mapped to bone and radiopaque packing was not overridden
Raines, Alla
2015-01-01
Numerical solution of non-steady problems of supersonic inflow of a binary mixture of a rarefied gas on a normally posed wall with mirror and diffuse reflection laws is obtained on the basis of the kinetic Boltzmann equation for the model of hard sphere molecules. For calculation of collision integrals we apply the projection method, developed by Tcheremissine for a one-component gas and generalized by the author for a binary gas mixture in the case of cylindrical symmetry. We demonstrate a good qualitative agreement of our results with other authors for one-component gases.
Institute of Scientific and Technical Information of China (English)
段雅丽; 陈先进; 孔令华
2015-01-01
We develop a lattice Boltzmann model for compound Burgers-Korteweg-de Vries ( cBKdV) equation. By properly treating dispersive term uxxx and applying Chapman-Enskog expansion, the governing equation is recovered correctly from lattice Boltzmann equation and local equilibrium distribution functions are obtained. Numerical experiments show that our results agree well with exact solutions and have better numerical accuracy compared with previous numerical results. This hence indicates that the model is satisfactory and efficient.%针对Burgers-Korteweg-de Vries ( cBKdV)复合方程提出一种格子Boltzmann模型。通过恰当地处理色散项uxxx 并运用Chapman-Enskog展开从格子Boltzmann方程推导出宏观方程，从而得到联系微观量与宏观量的局部平衡分布函数。对不同微分方程进行数值实验，数值解与解析解非常吻合，相比于其它数值结果，该格子Boltzmann模型的数值结果更精确，说明该数值模型的高效性。
André, Raíla
2014-01-01
In this work we analyze the dynamics of collisionless self-gravitating systems described by the f(R)-gravity and Boltzmann equation in the weak field approximation, focusing on the Jeans instability for theses systems. The field equations in this approximation were obtained within the Palatini formalism. Through the solution of coupled equations we achieved the collapse criterion for infinite homogeneous fluid and stellar systems, which is given by a dispersion relation. This result is compared with the results of the standard case and the case for f(R)-gravity in metric formalism, in order to see the difference among them. The limit of instability varies according to which theory of gravity is adopted.
Noronha, Jorge
2015-01-01
In this paper we obtain an analytical solution of the relativistic Boltzmann equation under the relaxation time approximation that describes the out-of-equilibrium dynamics of a radially expanding massless gas. This solution is found by mapping this expanding system in flat spacetime to a static flow in the curved spacetime $\\mathrm{AdS}_{2}\\otimes \\mathrm{S}_{2}$. We further derive explicit analytic expressions for the momentum dependence of the single particle distribution function as well as for the spatial dependence of its moments. We find that this dissipative system has the ability to flow as a perfect fluid even though its entropy density does not match the equilibrium form. The non-equilibrium contribution to the entropy density is shown to be due to higher order scalar moments (which possess no hydrodynamical interpretation) of the Boltzmann equation that can remain out of equilibrium but do not couple to the energy-momentum tensor of the system. Thus, in this system the slowly moving hydrodynamic d...
KdV方程带修正函数的格子Boltzmann模拟%Lattice Boltzmann model with amending function for KdV equation
Institute of Scientific and Technical Information of China (English)
何郁波; 董晓亮; 林晓艳
2012-01-01
A new lattice Boltzmann model with amending-function for KdV equation is presented. Monotonicity and stability of the scheme are analyzed. The conditions of monotonicity are obtained, under which the stability of the scheme is proved in the L1 norm. Applied the proposed scheme, the solutions of KdV equation are simulated, and numerical results agree with the analytical solutions quite well.%采用一种带修正函数的新格子Boltzmann模型模拟了KdV方程,分析了由此得出的迭代格式的单调性和稳定性,得到了格式的单调性条件.在单调性条件下,迭代格式是L1稳定的.数值模拟结果表明该格式是可行的.
Mendes, Albert C R; Abreu, Everton M C; Neto, Jorge Ananias
2016-01-01
In this work we have obtained a higher-derivative Lagrangian for a charged fluid coupled with the electromagnetic fluid and the Dirac's constraints analysis was discussed. A set of first-class constraints fixed by noncovariant gauge condition was obtained. The path integral formalism was used to obtain the partition function for the corresponding higher-derivative Hamiltonian and the Faddeev-Popov ansatz was used to construct an effective Lagrangian. Through the partition function, a Stefan-Boltzmann type law was obtained.
Energy Technology Data Exchange (ETDEWEB)
Horsten, N., E-mail: niels.horsten@kuleuven.be; Baelmans, M. [KU Leuven, Department of Mechanical Engineering, Celestijnenlaan 300A, 3001 Leuven (Belgium); Dekeyser, W. [ITER Organization, route de Vinon-sur-Verdon, 13067 St. Paul lez Durance Cedex (France); Samaey, G. [KU Leuven, Department of Computer Science, Celestijnenlaan 200A, 3001 Leuven (Belgium)
2016-01-15
We derive fluid neutral approximations for a simplified 1D edge plasma model, suitable to study the neutral behavior close to the target of a nuclear fusion divertor, and compare its solutions to the solution of the corresponding kinetic Boltzmann equation. The plasma is considered as a fixed background extracted from a detached 2D simulation. We show that the Maxwellian equilibrium distribution is already obtained very close to the target, justifying the use of a fluid approximation. We compare three fluid neutral models: (i) a diffusion model; (ii) a pressure-diffusion model (i.e., a combination of a continuity and momentum equation) assuming equal neutral and ion temperatures; and (iii) the pressure-diffusion model coupled to a neutral energy equation taking into account temperature differences between neutrals and ions. Partial reflection of neutrals reaching the boundaries is included in both the kinetic and fluid models. We propose two methods to obtain an incident neutral flux boundary condition for the fluid models: one based on a diffusion approximation and the other assuming a truncated Chapman-Enskog distribution. The pressure-diffusion model predicts the plasma sources very well. The diffusion boundary condition gives slightly better results overall. Although including an energy equation still improves the results, the assumption of equal ion and neutral temperature already gives a very good approximation.
Energy Technology Data Exchange (ETDEWEB)
Fidler, Christian
2011-12-16
Polarisation and Nongaussianity are expected to play a central role in future studies of the cosmic microwave background radiation. Polarisation can be split into a divergence-like E-mode and a curl-like B-mode, of which the later can only be induced by primordial gravitational waves (tensor fluctuations of the metric) at leading order. Nongaussianity is not generated at first order and is directly proportional to the primordial Nongaussianity of inflation. Thus B-mode polarisation and Nongaussianity constrain inflation models directly. While E-mode polarisation has already been detected and is being observed with increasing precision, B-mode polarisation and Nongaussianity remains elusive. The absence of B-mode polarisation when the primordial fluctuations are purely scalar holds, however, only in linear perturbation theory. B-mode polarisation is also generated from scalar sources in second order, which may constitute an important background to the search for primordial gravitational waves. While such an effect would naturally be expected to be relevant at tensor-to-scalar ratios of order 10{sup -5}, which is the size of perturbations in the microwave background, only a full second order calculation can tell whether there are no enhancements. For Nongaussianity the situation is analogous: At second order intrinsic Nongaussianities are induced to the spectrum, which may be an important background to the primordial Nongaussianity. After the full second-order Boltzmann equations for the cosmological evolution of the polarised radiation distribution have become available, I focused on the novel sources to B-mode polarisation that appear in the second-order collision term, which have not been calculated before. In my PHD thesis I developed a numerical code, which solves the second order Boltzmann hierarchy and calculates the C{sub l}{sup BB}-spectrum.
Reciprocal Symmetric Boltzmann Function and Unified Boson-Fermion Statistics
2007-01-01
The differential equation for Boltzmann's function is replaced by the corresponding discrete finite difference equation. The difference equation is, then, symmetrized so that the equation remains invariant when step d is replaced by -d. The solutions of this equation come in Boson-Fermion pairs. Reciprocal symmetric Boltzmann's function, thus, unifies both Bosonic and Fermionic distributions.
关于Boltzmann方程的空间均匀的ES模型%On the Spatially Homogeneous ES Model of the Boltzmann Equation
Institute of Scientific and Technical Information of China (English)
张显文; 胡适耕; 张诚坚
2006-01-01
We discuss the solution properties of the spatially homogeneous ellipsoidal statistical model (ES model) of the Boltzmann equation with Prandtl number Pr ∈ [2/3,∞). First, we establish the existence and uniqueness result. Second, the trend towards equilibrium and the Maxwellian lower bound estimates of the solution are established. Finally, we prove the entropy identity and obtain dissipation of the entropy of this equation.%在Prandtl数Pr∈[2/3,∞)的情况下,我们讨论了Boltzmann方程的空间均匀的椭圆统计模型.首先,我们建立了解的存在唯一性.其次,我们证明了该解收敛到平衡态并给出了其Maxwell分布型的下界估计.最后,我们给出了熵等式从而证明了该方程的熵是衰减的.
Energy Technology Data Exchange (ETDEWEB)
Kawakami, H.; Urabe, J.; Yukimura, K. (Doshisha Univ., Kyoto (Japan))
1991-03-20
In a discharge excitation rare gas halide excima laser, uniform generation and stable maintenance of the excited discharge determines the laser characteristics. In this report, an approximate solution was obtained on the Boltzmann equation (frequently used for the theoretical analysis of this laser) to examine the nature of the solution. By optimizing the conversion of the variables, calculation of an electron swarm parameter in the hitherto uncertain range of the low conversion electric field was made possible, giving a generation mechanism of the uncertainty of the excited dischareg. The results are summarized as below. (1) The Boltzmann equation gives a linear solution for a logarithmic value of an electron energy in the range of low conversion electric field. (2) Time-wise responce ability between the measured voltage, current characteristics of the excitation discharge was clarified and the attachment and ionization coefficients calculated by Boltzmann equation. (3) Dependency of the attachment coefficient on the partial pressure of fluorine and kripton was examined, and the attachment coefficient was found to increase with the increase of the partial pressure for the both cases. 20 refs., 9 figs., 2 tabs.
Institute of Scientific and Technical Information of China (English)
Deng Yun-Kun; Xiao Deng-Ming
2013-01-01
The electron swarm parameters including the density-normalized effective ionization coefficients (α-η)/N and the electron drift velocities Ve are calculated for a gas mixture of CF3I with N2 and CO2 by solving the Boltzmann equation in the condition of a steady-state Townsend (SST) experiment.The overall density-reduced electric field strength is from 100 Td to 1000 Td (1 Td =10-17 V·cm2),while the CF3I content k in the gas mixture can be varied over the range from 0％ to 100％.From the variation of (α-η)/N with the CF3I mixture ratio k,the limiting field strength (E/N)lim for each CF3I concentration is derived.It is found that for the mixtures with 70％ CF3I,the values of (E/N)lim are essentially the same as that for pure SF6.Additionally,the global warming potential (GWP) and the liquefaction temperature of the gas mixtures are also taken into account to evaluate the possibility of application in the gas insulation of power equipment.
Wang, Peng; Wang, Lian-Ping; Guo, Zhaoli
2016-10-01
The main objective of this work is to perform a detailed comparison of the lattice Boltzmann equation (LBE) and the recently developed discrete unified gas-kinetic scheme (DUGKS) methods for direct numerical simulation (DNS) of the decaying homogeneous isotropic turbulence and the Kida vortex flow in a periodic box. The flow fields and key statistical quantities computed by both methods are compared with those from the pseudospectral method at both low and moderate Reynolds numbers. The results show that the LBE is more accurate and efficient than the DUGKS, but the latter has a superior numerical stability, particularly for high Reynolds number flows. In addition, we conclude that the DUGKS can adequately resolve the flow when the minimum spatial resolution parameter kmaxη >3 , where kmax is the maximum resolved wave number and η is the flow Kolmogorov length. This resolution requirement can be contrasted with the requirements of kmaxη >1 for the pseudospectral method and kmaxη >2 for the LBE. It should be emphasized that although more validations should be conducted before the DUGKS can be called a viable tool for DNS of turbulent flows, the present work contributes to the overall assessment of the DUGKS, and it provides a basis for further applications of DUGKS in studying the physics of turbulent flows.
Wang, Peng; Wang, Lian-Ping; Guo, Zhaoli
2016-10-01
The main objective of this work is to perform a detailed comparison of the lattice Boltzmann equation (LBE) and the recently developed discrete unified gas-kinetic scheme (DUGKS) methods for direct numerical simulation (DNS) of the decaying homogeneous isotropic turbulence and the Kida vortex flow in a periodic box. The flow fields and key statistical quantities computed by both methods are compared with those from the pseudospectral method at both low and moderate Reynolds numbers. The results show that the LBE is more accurate and efficient than the DUGKS, but the latter has a superior numerical stability, particularly for high Reynolds number flows. In addition, we conclude that the DUGKS can adequately resolve the flow when the minimum spatial resolution parameter k_{max}η>3, where k_{max} is the maximum resolved wave number and η is the flow Kolmogorov length. This resolution requirement can be contrasted with the requirements of k_{max}η>1 for the pseudospectral method and k_{max}η>2 for the LBE. It should be emphasized that although more validations should be conducted before the DUGKS can be called a viable tool for DNS of turbulent flows, the present work contributes to the overall assessment of the DUGKS, and it provides a basis for further applications of DUGKS in studying the physics of turbulent flows.
The Einstein-Boltzmann system and positivity
Lee, Ho
2012-01-01
The Einstein-Boltzmann system is studied, with particular attention to the non-negativity of the solution of the Boltzmann equation. A new parametrization of post-collisional momenta in general relativity is introduced and then used to simplify the conditions on the collision cross-section given by Bancel and Choquet-Bruhat. The non-negativity of solutions of the Boltzmann equation on a given curved spacetime has been studied by Bichteler and by Tadmon. By examining to what extent the results of these authors apply in the framework of Bancel and Choquet-Bruhat, the non-negativity problem for the Einstein-Boltzmann system is resolved for a certain class of scattering kernels. It is emphasized that it is a challenge to extend the existing theory of the Cauchy problem for the Einstein-Boltzmann system so as to include scattering kernels which are physically well-motivated.
Energy Technology Data Exchange (ETDEWEB)
Uchida, S.; Sugawara, H.; Ventzek, P.; Sakai, Y. [Hokkaido University, Sapporo (Japan)
1998-06-01
Xe/Ne plasmas are important for plasma display panels and VUV light sources. However, reactions between electrons and excited particles in the mixtures are so complicated that influence of the reactions on the plasma properties is not understood well. In this work, taking account of reactions through which electrons are produced, such as cumulative and Penning ionization, and of transition between excited levels, the electron and excited particle properties in Xe/Ne plasmas are calculated using the Boltzmann equation. The ionization coefficient and electron drift velocity agreed with experimental data. The influence of laser absorption in Xe/Ne plasmas on the plasma properties is also discussed. 25 refs., 15 figs.
Lattice Boltzmann approach for complex nonequilibrium flows.
Montessori, A; Prestininzi, P; La Rocca, M; Succi, S
2015-10-01
We present a lattice Boltzmann realization of Grad's extended hydrodynamic approach to nonequilibrium flows. This is achieved by using higher-order isotropic lattices coupled with a higher-order regularization procedure. The method is assessed for flow across parallel plates and three-dimensional flows in porous media, showing excellent agreement of the mass flow with analytical and numerical solutions of the Boltzmann equation across the full range of Knudsen numbers, from the hydrodynamic regime to ballistic motion.
Schaap, M. G.
2013-12-01
This DOE-funded study is a collaboration between Oregon State University (led by Dr. Dorthe Wildenschild) and the University of Arizona to investigate pore-scale aspects of capillary trapping to enhance the efficiency of geological CO2 sequestration in deep saline aquifers where super-critical conditions prevail. Compared to most current reservoir-scale studies, our research takes several steps back in scale to observe and model trapping at the pore-scale using a combination of computed micro-tomography imaging (performed by OSU) and multi-phase/multi-component lattice Boltzmann (LB) simulations (carried out by UA). The main objective is to quantify how pore-scale mechanisms translate into continuum scale properties that can subsequently support improved modelling of sequestration at large spatio-temporal scales. For the purposes of this project it is important to correctly simulate the physical conditions under which super-critical CO2 will be present after injection into the host rock. In practice this means that the LB model should be able to handle the pressures (P), densities (ρ), temperatures (T) that prevail in deep geological media. A logical way of dealing with is is to combine a single-component LB model with and Equation of State (EOS) that describes the physical interrelations among P, ρ and T (Yuan and Scheafer, 2006). Previously, we showed that the Peng-Robinson (PR) EOS provides an excellent fit to super-critical conditions for the pure CO2 system. However, simulating pure-CO2 systems is not sufficient as the super-critical CO2 will co-exist (and interact) with brine present in the saline aquifers. In effect this means that we need to simulate multi-component systems: one phase being the super-critical CO2, the other phase being a brine of varying salinity. Previously, we have used used a Shan-Chen-type model (Shan Chen, 1993, 1994) as modified by Martys and Chen (1996) for simplified capillari pressure dominated air-water systems in porous media
Accurate deterministic solutions for the classic Boltzmann shock profile
Yue, Yubei
The Boltzmann equation or Boltzmann transport equation is a classical kinetic equation devised by Ludwig Boltzmann in 1872. It is regarded as a fundamental law in rarefied gas dynamics. Rather than using macroscopic quantities such as density, temperature, and pressure to describe the underlying physics, the Boltzmann equation uses a distribution function in phase space to describe the physical system, and all the macroscopic quantities are weighted averages of the distribution function. The information contained in the Boltzmann equation is surprisingly rich, and the Euler and Navier-Stokes equations of fluid dynamics can be derived from it using series expansions. Moreover, the Boltzmann equation can reach regimes far from the capabilities of fluid dynamical equations, such as the realm of rarefied gases---the topic of this thesis. Although the Boltzmann equation is very powerful, it is extremely difficult to solve in most situations. Thus the only hope is to solve it numerically. But soon one finds that even a numerical simulation of the equation is extremely difficult, due to both the complex and high-dimensional integral in the collision operator, and the hyperbolic phase-space advection terms. For this reason, until few years ago most numerical simulations had to rely on Monte Carlo techniques. In this thesis I will present a new and robust numerical scheme to compute direct deterministic solutions of the Boltzmann equation, and I will use it to explore some classical gas-dynamical problems. In particular, I will study in detail one of the most famous and intrinsically nonlinear problems in rarefied gas dynamics, namely the accurate determination of the Boltzmann shock profile for a gas of hard spheres.
Adaptive Lattice Boltzmann Model for Compressible Flows
Institute of Scientific and Technical Information of China (English)
无
2000-01-01
A new lattice Boltzmann model for compressible flows is presented. The main difference from the standard lattice Boltzmann model is that the particle velocities are no longer constant, but vary with the mean velocity and internal energy. The adaptive nature of the particle velocities permits the mean flow to have a high Mach number. The introduction of a particle potential energy makes the model suitable for a perfect gas with arbitrary specific heat ratio. The Navier-Stokes (N-S) equations are derived by the Chapman-Enskog method from the BGK Boltzmann equation. Two kinds of simulations have been carried out on the hexagonal lattice to test the proposed model. One is the Sod shock-tube simulation. The other is a strong shock of Mach number 5.09 diffracting around a corner.
Energy Technology Data Exchange (ETDEWEB)
Chatterjee, Kausik, E-mail: kausik.chatterjee@aggiemail.usu.edu [Strategic and Military Space Division, Space Dynamics Laboratory, North Logan, UT 84341 (United States); Center for Atmospheric and Space Sciences, Utah State University, Logan, UT 84322 (United States); Roadcap, John R., E-mail: john.roadcap@us.af.mil [Air Force Research Laboratory, Kirtland AFB, NM 87117 (United States); Singh, Surendra, E-mail: surendra-singh@utulsa.edu [Department of Electrical Engineering, The University of Tulsa, Tulsa, OK 74104 (United States)
2014-11-01
The objective of this paper is the exposition of a recently-developed, novel Green's function Monte Carlo (GFMC) algorithm for the solution of nonlinear partial differential equations and its application to the modeling of the plasma sheath region around a cylindrical conducting object, carrying a potential and moving at low speeds through an otherwise neutral medium. The plasma sheath is modeled in equilibrium through the GFMC solution of the nonlinear Poisson–Boltzmann (NPB) equation. The traditional Monte Carlo based approaches for the solution of nonlinear equations are iterative in nature, involving branching stochastic processes which are used to calculate linear functionals of the solution of nonlinear integral equations. Over the last several years, one of the authors of this paper, K. Chatterjee has been developing a philosophically-different approach, where the linearization of the equation of interest is not required and hence there is no need for iteration and the simulation of branching processes. Instead, an approximate expression for the Green's function is obtained using perturbation theory, which is used to formulate the random walk equations within the problem sub-domains where the random walker makes its walks. However, as a trade-off, the dimensions of these sub-domains have to be restricted by the limitations imposed by perturbation theory. The greatest advantage of this approach is the ease and simplicity of parallelization stemming from the lack of the need for iteration, as a result of which the parallelization procedure is identical to the parallelization procedure for the GFMC solution of a linear problem. The application area of interest is in the modeling of the communication breakdown problem during a space vehicle's re-entry into the atmosphere. However, additional application areas are being explored in the modeling of electromagnetic propagation through the atmosphere/ionosphere in UHF/GPS applications.
Boltzmann-Electron Model in Aleph.
Energy Technology Data Exchange (ETDEWEB)
Hughes, Thomas Patrick; Hooper, Russell
2014-11-01
We apply the Boltzmann-electron model in the electrostatic, particle-in-cell, finite- element code Aleph to a plasma sheath. By assuming a Boltzmann energy distribution for the electrons, the model eliminates the need to resolve the electron plasma fre- quency, and avoids the numerical "grid instability" that can cause unphysical heating of electrons. This allows much larger timesteps to be used than with kinetic electrons. Ions are treated with the standard PIC algorithm. The Boltzmann-electron model re- quires solution of a nonlinear Poisson equation, for which we use an iterative Newton solver (NOX) from the Trilinos Project. Results for the spatial variation of density and voltage in the plasma sheath agree well with an analytic model
Training Restricted Boltzmann Machines
DEFF Research Database (Denmark)
Fischer, Asja
Restricted Boltzmann machines (RBMs) are probabilistic graphical models that can also be interpreted as stochastic neural networks. Training RBMs is known to be challenging. Computing the likelihood of the model parameters or its gradient is in general computationally intensive. Thus, training...
Lindner, Manfred
2007-01-01
Boltzmann equations are often used to describe the non-equilibrium time-evolution of many-body systems in particle physics. Prominent examples are the computation of the baryon asymmetry of the universe and the evolution of the quark-gluon plasma after a relativistic heavy ion collision. However, Boltzmann equations are only a classical approximation of the quantum thermalization process, which is described by so-called Kadanoff-Baym equations. This raises the question how reliable Boltzmann equations are as approximations to the complete Kadanoff-Baym equations. Therefore, we present in this article a detailed comparison of Boltzmann and Kadanoff-Baym equations in the framework of a chirally invariant Yukawa-type quantum field theory including fermions and scalars. The obtained numerical results reveal significant differences between both types of equations. Apart from quantitative differences, on a qualitative level the late-time universality respected by Kadanoff-Baym equations is severely restricted in th...
Lattice Boltzmann Large Eddy Simulation Model of MHD
Flint, Christopher
2016-01-01
The work of Ansumali \\textit{et al.}\\cite{Ansumali} is extended to Two Dimensional Magnetohydrodynamic (MHD) turbulence in which energy is cascaded to small spatial scales and thus requires subgrid modeling. Applying large eddy simulation (LES) modeling of the macroscopic fluid equations results in the need to apply ad-hoc closure schemes. LES is applied to a suitable mesoscopic lattice Boltzmann representation from which one can recover the MHD equations in the long wavelength, long time scale Chapman-Enskog limit (i.e., the Knudsen limit). Thus on first performing filter width expansions on the lattice Boltzmann equations followed by the standard small Knudsen expansion on the filtered lattice Boltzmann system results in a closed set of MHD turbulence equations provided we enforce the physical constraint that the subgrid effects first enter the dynamics at the transport time scales. In particular, a multi-time relaxation collision operator is considered for the density distribution function and a single rel...
A Unified Theory of Non-Ideal Gas Lattice Boltzmann Models
Luo, Li-Shi
1998-01-01
A non-ideal gas lattice Boltzmann model is directly derived, in an a priori fashion, from the Enskog equation for dense gases. The model is rigorously obtained by a systematic procedure to discretize the Enskog equation (in the presence of an external force) in both phase space and time. The lattice Boltzmann model derived here is thermodynamically consistent and is free of the defects which exist in previous lattice Boltzmann models for non-ideal gases. The existing lattice Boltzmann models for non-ideal gases are analyzed and compared with the model derived here.
Explicit finite-difference lattice Boltzmann method for curvilinear coordinates.
Guo, Zhaoli; Zhao, T S
2003-06-01
In this paper a finite-difference-based lattice Boltzmann method for curvilinear coordinates is proposed in order to improve the computational efficiency and numerical stability of a recent method [R. Mei and W. Shyy, J. Comput. Phys. 143, 426 (1998)] in which the collision term of the Boltzmann Bhatnagar-Gross-Krook equation for discrete velocities is treated implicitly. In the present method, the implicitness of the numerical scheme is removed by introducing a distribution function different from that being used currently. As a result, an explicit finite-difference lattice Boltzmann method for curvilinear coordinates is obtained. The scheme is applied to a two-dimensional Poiseuille flow, an unsteady Couette flow, a lid-driven cavity flow, and a steady flow around a circular cylinder. The numerical results are in good agreement with the results of previous studies. Extensions to other lattice Boltzmann models based on nonuniform meshes are also discussed.
Directory of Open Access Journals (Sweden)
Xinzhi Liu
1998-01-01
Full Text Available This paper studies a class of high order delay partial differential equations. Employing high order delay differential inequalities, several oscillation criteria are established for such equations subject to two different boundary conditions. Two examples are also given.
Nonequilibrium phenomena in QCD and BEC. Boltzmann and beyond
Energy Technology Data Exchange (ETDEWEB)
Stockamp, T.
2006-12-22
In chapter 2 we chose the real time formalism to discuss some basic principles in quantum field theory at finite temperature. This enables us to derive the quantum Boltzmann equation from the Schwinger-Dyson series. We then shortly introduce the basic concepts of QCD which are needed to understand the physics of QGP formation. After a detailed account on the bottom-up scenario we show the consistency of this approach by a diagramatical analysis of the relevant Boltzmann collision integrals. Chapter 3 deals with BEC dynamics out of equilibrium. After an introduction to the fundamental theoretical tool - namely the Gross-Pitaevskii equation - we focus on a generalization to finite temperature developed by Zaremba, Nikuni and Griffin (ZNG). These authors use a Boltzmann equation to describe the interactions between condensed and excited atoms and manage in this way to describe condensate growth. We then turn to a discussion on the 2PI effective action and derive equations of motion for a relativistic scalar field theory. In the nonrelativistic limit these equations are shown to coincide with the ZNG theory when a quasiparticle approximation is applied. Finally, we perform a numerical analysis of the full 2PI equations. These remain valid even at strong coupling and far from equilibrium, and thus go far beyond Boltzmann's approach. For simplicity, we limit ourselves to a homogeneous system and present the first 3+1 dimensional study of condensate melting. (orig.)
Poisson-Boltzmann versus Size-Modified Poisson-Boltzmann Electrostatics Applied to Lipid Bilayers.
Wang, Nuo; Zhou, Shenggao; Kekenes-Huskey, Peter M; Li, Bo; McCammon, J Andrew
2014-12-26
Mean-field methods, such as the Poisson-Boltzmann equation (PBE), are often used to calculate the electrostatic properties of molecular systems. In the past two decades, an enhancement of the PBE, the size-modified Poisson-Boltzmann equation (SMPBE), has been reported. Here, the PBE and the SMPBE are reevaluated for realistic molecular systems, namely, lipid bilayers, under eight different sets of input parameters. The SMPBE appears to reproduce the molecular dynamics simulation results better than the PBE only under specific parameter sets, but in general, it performs no better than the Stern layer correction of the PBE. These results emphasize the need for careful discussions of the accuracy of mean-field calculations on realistic systems with respect to the choice of parameters and call for reconsideration of the cost-efficiency and the significance of the current SMPBE formulation.
Lattice Boltzmann Numerical Simulation of a Circular Cylinder
Institute of Scientific and Technical Information of China (English)
冯士德; 赵颖; 郜宪林; 季仲贞
2002-01-01
The lattice Boltzmann equation (LBE) model based on the Boltzmann equation is suitable for the numerical simulation of various flow fields. The fluid dynamics equation can be recovered from the LBE model. However,compared to the Navier-Stokes transport equation, the fluid dynamics equation derived from the LBE model is somewhat different in the viscosity transport term, which contains not only the Navier-Stokes transport equation but also nonsteady pressure and momentum flux terms. The two nonsteady terms can produce the same function as the random stirring force term introduced in the direct numerical or large-eddy vortex simulation of turbulence.Through computation of a circular cylinder, it is verified that the influence of the two nonsteady terms on flow field stability cannot be ignored, which is helpful for the study of turbulence.
Lattice Boltzmann method and its applications in engineering thermophysics
Institute of Scientific and Technical Information of China (English)
HE YaLing; LI Qing; WANG Yong; TANG GuiHua
2009-01-01
The lattice Boltzmann method (LBM),a mesoscopic method between the molecular dynamics method and the conventional numerical methods,has been developed into a very efficient numerical alternative in the past two decades.Unlike conventional numerical methods,the kinetic theory based LBM simulates fluid flows by tracking the evolution of the particle distribution function,and then accumulates the distribution to obtain macroscopic averaged properties.In this article we review some work on LBM applications in engineering thermophysics:(1) brief introduction to the development of the LBM; (2)fundamental theory of LBM including the Boltzmann equation,Maxwell distribution function,Boltzmann-BGK equation,and the lattice Boltzmann-BGK equation; (3) lattice Boltzmann models for compressible flows and non-equilibrium gas flows,bounce back-specular-reflection boundary scheme for microscale gaseous flows,the mass modified outlet boundary scheme for fully developed flows,and an implicit-explicit finite-difference-based LBM; and (4) applications of the LBM to oscillating flow,compressible flow,porous media flow,non-equilibrium flow,and gas resonant oscillating flow.
Learning thermodynamics with Boltzmann machines
Torlai, Giacomo; Melko, Roger G.
2016-10-01
A Boltzmann machine is a stochastic neural network that has been extensively used in the layers of deep architectures for modern machine learning applications. In this paper, we develop a Boltzmann machine that is capable of modeling thermodynamic observables for physical systems in thermal equilibrium. Through unsupervised learning, we train the Boltzmann machine on data sets constructed with spin configurations importance sampled from the partition function of an Ising Hamiltonian at different temperatures using Monte Carlo (MC) methods. The trained Boltzmann machine is then used to generate spin states, for which we compare thermodynamic observables to those computed by direct MC sampling. We demonstrate that the Boltzmann machine can faithfully reproduce the observables of the physical system. Further, we observe that the number of neurons required to obtain accurate results increases as the system is brought close to criticality.
Lattice Boltzmann Model for Compressible Fluid on a Square Lattice
Institute of Scientific and Technical Information of China (English)
SUN Cheng-Hai
2000-01-01
A two-level four-direction lattice Boltzmann model is formulated on a square lattice to simulate compressible flows with a high Mach number. The particle velocities are adaptive to the mean velocity and internal energy. Therefore, the mean flow can have a high Mach number. Due to the simple form of the equilibrium distribution, the 4th order velocity tensors are not involved in the calculations. Unlike the standard lattice Boltzmann model, o special treatment is need for the homogeneity of 4th order velocity tensors on square lattices. The Navier-Stokes equations were derived by the Chapman-Enskog method from the BGK Boltzmann equation. The model can be easily extended to three-dimensional cubic lattices. Two-dimensional shock-wave propagation was simulated
An integrable 3D lattice model with positive Boltzmann weights
Mangazeev, Vladimir V; Sergeev, Sergey M
2013-01-01
In this paper we construct a three-dimensional (3D) solvable lattice model with non-negative Boltzmann weights. The spin variables in the model are assigned to edges of the 3D cubic lattice and run over an infinite number of discrete states. The Boltzmann weights satisfy the tetrahedron equation, which is a 3D generalisation of the Yang-Baxter equation. The weights depend on a free parameter 0Boltzmann weights.
Lattice Boltzmann Model for Numerical Relativity
Ilseven, E
2015-01-01
In the Bona-Masso formulation, Einstein equations are written as a set of flux conservative first order hyperbolic equations that resemble fluid dynamics equations. Based on this formulation, we construct a lattice Boltzmann model for Numerical Relativity. Our model is validated with well-established tests, showing good agreement with analytical solutions. Furthermore, we show that by increasing the relaxation time, we gain stability at the cost of losing accuracy, and by decreasing the lattice spacings while keeping a constant numerical diffusivity, the accuracy and stability of our simulations improves. Finally, in order to show the potential of our approach a linear scaling law for parallelisation with respect to number of CPU cores is demonstrated. Our model represents the first step in using lattice kinetic theory to solve gravitational problems.
Lattice Boltzmann model for numerical relativity.
Ilseven, E; Mendoza, M
2016-02-01
In the Z4 formulation, Einstein equations are written as a set of flux conservative first-order hyperbolic equations that resemble fluid dynamics equations. Based on this formulation, we construct a lattice Boltzmann model for numerical relativity and validate it with well-established tests, also known as "apples with apples." Furthermore, we find that by increasing the relaxation time, we gain stability at the cost of losing accuracy, and by decreasing the lattice spacings while keeping a constant numerical diffusivity, the accuracy and stability of our simulations improve. Finally, in order to show the potential of our approach, a linear scaling law for parallelization with respect to number of CPU cores is demonstrated. Our model represents the first step in using lattice kinetic theory to solve gravitational problems.
EXTERNAL BODY FORCE IN FINITE DIFFERENCE LATTICE BOLTZMANN METHOD
Institute of Scientific and Technical Information of China (English)
CHEN Sheng; LIU Zhao-hui; SHI Bao-chang; ZHENG Chu-guang
2005-01-01
A new finite difference lattice Boltzmann scheme is developed. Because of analyzing the influence of external body force roundly, the correct Navier-Stokes equations with the external body force are recovered, without any additional unphysical terms. And some numerical results are presented. The result which close agreement with analytical data shows the good performance of the model.
Lattice Boltzmann model for nanofluids
Energy Technology Data Exchange (ETDEWEB)
Xuan Yimin; Yao Zhengping [Nanjing University of Science and Technology, School of Power Engineering, Nanjing (China)
2005-01-01
A nanofluid is a particle suspension that consists of base liquids and nanoparticles and has great potential for heat transfer enhancement. By accounting for the external and internal forces acting on the suspended nanoparticles and interactions among the nanoparticles and fluid particles, a lattice Boltzmann model is proposed for simulating flow and energy transport processes inside the nanofluids. First, we briefly introduce the conventional lattice Boltzmann model for multicomponent systems. Then, we discuss the irregular motion of the nanoparticles and inherent dynamic behavior of nanofluids and describe a lattice Boltzmann model for simulating nanofluids. Finally, we conduct some calculations for the distribution of the suspended nanoparticles. (orig.)
Hu, Kainan; Geng, Shaojuan
2016-01-01
A new lattice Boltzmann scheme associated with flexible specific heat ratio is proposed. The new free degree is introduced via the internal energy associated with the internal structure. The evolution equation of the distribution function is reduced to two evolution equations. One is connected to the density and velocity, the other is of the energy. A two-dimensional lattice Boltzmann model and a three-dimensional lattice Boltzmann model are derived via the Hermite expansion. The two lattice Boltzmann models are applied to simulating the shock tube of one dimension. Good agreement between the numerical results and the analytical solutions are obtained.
Contact line dynamics in binary lattice Boltzmann simulations
Pooley, C M; Yeomans, J M; 10.1103/PhysRevE.78.056709
2008-01-01
We show that, when a single relaxation time lattice Boltzmann algorithm is used to solve the hydrodynamic equations of a binary fluid for which the two components have different viscosities, strong spurious velocities in the steady state lead to incorrect results for the equilibrium contact angle. We identify the origins of these spurious currents, and demonstrate how the results can be greatly improved by using a lattice Boltzmann method based on a multiple-relaxation-time algorithm. By considering capillary filling we describe the dependence of the advancing contact angle on the interface velocity.
Directory of Open Access Journals (Sweden)
Thereza A. Soares
2004-08-01
Full Text Available The ability of biomolecules to catalyze chemical reactions is due chiefly to their sensitivity to variations of the pH in the surrounding environment. The reason for this is that they are made up of chemical groups whose ionization states are modulated by pH changes that are of the order of 0.4 units. The determination of the protonation states of such chemical groups as a function of conformation of the biomolecule and the pH of the environment can be useful in the elucidation of important biological processes from enzymatic catalysis to protein folding and molecular recognition. In the past 15 years, the theory of Poisson-Boltzmann has been successfully used to estimate the pKa of ionizable sites in proteins yielding results, which may differ by 0.1 unit from the experimental values. In this study, we review the theory of Poisson-Boltzmann under the perspective of its application to the calculation of pKa in proteins.
Lattice Boltzmann method for linear oscillatory noncontinuum flows
Shi, Yong; Yap, Ying Wan; Sader, John E.
2014-03-01
Oscillatory gas flows are commonly generated by micro- and nanoelectromechanical systems. Due to their small size and high operating frequencies, these devices often produce noncontinuum gas flows. Theoretical analysis of such flows requires solution of the unsteady Boltzmann equation, which can present a formidable challenge. In this article, we explore the applicability of the lattice Boltzmann (LB) method to such linear oscillatory noncontinuum flows; this method is derived from the linearized Boltzmann Bhatnagar-Gross-Krook (BGK) equation. We formulate four linearized LB models in the frequency domain, based on Gaussian-Hermite quadratures of different algebraic precision (AP). The performance of each model is assessed by comparison to high-accuracy numerical solutions to the linearized Boltzmann-BGK equation for oscillatory Couette flow. The numerical results demonstrate that high even-order LB models provide superior performance over the greatest noncontinuum range. Our results also highlight intrinsic deficiencies in the current LB framework, which is incapable of capturing noncontinuum behavior at high oscillation frequencies, regardless of quadrature AP and the Knudsen number.
Nauenberg, Michael
2005-03-01
In 1916 Einstein published a remarkable paper entitled ``On the Quantum Theory of Radiation''ootnotetextA. Einstein ``On the Quantum theory of Radiation,'' Phys. Zeitschrift 18 (1917) 121. First printed in Mitteilungender Physikalischen Gesellschaft Zurich. No 18, 1916. Translated into English in Van der Waerden ``Sources of Quantum Mechanics'' (North Holland 1967) pp. 63-77. in which he obtained Planck's formula for black-body radiation by introducing a new statistical hypothesis for the emmision and absorption of electromagneic radiation based on discrete bundles of energy and momentum which are now called photons. Einstein radiation theory replaced Maxwell's classical theory by a stochastic process which, when properly interpreted, also gives well known statistics of massless particles with even spin.^2 This quantum distribution, however, was not discovered by Einstein but was communicated to him by Bose in 1924. Like Boltzmann's classical counterpart, Einstein's statistical theory leads to an irreversible approach to thermal equilibrium, but because this violates time reversal, Einstein theory can not be regarded as a fundamental theory of physical process.ootnotetextM. Nauenberg ``The evolution of radiation towards thermal equilibrium: A soluble model which illustrates the foundations of statistical mechanics,'' American Journal of Physics 72 (2004) 313 Apparently Einstein and his contemporaries were unaware of this problem, and even today this problem is ignored in contemporary discussions of Einstein's treatment of the black-body spectrum.
Lattice Boltzmann modelling of intrinsic permeability
Li, Jun; Wu, Lei; Zhang, Yonghao
2016-01-01
Lattice Boltzmann method (LBM) has been applied to predict flow properties of porous media including intrinsic permeability, where it is implicitly assumed that the LBM is equivalent to the incompressible (or near incompressible) Navier-Stokes equation. However, in LBM simulations, high-order moments, which are completely neglected in the Navier-Stokes equation, are still available through particle distribution functions. To ensure that the LBM simulation is correctly working at the Navier-Stokes hydrodynamic level, the high-order moments have to be negligible. This requires that the Knudsen number (Kn) is small so that rarefaction effect can be ignored. In this technical note, we elaborate this issue in LBM modelling of porous media flows, which is particularly important for gas flows in ultra-tight media.
Nomura, Yasunori
2015-01-01
Understanding the observed arrow of time is equivalent, under general assumptions, to explaining why Boltzmann brains do not overwhelm ordinary observers. It is usually thought that this provides a condition on the decay rate of every cosmologically accessible de Sitter vacuum, and that this condition is determined by the production rate of Boltzmann brains calculated using semiclassical theory built on each such vacuum. We argue, based on a recently developed picture of microscopic quantum gravitational degrees of freedom, that this thinking needs to be modified. In particular, depending on the structure of the fundamental theory, the decay rate of a de Sitter vacuum may not have to satisfy any condition except possibly the one imposed by the Poincare recurrence. The framework discussed here also addresses the question of whether a Minkowski vacuum may produce Boltzmann brains.
Lattice-Boltzmann simulation of laser interaction with weakly ionized helium plasmas.
Li, Huayu; Ki, Hyungson
2010-07-01
This paper presents a lattice Boltzmann method for laser interaction with weakly ionized plasmas considering electron impact ionization and three-body recombination. To simulate with physical properties of plasmas, the authors' previous work on the rescaling of variables is employed and the electromagnetic fields are calculated from the Maxwell equations by using the finite-difference time-domain method. To calculate temperature fields, energy equations are derived separately from the Boltzmann equations. In this way, we attempt to solve the full governing equations for plasma dynamics. With the developed model, the continuous-wave CO2 laser interaction with helium is simulated successfully.
Lattice Boltzmann model for Coulomb-driven flows in dielectric liquids.
Luo, Kang; Wu, Jian; Yi, Hong-Liang; Tan, He-Ping
2016-02-01
In this paper, we developed a unified lattice Boltzmann model (LBM) to simulate electroconvection in a dielectric liquid induced by unipolar charge injection. Instead of solving the complex set of coupled Navier-Stokes equations, the charge conservation equation, and the Poisson equation of electric potential, three consistent lattice Boltzmann equations are formulated. Numerical results are presented for both strong and weak injection regimes, and different scenarios for the onset and evolution of instability, bifurcation, and chaos are tracked. All LBM results are found to be highly consistent with the analytical solutions and other numerical work.
Immiscible multicomponent lattice Boltzmann model for fluids with high relaxation time ratio
Indian Academy of Sciences (India)
Tao Jiang; Qiwei Gong; Ruofan Qiu; Anlin Wang
2014-10-01
An immiscible multicomponent lattice Boltzmann model is developed for fluids with high relaxation time ratios, which is based on the model proposed by Shan and Chen (SC). In the SC model, an interaction potential between particles is incorporated into the discrete lattice Boltzmann equation through the equilibrium velocity. Compared to the SC model, external forces in our model are discretized directly into the discrete lattice Boltzmann equation, as proposed by Guo et al. We develop it into a new multicomponent lattice Boltzmann (LB) model which has the ability to simulate immiscible multicomponent fluids with relaxation time ratio as large as 29.0 and to reduce `spurious velocity’. In this work, the improved model is validated and studied using the central bubble case and the rising bubble case. It finds good applications in both static and dynamic cases for multicomponent simulations with different relaxation time ratios.
A lattice Boltzmann model for adsorption breakthrough
Energy Technology Data Exchange (ETDEWEB)
Agarwal, Saurabh; Verma, Nishith [Indian Institute of Technology Kanpur, Department of Chemical Engineering, Kanpur (India); Mewes, Dieter [Universitat Hannover, Institut fur Verfahrenstechnik, Hannover (Germany)
2005-07-01
A lattice Boltzmann model is developed to simulate the one-dimensional (1D) unsteady state concentration profiles, including breakthrough curves, in a fixed tubular bed of non-porous adsorbent particles. The lattice model solves the 1D time dependent convection-diffusion-reaction equation for an ideal binary gaseous mixture, with solute concentrations at parts per million levels. The model developed in this study is also able to explain the experimental adsorption/desorption data of organic vapours (toluene) on silica gel under varying conditions of temperature, concentrations and flowrates. Additionally, the programming code written for simulating the adsorption breakthrough is modified with minimum changes to successfully simulate a few flow problems, such as Poiseuille flow, Couette flow, and axial dispersion in a tube. The present study provides an alternative numerical approach to solving such types of mass transfer related problems. (orig.)
Boltzmann transport calculation of collinear spin transport on short timescales
Nenno, Dennis M.; Kaltenborn, Steffen; Schneider, Hans Christian
2016-09-01
A spin-dependent Boltzmann transport equation is used to describe charge and spin dynamics resulting from the excitation of hot electrons in a ferromagnet/normal metal heterostructure. As the microscopic Boltzmann equation works with k -dependent distribution functions, it can describe far-from-equilibrium excitations, which are outside the scope of drift-diffusion theories. We study different scenarios for spin-dependent carrier injection into a nonmagnetic metal using an effectively two-dimensional phase space. While the charge signal is robust for various excitation schemes, the shape of the resulting spin current/density depends critically on the interplay between transport and scattering, and on the energetic distribution of the injected carriers. Our results imply that the energy dependence of the injected hot electrons has a decisive effect on the spin dynamics.
LATTICE-BOLTZMANN MODEL FOR COMPRESSIBLE PERFECT GASES
Institute of Scientific and Technical Information of China (English)
Sun Chenghai
2000-01-01
We present an adaptive lattice Boltzmann model to simulate super sonic flows. The particle velocities are determined by the mean velocity and internal energy. The adaptive nature of particle velocities permits the mean flow to have high Mach number. A particle potential energy is introduced so that the model is suitable for the perfect gas with arbitrary specific heat ratio. The Navier-Stokes equations are derived by the Chapman-Enskog method from the BGK Boltzmann equation.As preliminary tests, two kinds of simulations have been performed on hexagonal lattices. One is the one-dimensional simulation for sinusoidal velocity distributions.The velocity distributions are compared with the analytical solution and the mea sured viscosity is compared with the theoretical values. The agreements are basically good. However, the discretion error may cause some non-isotropic effects. The other simulation is the 29 degree shock reflection.
Lattice Boltzmann model for incompressible flows through porous media.
Guo, Zhaoli; Zhao, T S
2002-09-01
In this paper a lattice Boltzmann model is proposed for isothermal incompressible flow in porous media. The key point is to include the porosity into the equilibrium distribution, and add a force term to the evolution equation to account for the linear and nonlinear drag forces of the medium (the Darcy's term and the Forcheimer's term). Through the Chapman-Enskog procedure, the generalized Navier-Stokes equations for incompressible flow in porous media are derived from the present lattice Boltzmann model. The generalized two-dimensional Poiseuille flow, Couette flow, and lid-driven cavity flow are simulated using the present model. It is found the numerical results agree well with the analytical and/or the finite-difference solutions.
Boltzmann-Langevin one-body dynamics for fermionic systems
Directory of Open Access Journals (Sweden)
Napolitani P.
2012-07-01
Full Text Available A full implementation of the Boltzmann-Langevin equation for fermionic systems is introduced in a transport model for dissipative collisions among heavy nuclei. Fluctuations are injected in phase space and not, like in more conventional approaches, as a projection on suitable subspaces. The advantage of this model is to be specifically adapted to describe processes characterised by instabilities, like the formation of fragments from a hot nuclear system, and by dissipation, like the transparency in nucleus-nucleus collisions.
Topological Interactions in a Boltzmann-Type Framework
Blanchet, Adrien; Degond, Pierre
2016-04-01
We consider a finite number of particles characterised by their positions and velocities. At random times a randomly chosen particle, the follower, adopts the velocity of another particle, the leader. The follower chooses its leader according to the proximity rank of the latter with respect to the former. We study the limit of a system size going to infinity and, under the assumption of propagation of chaos, show that the limit equation is akin to the Boltzmann equation. However, it exhibits a spatial non-locality instead of the classical non-locality in velocity space. This result relies on the approximation properties of Bernstein polynomials. We illustrate the dynamics with numerical simulations.
Diffusive limit for a quantum linear Boltzmann dynamics
Clark, Jeremy
2010-01-01
We study the diffusive behavior for a quantum test particle interacting with a dilute background gas. The model we begin with is a reduced picture for the test particle dynamics given by a quantum linear Boltzmann equation in which the scattering with the gas particles is assumed to occur through a hard-sphere interaction. The state of the particle is represented by a density matrix evolving according to a translation-covariant Lindblad equation. Our main result is a proof that the particle diffuses for large times.
Student understanding of the Boltzmann factor
Smith, Trevor I; Thompson, John R
2015-01-01
We present results of our investigation into student understanding of the physical significance and utility of the Boltzmann factor in several simple models. We identify various justifications, both correct and incorrect, that students use when answering written questions that require application of the Boltzmann factor. Results from written data as well as teaching interviews suggest that many students can neither recognize situations in which the Boltzmann factor is applicable, nor articulate the physical significance of the Boltzmann factor as an expression for multiplicity, a fundamental quantity of statistical mechanics. The specific student difficulties seen in the written data led us to develop a guided-inquiry tutorial activity, centered around the derivation of the Boltzmann factor, for use in undergraduate statistical mechanics courses. We report on the development process of our tutorial, including data from teaching interviews and classroom observations on student discussions about the Boltzmann f...
Are there Boltzmann brains in the vacuum
Davenport, Matthew
2010-01-01
"Boltzmann brains" are human brains that arise as thermal or quantum fluctuations and last at least long enough to think a few thoughts. In many scenarios involving universes of infinite size or duration, Boltzmann brains are infinitely more common than human beings who arise in the ordinary way. Thus we should expect to be Boltzmann brains, in contradiction to observation. We discuss here the question of whether Boltzmann brains can arise as quantum fluctuations in the vacuum. Such Boltzmann brains pose an even worse problem than those arising as fluctuations in the thermal state of an exponentially expanding universe. We give several arguments for and against inclusion of vacuum Boltzmann brains in the anthropic reference class, but find neither choice entirely satisfactory.
Directory of Open Access Journals (Sweden)
K. Banoo
1998-01-01
equation in the discrete momentum space. This is shown to be similar to the conventional drift-diffusion equation except that it is a more rigorous solution to the Boltzmann equation because the current and carrier densities are resolved into M×1 vectors, where M is the number of modes in the discrete momentum space. The mobility and diffusion coefficient become M×M matrices which connect the M momentum space modes. This approach is demonstrated by simulating electron transport in bulk silicon.
Lattice Boltzmann method with the cell-population equilibrium
Institute of Scientific and Technical Information of China (English)
Zhou Xiao-Yang; Cheng Bing; Shi Bao-Chang
2008-01-01
The central problem of the lattice Boltzmann method (LBM) is to construct a discrete equilibrium.In this paper,a multi-speed 1D cell-model of Boltzmann equation is proposed,in which the cell-population equilibrium,a direct nonnegative approximation to the continuous Maxwellian distribution,plays an important part.By applying the explicit one-order Chapman-Enskog distribution,the model reduces the transportation and collision,two basic evolution steps in LBM,to the transportation of the non-equilibrium distribution.Furthermore,1D dam-break problem is performed and the numerical results agree well with the analytic solutions.
Viscous QCD matter in a hybrid hydrodynamic+Boltzmann approach
Song, Huichao; Heinz, Ulrich W
2010-01-01
A hybrid transport approach for the bulk evolution of viscous QCD matter produced in ultra-relativistic heavy-ion collisions is presented. The expansion of the dense deconfined phase of the reaction is modeled with viscous hydrodynamics while the dilute late hadron gas stage is described microscopically by the Boltzmann equation. The advantages of such a hybrid approach lie in the improved capability of handling large dissipative corrections in the late dilute phase of the reaction, including a realistic treatment of the non-equilibrium hadronic chemistry and kinetic freeze-out. By varying the switching temperature at which the hydrodynamic output is converted to particles for further propagation with the Boltzmann cascade we test the ability of the macroscopic hydrodynamic approach to emulate the microscopic evolution during the hadronic stage and extract the temperature dependence of the effective shear viscosity of the hadron resonance gas produced in the collision. We find that the extracted values depend...
Quadrature-based Lattice Boltzmann Model for Relativistic Flows
Blaga, Robert
2016-01-01
A quadrature-based finite-difference lattice Boltzmann model is developed that is suitable for simulating relativistic flows of massless particles. We briefly review the relativistc Boltzmann equation and present our model. The quadrature is constructed such that the stress-energy tensor is obtained as a second order moment of the distribution function. The results obtained with our model are presented for a particular instance of the Riemann problem (the Sod shock tube). We show that the model is able to accurately capture the behavior across the whole domain of relaxation times, from the hydrodynamic to the ballistic regime. The property of the model of being extendable to arbitrarily high orders is shown to be paramount for the recovery of the analytical result in the ballistic regime.
STUDY ON GAS KINETIC NUMERICAL ALGORITHM USING BOLTZMANN MODEL EQUATION%基于Boltzmann模型方程的气体运动论统一算法研究
Institute of Scientific and Technical Information of China (English)
李志辉; 张涵信
2005-01-01
从Boltzmann-Shakhov模型方程出发,研究确立含流态控制参数可描述不同流域气体流动特征的气体分子速度分布函数方程;研究发展气体运动论离散速度坐标法,借助非定常时间分裂数值计算方法和NND差分格式,结合DSMC方法关于分子运动与碰撞去耦技术,发展直接求解速度分布函数的气体运动论耦合迭代数值格式;研制可用于物理空间各点宏观流动取矩的离散速度数值积分方法,由此提出一套能有效模拟稀薄流到连续流不同流域气体流动问题统一算法.通过对不同Knudsen数下一维激波内流动、二维圆柱、三维球体绕流数值计算表明,计算结果与有关实验数据及其它途径研究结果(如DSMC模拟值、N-S数值解)吻合较好,证实气体运动论统一算法求解各流域气体流动问题的可行性.尝试将统一算法进行HPF并行化程序设计,基于对球体绕流及类"神舟"返回舱外形绕流问题进行HPF初步并行试算,显示出统一算法具有很好的并行可扩展性,可望建立起新型的能有效模拟各流域飞行器绕流HPF并行算法研究方向.通过将气体运动论统一算法推广应用于微槽道流动计算研究,已初步发展起可靠模拟二维短微槽道流动数值算法;通过对Couette流、Poiseuille流、压力驱动的二维短槽道流数值模拟,证实该算法对微槽道气体流动问题具有较强的模拟能力,可望发展起基于Boltzmann模型方程能可靠模拟MEMS微流动问题气体运动论数值计算方法研究途径.
Lattice-Boltzmann-based two-phase thermal model for simulating phase change
Kamali, M.R.; Gillissen, J.J.J.; Van den Akker, H.E.A.; Sundaresan, S.
2013-01-01
A lattice Boltzmann (LB) method is presented for solving the energy conservation equation in two phases when the phase change effects are included in the model. This approach employs multiple distribution functions, one for a pseudotemperature scalar variable and the rest for the various species. A nonideal equation of state (EOS) is introduced by using a pseudopotential LB model. The evolution equation for the pseudotemperature variable is constructed in such a manner that in the continuum l...
SIMPLE LATTICE BOLTZMANN MODEL FOR TRAFFIC FLOWS
Institute of Scientific and Technical Information of China (English)
Yan Guangwu; Hu Shouxin
2000-01-01
A lattice Boltzmann model with 5-bit lattice for traffic flows is proposed.Using the Chapman-Enskog expansion and multi-scale technique,we obtain the higher-order moments of equilibrium distribution function.A simple traffic light problem is simulated by using the present lattice Boltzmann model,and the result agrees well with analytical solution.
High-order hydrodynamics via lattice Boltzmann methods.
Colosqui, Carlos E
2010-02-01
In this work, closure of the Boltzmann-Bhatnagar-Gross-Krook (Boltzmann-BGK) moment hierarchy is accomplished via projection of the distribution function f onto a space H(N) spanned by N-order Hermite polynomials. While successive order approximations retain an increasing number of leading-order moments of f , the presented procedure produces a hierarchy of (single) N-order partial-differential equations providing exact analytical description of the hydrodynamics rendered by ( N-order) lattice Boltzmann-BGK (LBBGK) simulation. Numerical analysis is performed with LBBGK models and direct simulation Monte Carlo for the case of a sinusoidal shear wave (Kolmogorov flow) in a wide range of Weissenberg number Wi=taunuk(2) (i.e., Knudsen number Kn=lambdak=square root Wi); k is the wave number, [corrected] tau is the relaxation time of the system, and lambda approximately tauc(s) is the mean-free path, where c(s) is the speed of sound. The present results elucidate the applicability of LBBGK simulation under general nonequilibrium conditions.
DEFF Research Database (Denmark)
Svec, Oldrich; Skoček, Jan
2013-01-01
The ability of the Lattice Boltzmann method, as the fluid dynamics solver, to properly simulate macroscopic Navier’s slip boundary condition is investigated. An approximate equation relating the Lattice Boltzmann variable slip boundary condition with the macroscopic Navier’s slip boundary conditi...... is proposed. The proposed relation is validated both for the case of Newtonian and non-Newtonian fluids. The importance of employing the Navier’s slip boundary condition is highlighted by a practical industrial problem.......The ability of the Lattice Boltzmann method, as the fluid dynamics solver, to properly simulate macroscopic Navier’s slip boundary condition is investigated. An approximate equation relating the Lattice Boltzmann variable slip boundary condition with the macroscopic Navier’s slip boundary condition...
Filter-matrix lattice Boltzmann model for microchannel gas flows.
Zhuo, Congshan; Zhong, Chengwen
2013-11-01
The lattice Boltzmann method has been shown to be successful for microscale gas flows, and it has attracted significant research interest. In this paper, the recently proposed filter-matrix lattice Boltzmann (FMLB) model is first applied to study the microchannel gas flows, in which a Bosanquet-type effective viscosity is used to capture the flow behaviors in the transition regime. A kinetic boundary condition, the combined bounce-back and specular-reflection scheme with the second-order slip scheme, is also designed for the FMLB model. By analyzing a unidirectional flow, the slip velocity and the discrete effects related to the boundary condition are derived within the FMLB model, and a revised scheme is presented to overcome such effects, which have also been validated through numerical simulations. To gain an accurate simulation in a wide range of Knudsen numbers, covering the slip and the entire transition flow regimes, a set of slip coefficients with an introduced fitting function is adopted in the revised second-order slip boundary condition. The periodic and pressure-driven microchannel flows have been investigated by the present model in this study. The numerical results, including the velocity profile and the mass flow rate, as well as the nonlinear pressure distribution along the channel, agree fairly well with the solutions of the linearized Boltzmann equation, the direct simulation Monte Carlo results, the experimental data, and the previous results of the multiple effective relaxation lattice Boltzmann model. Also, the present results of the velocity profile and the mass flow rate show that the present model with the fitting function can yield improved predictions for the microchannel gas flow with higher Knudsen numbers in the transition flow regime.
Bohinc, Klemen; Shrestha, Ahis; Brumen, Milan; May, Sylvio
2012-03-01
In the classical mean-field description of the electric double layer, known as the Poisson-Boltzmann model, ions interact exclusively through their Coulomb potential. Ion specificity can arise through solvent-mediated, nonelectrostatic interactions between ions. We employ the Yukawa pair potential to model the presence of nonelectrostatic interactions. The combination of Yukawa and Coulomb potential on the mean-field level leads to the Poisson-Helmholtz-Boltzmann model, which employs two auxiliary potentials: one electrostatic and the other nonelectrostatic. In the present work we apply the Poisson-Helmholtz-Boltzmann model to ionic mixtures, consisting of monovalent cations and anions that exhibit different Yukawa interaction strengths. As a specific example we consider a single charged surface in contact with a symmetric monovalent electrolyte. From the minimization of the mean-field free energy we derive the Poisson-Boltzmann and Helmholtz-Boltzmann equations. These nonlinear equations can be solved analytically in the weak perturbation limit. This together with numerical solutions in the nonlinear regime suggests an intricate interplay between electrostatic and nonelectrostatic interactions. The structure and free energy of the electric double layer depends sensitively on the Yukawa interaction strengths between the different ion types and on the nonelectrostatic interactions of the mobile ions with the surface.
Least-squares finite-element lattice Boltzmann method.
Li, Yusong; LeBoeuf, Eugene J; Basu, P K
2004-06-01
A new numerical model of the lattice Boltzmann method utilizing least-squares finite element in space and Crank-Nicolson method in time is presented. The new method is able to solve problem domains that contain complex or irregular geometric boundaries by using finite-element method's geometric flexibility and numerical stability, while employing efficient and accurate least-squares optimization. For the pure advection equation on a uniform mesh, the proposed method provides for fourth-order accuracy in space and second-order accuracy in time, with unconditional stability in the time domain. Accurate numerical results are presented through two-dimensional incompressible Poiseuille flow and Couette flow.
Static contact angle in lattice Boltzmann models of immiscible fluids.
Latva-Kokko, M; Rothman, Daniel H
2005-10-01
We study numerically the capillary rise between two horizontal plates and in a rectangular tube, using a lattice Boltzmann (LB) method. We derive an equation for the static fluid-solid contact angle as a function of the wetting tendency of the walls and test its validity. We show that the generalized Laplace law with two independent radii of curvature is followed in capillary rise in rectangular tubes. Our method removes the history dependence of the fluid-solid contact angle that had been present in earlier LB schemes.
A lattice Boltzmann method for dilute polymer solutions.
Singh, Shiwani; Subramanian, Ganesh; Ansumali, Santosh
2011-06-13
We present a lattice Boltzmann approach for the simulation of non-Newtonian fluids. The method is illustrated for the specific case of dilute polymer solutions. With the appropriate local equilibrium distribution, phase-space dynamics on a lattice, driven by a Bhatnagar-Gross-Krook (BGK) relaxation term, leads to a solution of the Fokker-Planck equation governing the probability density of polymer configurations. Results for the bulk rheological characteristics for steady and start-up shear flow are presented, and compare favourably with those obtained using Brownian dynamics simulations. The new method is less expensive than stochastic simulation techniques, particularly in the range of small to moderate Weissenberg numbers (Wi).
On space enrichment estimator for nonlinear Poisson-Boltzmann
Randrianarivony, Maharavo
2013-10-01
We consider the mathematical aspect of the nonlinear Poisson-Boltzmann equation which physically governs the ionic interaction between solute and solvent media. The presented a-posteriori estimates can be computed locally in a very efficient manner. The a-posteriori error is based upon hierarchical space enrichment which ensures its efficiency and reliability. A brief survey of the solving of the nonlinear system resulting from the FEM discretization is reported. To corroborate the analysis, we report on a few numerical results for illustrations. We numerically examine some values of the constants encountered in the theoretical study.
Thermal cascaded lattice Boltzmann method
Fei, Linlin
2016-01-01
In this paper, a thermal cascaded lattice Boltzmann method (TCLBM) is developed in combination with the double-distribution-function (DDF) approach. A density distribution function relaxed by the cascaded scheme is employed to solve the flow field, and a total energy distribution function relaxed by the BGK scheme is used to solve temperature field, where two distribution functions are coupled naturally. The forcing terms are incorporated by means of central moments, which is consistent with the previous force scheme [Premnath \\emph{et al.}, Phys. Rev. E \\textbf{80}, 036702 (2009)] but the derivation is more intelligible and the evolution process is simpler. In the method, the viscous heat dissipation and compression work are taken into account, the Prandtl number and specific-heat ratio are adjustable, the external force is considered directly without the Boussinesq assumption, and the low-Mach number compressible flows can also be simulated. The forcing scheme is tested by simulating a steady Taylor-Green f...
An Infinite Restricted Boltzmann Machine.
Côté, Marc-Alexandre; Larochelle, Hugo
2016-07-01
We present a mathematical construction for the restricted Boltzmann machine (RBM) that does not require specifying the number of hidden units. In fact, the hidden layer size is adaptive and can grow during training. This is obtained by first extending the RBM to be sensitive to the ordering of its hidden units. Then, with a carefully chosen definition of the energy function, we show that the limit of infinitely many hidden units is well defined. As with RBM, approximate maximum likelihood training can be performed, resulting in an algorithm that naturally and adaptively adds trained hidden units during learning. We empirically study the behavior of this infinite RBM, showing that its performance is competitive to that of the RBM, while not requiring the tuning of a hidden layer size.
Moving Charged Particles in Lattice Boltzmann-Based Electrokinetics
Kuron, Michael; Schornbaum, Florian; Bauer, Martin; Godenschwager, Christian; Holm, Christian; de Graaf, Joost
2016-01-01
The motion of ionic solutes and charged particles under the influence of an electric field and the ensuing hydrodynamic flow of the underlying solvent is ubiquitous in aqueous colloidal suspensions. The physics of such systems is described by a coupled set of differential equations, along with boundary conditions, collectively referred to as the electrokinetic equations. Capuani et al. [J. Chem. Phys. 121, 973 (2004)] introduced a lattice-based method for solving this system of equations, which builds upon the lattice Boltzmann (LB) algorithm for the simulation of hydrodynamic flow and exploits computational locality. However, thus far, a description of how to incorporate moving boundary conditions, which are needed to simulate moving colloids, into the Capuani scheme has been lacking. In this paper, we detail how to introduce such moving boundaries, based on an analogue to the moving boundary method for the pure LB solver. The key ingredients in our method are mass and charge conservation for the solute spec...
Reprint of : The Boltzmann--Langevin approach: A simple quantum-mechanical derivation
Nagaev, K. E.
2016-08-01
We present a simple quantum-mechanical derivation of correlation function of Langevin sources in the semiclassical Boltzmann-Langevin equation. The specific case of electron-phonon scattering is considered. It is shown that the assumption of weak scattering leads to the Poisson nature of the scattering fluxes.
Lattice-Boltzmann-based two-phase thermal model for simulating phase change
Kamali, M.R.; Gillissen, J.J.J.; Van den Akker, H.E.A.; Sundaresan, S.
2013-01-01
A lattice Boltzmann (LB) method is presented for solving the energy conservation equation in two phases when the phase change effects are included in the model. This approach employs multiple distribution functions, one for a pseudotemperature scalar variable and the rest for the various species. A
A Nonlinera Krylov Accelerator for the Boltzmann k-Eigenvalue Problem
Calef, Matthew T; Warsa, James S; Berndt, Markus; Carlson, Neil N
2011-01-01
We compare variants of Anderson Mixing with the Jacobian-Free Newton-Krylov and Broyden methods applied to the k-eigenvalue formulation of the linear Boltzmann transport equation. We present evidence that one variant of Anderson Mixing finds solutions in the fewest number of iterations. We examine and strengthen theoretical results of Anderson Mixing applied to linear problems.
Multiphase lattice Boltzmann methods theory and application
Huang, Haibo; Lu, Xiyun
2015-01-01
Theory and Application of Multiphase Lattice Boltzmann Methods presents a comprehensive review of all popular multiphase Lattice Boltzmann Methods developed thus far and is aimed at researchers and practitioners within relevant Earth Science disciplines as well as Petroleum, Chemical, Mechanical and Geological Engineering. Clearly structured throughout, this book will be an invaluable reference on the current state of all popular multiphase Lattice Boltzmann Methods (LBMs). The advantages and disadvantages of each model are presented in an accessible manner to enable the reader to choose the
Ion-Conserving Modified Poisson-Boltzmann Theory Considering a Steric Effect in an Electrolyte
Sugioka, Hideyuki
2016-12-01
The modified Poisson-Nernst-Planck (MPNP) and modified Poisson-Boltzmann (MPB) equations are well known as fundamental equations that consider a steric effect, which prevents unphysical ion concentrations. However, it is unclear whether they are equivalent or not. To clarify this problem, we propose an improved free energy formulation that considers a steric limit with an ion-conserving condition and successfully derive the ion-conserving modified Poisson-Boltzmann (IC-MPB) equations that are equivalent to the MPNP equations. Furthermore, we numerically examine the equivalence by comparing between the IC-MPB solutions obtained by the Newton method and the steady MPNP solutions obtained by the finite-element finite-volume method. A surprising aspect of our finding is that the MPB solutions are much different from the MPNP (IC-MPB) solutions in a confined space. We consider that our findings will significantly contribute to understanding the surface science between solids and liquids.
Held, M
2015-01-01
A lattice Boltzmann method (LBM) approach to the Charney-Hasegawa-Mima (CHM) model for adiabatic drift wave turbulence in magnetised plasmas, is implemented. The CHM-LBM model contains a barotropic equation of state for the potential, a force term including a cross-product analogous to the Coriolis force in quasigeostrophic models, and a density gradient source term. Expansion of the resulting lattice Boltzmann model equations leads to cold-ion fluid continuity and momentum equations, which resemble CHM dynamics under drift ordering. The resulting numerical solutions of standard test cases (monopole propagation, stable drift modes and decaying turbulence) are compared to results obtained by a conventional finite difference scheme that directly discretizes the CHM equation. The LB scheme resembles characteristic CHM dynamics apart from an additional shear in the density gradient direction. The occuring shear reduces with the drift ratio and is ascribed to the compressible limit of the underlying LBM.
Institute of Scientific and Technical Information of China (English)
蔡新景; 王新新; 邹晓兵; 鲁志伟
2016-01-01
The propagation properties of streamer could be obtained accurately by using the fluid model to simulate, provided that precise electron transport and reaction coefficients were input the model. Presently, there were two methods to calculate the transport coefficients: interpolation method based on the data of swarm experiment or two-term approximation of the Boltzmann equation. It was showed that interpolation method could be merely used in low reduced electric condition, and for the second method the reasonableness of the isotropic assumption and the accuracy of the results were a question. In view of the above problems, multi-term approximation of the Boltzmann equation to obtain electron transport coefficients was proposed by Nesset al. Here two improvements are provided: firstly, the expansion sequence is adjusted to derive the unified hierarchy in the hydrodynamic and non-hydrodynamic limit; secondly, the collision integral is evaluated based on the Gauss-Kronrod rule instead of Gauss-Laguerre rule as used in Ness''s works. In the end hard sphere model and Reid''s ramp inelastic model are considered. It is shown that it is more accurate to evaluate the collision integral based on Gauss-Kronrod integration method than Gauss-Laguerre method. Furthermore, it is demonstrated that the electron velocity distribution is anisotropic even only undergoing conservative collision, so there is a great error if the two -term approximation is used to obtain the electron transport coefficients.%获得准确的电子输运和反应系数是采用流体模型准确仿真流注传播特性的前提.目前,电子输运系数主要有两种计算方法:一是用电子群实验数据进行插值;二是用两项近似方法解玻尔兹曼方程.方法一只能用在约化场强很小的场合,方法二的理论基础即各相同性假设是否成立和数据准确度尚无定论.针对以上问题,Ness 等人采用了多项近似法解玻尔兹曼方程计算电子输运系数.该
Boltzmann and the art of flying
Dahmen, Silvio R
2007-01-01
One of the less known facets of Ludwig Boltzmann was that of an advocate of Aviation, one of the most challenging technological problems of his times. Boltzmann followed closely the studies of pioneers like Otto Lilienthal in Berlin, and during a lecture on a prestigious conference he vehemently defended further investments in the area. In this article I discuss his involvement with Aviation, his role in its development and his correspondence with two flight pioneers, Otto Lilienthal e Wilhelm Kress.
Student understanding of the Boltzmann factor
Smith, Trevor I.; Mountcastle, Donald B.; Thompson, John R.
2015-12-01
[This paper is part of the Focused Collection on Upper Division Physics Courses.] We present results of our investigation into student understanding of the physical significance and utility of the Boltzmann factor in several simple models. We identify various justifications, both correct and incorrect, that students use when answering written questions that require application of the Boltzmann factor. Results from written data as well as teaching interviews suggest that many students can neither recognize situations in which the Boltzmann factor is applicable nor articulate the physical significance of the Boltzmann factor as an expression for multiplicity, a fundamental quantity of statistical mechanics. The specific student difficulties seen in the written data led us to develop a guided-inquiry tutorial activity, centered around the derivation of the Boltzmann factor, for use in undergraduate statistical mechanics courses. We report on the development process of our tutorial, including data from teaching interviews and classroom observations of student discussions about the Boltzmann factor and its derivation during the tutorial development process. This additional information informed modifications that improved students' abilities to complete the tutorial during the allowed class time without sacrificing the effectiveness as we have measured it. These data also show an increase in students' appreciation of the origin and significance of the Boltzmann factor during the student discussions. Our findings provide evidence that working in groups to better understand the physical origins of the canonical probability distribution helps students gain a better understanding of when the Boltzmann factor is applicable and how to use it appropriately in answering relevant questions.
Matrix-valued Quantum Lattice Boltzmann Method
Mendl, Christian B
2013-01-01
We develop a numerical framework for the quantum analogue of the "classical" lattice Boltzmann method (LBM), with the Maxwell-Boltzmann distribution replaced by the Fermi-Dirac function. To accommodate the spin density matrix, the distribution functions become 2x2-matrix valued. We show that the efficient, commonly used BGK approximation of the collision operator is valid in the present setting. The framework could leverage the principles of LBM for simulating complex spin systems, with applications to spintronics.
Three-dimensional lattice Boltzmann model for electrodynamics.
Mendoza, M; Muñoz, J D
2010-11-01
In this paper we introduce a three-dimensional Lattice-Boltzmann model that recovers in the continuous limit the Maxwell equations in materials. In order to build conservation equations with antisymmetric tensors, like the Faraday law, the model assigns four auxiliary vectors to each velocity vector. These auxiliary vectors, when combined with the distribution functions, give the electromagnetic fields. The evolution is driven by the usual Bhatnager-Gross-Krook (BGK) collision rule, but with a different form for the equilibrium distribution functions. This lattice Bhatnager-Gross-Krook (LBGK) model allows us to consider for both dielectrics and conductors with realistic parameters, and therefore it is adequate to simulate the most diverse electromagnetic problems, like the propagation of electromagnetic waves (both in dielectric media and in waveguides), the skin effect, the radiation pattern of a small dipole antenna and the natural frequencies of a resonant cavity, all with 2% accuracy. Actually, it shows to be one order of magnitude faster than the original Finite-difference time-domain (FDTD) formulation by Yee to reach the same accuracy. It is, therefore, a valuable alternative to simulate electromagnetic fields and opens lattice Boltzmann for a broad spectrum of new applications in electrodynamics.
Lattice Boltzmann methods for global linear instability analysis
Pérez, José Miguel; Aguilar, Alfonso; Theofilis, Vassilis
2016-11-01
Modal global linear instability analysis is performed using, for the first time ever, the lattice Boltzmann method (LBM) to analyze incompressible flows with two and three inhomogeneous spatial directions. Four linearization models have been implemented in order to recover the linearized Navier-Stokes equations in the incompressible limit. Two of those models employ the single relaxation time and have been proposed previously in the literature as linearization of the collision operator of the lattice Boltzmann equation. Two additional models are derived herein for the first time by linearizing the local equilibrium probability distribution function. Instability analysis results are obtained in three benchmark problems, two in closed geometries and one in open flow, namely the square and cubic lid-driven cavity flow and flow in the wake of the circular cylinder. Comparisons with results delivered by classic spectral element methods verify the accuracy of the proposed new methodologies and point potential limitations particular to the LBM approach. The known issue of appearance of numerical instabilities when the SRT model is used in direct numerical simulations employing the LBM is shown to be reflected in a spurious global eigenmode when the SRT model is used in the instability analysis. Although this mode is absent in the multiple relaxation times model, other spurious instabilities can also arise and are documented herein. Areas of potential improvements in order to make the proposed methodology competitive with established approaches for global instability analysis are discussed.
Linearized lattice Boltzmann method for micro- and nanoscale flow and heat transfer.
Shi, Yong; Yap, Ying Wan; Sader, John E
2015-07-01
Ability to characterize the heat transfer in flowing gases is important for a wide range of applications involving micro- and nanoscale devices. Gas flows away from the continuum limit can be captured using the Boltzmann equation, whose analytical solution poses a formidable challenge. An efficient and accurate numerical simulation of the Boltzmann equation is thus highly desirable. In this article, the linearized Boltzmann Bhatnagar-Gross-Krook equation is used to develop a hierarchy of thermal lattice Boltzmann (LB) models based on half-space Gaussian-Hermite (GH) quadrature ranging from low to high algebraic precision, using double distribution functions. Simplified versions of the LB models in the continuum limit are also derived, and are shown to be consistent with existing thermal LB models for noncontinuum heat transfer reported in the literature. Accuracy of the proposed LB hierarchy is assessed by simulating thermal Couette flows for a wide range of Knudsen numbers. Effects of the underlying quadrature schemes (half-space GH vs full-space GH) and continuum-limit simplifications on computational accuracy are also elaborated. The numerical findings in this article provide direct evidence of improved computational capability of the proposed LB models for modeling noncontinuum flows and heat transfer at small length scales.
Comment on ‘A low-uncertainty measurement of the Boltzmann constant’
Macnaughton, Donald B.
2016-02-01
The International Committee for Weights and Measures has projected a major revision of the International System of Units in which all the base units will be defined by fixing the values of certain fundamental constants of nature. To assist, de Podesta et al recently experimentally obtained a precise new estimate of the Boltzmann constant. This estimate is proposed as a basis for the redefinition of the unit of temperature, the kelvin. The present paper reports a reanalysis of de Podesta et al’s data that reveals systematic non-random patterns in the residuals of the key fitted model equation. These patterns violate the assumptions underlying the analysis and thus they raise questions about the validity of de Podesta et al’s estimate of the Boltzmann constant. An approach is discussed to address these issues, which should lead to an accurate estimate of the Boltzmann constant with a lower uncertainty.
Simulation of a Microfluidic Gradient Generator using Lattice Boltzmann Methods
Simon, Tanaka
2013-01-01
Microfluidics provides a powerful and versatile technology to accurately control spatial and temporal conditions for cell culturing and can therefore be used to study cellular responses to gradients. Here we use Lattice Boltzmann methods (LBM) to solve both the Navier-Stokes equation (NSE) for the fluid and the coupled convection-diffusion equation (CDE) for the compounds that form the diffusion-based gradient. The design of a microfluidic chamber for diffusion-based gradients must avoid flow through the cell chamber. This can be achieved by alternately opening the source and the sink channels. The fast toggling of microfluidic valves requires switching between different boundary conditions. We demonstrate that the LBM is a powerful method for handling complex geometries, high Peclet number conditions, discontinuities in the boundary conditions, and multiphysics coupling.
Influence of asperities on fluid and thermal flow in a fracture: a coupled Lattice Boltzmann study
Neuville, Amélie; Toussaint, Renaud
2013-01-01
The characteristics of the hydro-thermal flow which occurs when a cold fluid is injected into a hot fractured bedrock depend on the morphology of the fracture. We consider a sharp triangular asperity, invariant in one direction, perturbing an otherwise flat fracture. We investigate its influence on the macroscopic hydraulic transmissivity and heat transfer efficiency, at fixed low Reynolds number. In this study, numerical simulations are done with a coupled lattice Boltzmann method that solves both the complete Navier-Stokes and advection-diffusion equations in three dimensions. The results are compared with those obtained under lubrication approximations which rely on many hypotheses and neglect the three-dimensional (3D) effects. The lubrication results are obtained by analytically solving the Stokes equation and a two-dimensional (integrated over the thickness) advection-diffusion equation. We use a lattice Boltzmann method with a double distribution (for mass and energy transport) on hypercubic and cubic ...
Niu, Xiao-Dong; Hyodo, Shi-Aki; Munekata, Toshihisa; Suga, Kazuhiko
2007-09-01
It is well known that the Navier-Stokes equations cannot adequately describe gas flows in the transition and free-molecular regimes. In these regimes, the Boltzmann equation (BE) of kinetic theory is invoked to govern the flows. However, this equation cannot be solved easily, either by analytical techniques or by numerical methods. Hence, in order to efficiently maneuver around this equation for modeling microscale gas flows, a kinetic lattice Boltzmann method (LBM) has been introduced in recent years. This method is regarded as a numerical approach for solving the BE in discrete velocity space with Gauss-Hermite quadrature. In this paper, a systematic description of the kinetic LBM, including the lattice Boltzmann equation, the diffuse-scattering boundary condition for gas-surface interactions, and definition of the relaxation time, is provided. To capture the nonlinear effects due to the high-order moments and wall boundaries, an effective relaxation time and a modified regularization procedure of the nonequilibrium part of the distribution function are further presented based on previous work [Guo et al., J. Appl. Phys. 99, 074903 (2006); Shan et al., J. Fluid Mech. 550, 413 (2006)]. The capability of the kinetic LBM of simulating microscale gas flows is illustrated based on the numerical investigations of micro Couette and force-driven Poiseuille flows.
Computational Aeroacoustics Using the Generalized Lattice Boltzmann Equation Project
National Aeronautics and Space Administration — The research proposed targets airframe noise (AFN) prediction and reduction. AFN originates from complex interactions of turbulent flow with airframe components that...
Phantom cosmology and Boltzmann brains problem
Astashenok, Artyom V; Yurov, Valerian V
2013-01-01
We consider the well-known Boltzmann brains problem in frames of simple phantom energy models with little rip, big rip and big freeze singularity. It is showed that these models (i) satisfy to observational data and (ii) may be free from Boltzmann brains problem. The human observers in phantom models can exist only in during for a certain period $t
A Boltzmann Transport Simulation Using Open Source Physics
Hasbun, Javier
2004-03-01
The speed of a charged particle, under an applied electric field, in a conducting media, is, usually, simply modelled by writing Newton's 2nd law in the form mfrac ddtv=qE-mfrac vτ ; (1), where v is the speed, E is the applied electric field, q is the charge, m is the mass, and τ is the scattering time between collisions. Here, we simulate a numerical solution of the Boltzmann transport equation,frac partial partial tf+ vot nabla _rf+Fot nabla _pf=frac partial partial tf|_coll (2), where in general the Boltzmann distribution function f=f(r,p,t) depends on position, momentum, and time. Our numerical solution is made possible by neglecting the 2nd term on the LHS, and by modelling the RHS collision term as fracpartial partial tf|_coll=-frac 1τ . With these approximations, in addition to considering only one dimension, we find, our numerical solution of (2). The average velocity numerically obtained through the resulting distribution is compared to that obtained by the analytic solution of (1). An efficient method of carrying out the numerical solution of (2) due to P. Drallos and M. Wadehra [Journal of Applied Physics 63, 5601(1988)] is incorporated here. A final version of an applet that performs the full Java simulation will be located at http://www.westga.edu/ jhasbun/osp/osp.htm.
Polyelectrolyte Microcapsules: Ion Distributions from a Poisson-Boltzmann Model
Tang, Qiyun; Denton, Alan R.; Rozairo, Damith; Croll, Andrew B.
2014-03-01
Recent experiments have shown that polystyrene-polyacrylic-acid-polystyrene (PS-PAA-PS) triblock copolymers in a solvent mixture of water and toluene can self-assemble into spherical microcapsules. Suspended in water, the microcapsules have a toluene core surrounded by an elastomer triblock shell. The longer, hydrophilic PAA blocks remain near the outer surface of the shell, becoming charged through dissociation of OH functional groups in water, while the shorter, hydrophobic PS blocks form a networked (glass or gel) structure. Within a mean-field Poisson-Boltzmann theory, we model these polyelectrolyte microcapsules as spherical charged shells, assuming different dielectric constants inside and outside the capsule. By numerically solving the nonlinear Poisson-Boltzmann equation, we calculate the radial distribution of anions and cations and the osmotic pressure within the shell as a function of salt concentration. Our predictions, which can be tested by comparison with experiments, may guide the design of microcapsules for practical applications, such as drug delivery. This work was supported by the National Science Foundation under Grant No. DMR-1106331.
Lattice Boltzmann Simulation for Complex Flow in a Solar Wall
Institute of Scientific and Technical Information of China (English)
CHEN Rou; Shao Jiu-Gu; ZHENG You-Qu; YU Hui-Dan; XU You-Sheng
2013-01-01
In this letter,we present a lattice Boltzmann simulation for complex flow in a solar wall system which includes porous media flow and heat transfer,specifically for solar energy utilization through an unglazed transpired solar air collector (UTC).Besides the lattice Boltzmann equation (LBE) for time evolution of particle distribution function for fluid field,we introduce an analogy,LBE for time evolution of distribution function for temperature.Both temperature fields of fluid (air) and solid (porous media) are modeled.We study the effects of fan velocity,solar radiation intensity,porosity,etc.on the thermal performance of the UTC.In general,our simulation results are in good agreement with what in literature.With the current system setting,both fan velocity and solar radiation intensity have significant effect on the thermal performance of the UTC.However,it is shown that the porosity has negligible effect on the heat collector indicating the current system setting might not be realistic.Further examinations of thermal performance in different UTC systems are ongoing.The results are expected to present in near future.
Grid refinement for entropic lattice Boltzmann models
Dorschner, B; Chikatamarla, S S; Karlin, I V
2016-01-01
We propose a novel multi-domain grid refinement technique with extensions to entropic incompressible, thermal and compressible lattice Boltzmann models. Its validity and accuracy are accessed by comparison to available direct numerical simulation and experiment for the simulation of isothermal, thermal and viscous supersonic flow. In particular, we investigate the advantages of grid refinement for the set-ups of turbulent channel flow, flow past a sphere, Rayleigh-Benard convection as well as the supersonic flow around an airfoil. Special attention is payed to analyzing the adaptive features of entropic lattice Boltzmann models for multi-grid simulations.
Fast lattice Boltzmann solver for relativistic hydrodynamics.
Mendoza, M; Boghosian, B M; Herrmann, H J; Succi, S
2010-07-01
A lattice Boltzmann formulation for relativistic fluids is presented and numerically validated through quantitative comparison with recent hydrodynamic simulations of relativistic fluids. In order to illustrate its capability to handle complex geometries, the scheme is also applied to the case of a three-dimensional relativistic shock wave, generated by a supernova explosion, impacting on a massive interstellar cloud. This formulation opens up the possibility of exporting the proven advantages of lattice Boltzmann methods, namely, computational efficiency and easy handling of complex geometries, to the context of (mildly) relativistic fluid dynamics at large, from quark-gluon plasmas up to supernovae with relativistic outflows.
Pruning Boltzmann networks and hidden Markov models
DEFF Research Database (Denmark)
Pedersen, Morten With; Stork, D.
1996-01-01
We present sensitivity-based pruning algorithms for general Boltzmann networks. Central to our methods is the efficient calculation of a second-order approximation to the true weight saliencies in a cross-entropy error. Building upon previous work which shows a formal correspondence between linea...... and thus the proper weight is pruned at each pruning step. In all our experiments in small problems, pruning reduces the generalization error; in most cases the pruned networks facilitate interpretation as well......We present sensitivity-based pruning algorithms for general Boltzmann networks. Central to our methods is the efficient calculation of a second-order approximation to the true weight saliencies in a cross-entropy error. Building upon previous work which shows a formal correspondence between linear...... Boltzmann chains and hidden Markov models (HMMs), we argue that our method can be applied to HMMs as well. We illustrate pruning on Boltzmann zippers, which are equivalent to two HMMs with cross-connection links. We verify that our second-order approximation preserves the rank ordering of weight saliencies...
Geometric variations of the Boltzmann entropy
Kalogeropoulos, Nikos
2008-01-01
We perform a calculation of the first and second order infinitesimal variations, with respect to energy, of the Boltzmann entropy of constant energy hypersurfaces of a system with a finite number of degrees of freedom. We comment on the stability interpretation of the second variation in this framework.
Boltzmann und das Ende des mechanistischen Weltbildes
Renn, Jürgen
2007-01-01
Der Wissenschaftshistoriker und Physiker Jürgen Renn untersucht die Rolle des österreichischen Physikers und Philosophen Ludwig Boltzmann (18441906) bei der Entwicklung der modernen Physik. Boltzmann war einer der letzen Vertreter des mechanistischen Weltbildes und stand somit am Ende eines Zeitalters. Renn porträtiert den Wissenschaftler aber als einen Pionier der modernen Physik, dessen Beschäftigung mit den inneren Spannungen der klassischen Physik ihn visionär zukünftige Fragestellungen aufgreifen ließ. So befasste sich Boltzmann etwa mit den Grenzproblemen zwischen Mechanik und Thermodynamik, die ihn zur Entwicklung immer raffinierterer Instrumente der statistischen Physik antrieb, die schließlich zu Schlüsselinstrumenten der modernen Physik wurden. Boltzmanns Werk steht somit am Übergang vom mechanistischen Weltbild zur Relativitäts- und Quantentheorie. Der Aussage des viel bekannteren Physikers Albert Einstein, dass Fantasie wichtiger sei als Wissen, hält Jürgen Renn im Hinblick auf Leben ...
Stefan-Boltzmann law for massive photons
Moreira, E S
2015-01-01
Thirty years ago a paper appeared in the literature generalizing the Stefan-Boltzmann law to include massive photons. The paper suffers from a flaw though: it assumes that a massive photon travels at the speed of (massless) light. The present work fixes the mistake and presents the correct formula for the radiance.
Stefan-Boltzmann Law for Massive Photons
Moreira, E. S.; Ribeiro, T. G.
2016-08-01
This paper generalizes the Stefan-Boltzmann law to include massive photons. A crucial ingredient to obtain the correct formula for the radiance is to realize that a massive photon does not travel at the speed of (massless) light. It follows that, contrary to what could be expected, the radiance is not proportional to the energy density times the speed of light.
Boltzmann Samplers for Colored Combinatorial Objects
Bodini, Olivier
2009-01-01
In this paper, we give a general framework for the Boltzmann generation of colored objects belonging to combinatorial constructible classes. We propose an intuitive notion called profiled objects which allows the sampling of size-colored objects (and also of k-colored objects) although the corresponding class cannot be described by an analytic ordinary generating function.
Two Dimensional Lattice Boltzmann Method for Cavity Flow Simulation
Directory of Open Access Journals (Sweden)
Panjit MUSIK
2004-01-01
Full Text Available This paper presents a simulation of incompressible viscous flow within a two-dimensional square cavity. The objective is to develop a method originated from Lattice Gas (cellular Automata (LGA, which utilises discrete lattice as well as discrete time and can be parallelised easily. Lattice Boltzmann Method (LBM, known as discrete Lattice kinetics which provide an alternative for solving the Navier–Stokes equations and are generally used for fluid simulation, is chosen for the study. A specific two-dimensional nine-velocity square Lattice model (D2Q9 Model is used in the simulation with the velocity at the top of the cavity kept fixed. LBM is an efficient method for reproducing the dynamics of cavity flow and the results which are comparable to those of previous work.
Chemical-potential-based Lattice Boltzmann Method for Nonideal Fluids
Wen, Binghai; He, Bing; Zhang, Chaoying; Fang, Haiping
2016-01-01
Chemical potential is an effective way to drive phase transition or express wettability. In this letter, we present a chemical-potential-based lattice Boltzmann model to simulate multiphase flows. The nonideal force is directly evaluated by a chemical potential. The model theoretically satisfies thermodynamics and Galilean invariance. The computational efficiency is improved owing to avoiding the calculation of pressure tensor. We have derived several chemical potentials of the popular equations of state from the free-energy density function. An effective chemical-potential boundary condition is implemented to investigate the wettability of a solid surface. Remarkably, the numerical results show that the contact angle can be linearly tuned by the surface chemical potential.
Lattice Boltzmann based discrete simulation for gas-solid fluidization
Wang, Limin; Wang, Xiaowei; Ge, Wei
2013-01-01
Discrete particle simulation, a combined approach of computational fluid dynamics and discrete methods such as DEM (Discrete Element Method), SPH (Smoothed Particle Hydrodynamics), PIC (Particle-In-Cell), etc., is becoming a practical tool for exploring lab-scale gas-solid systems owing to the fast development of its parallel computation. However, the gas-solid coupling and the corresponding fluid flow solver remain immature. In this work, we presented a modified lattice Boltzmann approach to consider the effect of both the local solid volume fraction and the local relative velocity between the particles and the fluid, which was different from the traditional volume-averaged Navier-Stokes equations. This approach is combined with a time-driven hard sphere algorithm to simulate the motion of individual particles in which particles interact with each other via hard-sphere collisions but the collision detection and motion of the particle are performed at constant time intervals, and the EMMS (energy minimization...
Slits, plates, and Poisson-Boltzmann theory in a local formulation of nonlocal electrostatics.
Paillusson, Fabien; Blossey, Ralf
2010-11-01
Polar liquids like water carry a characteristic nanometric length scale, the correlation length of orientation polarizations. Continuum theories that can capture this feature commonly run under the name of "nonlocal" electrostatics since their dielectric response is characterized by a scale-dependent dielectric function ε(q), where q is the wave vector; the Poisson(-Boltzmann) equation then turns into an integro-differential equation. Recently, "local" formulations have been put forward for these theories and applied to water, solvated ions, and proteins. We review the local formalism and show how it can be applied to a structured liquid in slit and plate geometries, and solve the Poisson-Boltzmann theory for a charged plate in a structured solvent with counterions. Our results establish a coherent picture of the local version of nonlocal electrostatics and show its ease of use when compared to the original formulation.
Beyond Poisson-Boltzmann: fluctuations and fluid structure in a self-consistent theory
Buyukdagli, S.; Blossey, R.
2016-09-01
Poisson-Boltzmann (PB) theory is the classic approach to soft matter electrostatics and has been applied to numerous physical chemistry and biophysics problems. Its essential limitations are in its neglect of correlation effects and fluid structure. Recently, several theoretical insights have allowed the formulation of approaches that go beyond PB theory in a systematic way. In this topical review, we provide an update on the developments achieved in the self-consistent formulations of correlation-corrected Poisson-Boltzmann theory. We introduce a corresponding system of coupled non-linear equations for both continuum electrostatics with a uniform dielectric constant, and a structured solvent—a dipolar Coulomb fluid—including non-local effects. While the approach is only approximate and also limited to corrections in the so-called weak fluctuation regime, it allows us to include physically relevant effects, as we show for a range of applications of these equations.
Investigation of Resistivity of Saturated Porous Media with Lattice Boltzmann Method
Institute of Scientific and Technical Information of China (English)
YUE Wen-Zheng; TAO Guo; ZHU Ke-Qin
2004-01-01
The lattice Boltzmann method is employed to study the electrical transport properties of saturated porous media.Electrical current flow through the porous media is simulated and the relationship between resistivity index and water saturation is derived. It is found that this kind of relation is not a straight line as described by the Archie equation with the parameter n being a constant in a log-log scale. A new equation is thus developed to formulate this relation with n being a function of porosity and water saturation. The comparisons between the results by lattice Boltzmann and by the laboratory experiments on rock samples demonstrate that this numerical method can provide an alternative way for the expensive laboratory experiments to investigate the electrical transport properties of saturated porous media and can be used to explore micro mechanisms more conveniently.
Reis, T.
2010-09-06
Existing lattice Boltzmann models that have been designed to recover a macroscopic description of immiscible liquids are only able to make predictions that are quantitatively correct when the interface that exists between the fluids is smeared over several nodal points. Attempts to minimise the thickness of this interface generally leads to a phenomenon known as lattice pinning, the precise cause of which is not well understood. This spurious behaviour is remarkably similar to that associated with the numerical simulation of hyperbolic partial differential equations coupled with a stiff source term. Inspired by the seminal work in this field, we derive a lattice Boltzmann implementation of a model equation used to investigate such peculiarities. This implementation is extended to different spacial discretisations in one and two dimensions. We shown that the inclusion of a quasi-random threshold dramatically delays the onset of pinning and facetting.
Dynamically adaptive Lattice Boltzmann simulation of shallow water flows with the Peano framework
Neumann, Philipp
2015-09-01
© 2014 Elsevier Inc. All rights reserved. We present a dynamically adaptive Lattice Boltzmann (LB) implementation for solving the shallow water equations (SWEs). Our implementation extends an existing LB component of the Peano framework. We revise the modular design with respect to the incorporation of new simulation aspects and LB models. The basic SWE-LB implementation is validated in different breaking dam scenarios. We further provide a numerical study on stability of the MRT collision operator used in our simulations.
Boltzmann-Gibbs Distribution of Fortune and Broken Time-Reversible Symmetry in Econodynamics
Ao, P
2005-01-01
Within the description of stochastic differential equations it is argued that the existence of Boltzmann-Gibbs type distribution in economy is independent of the time reversal symmetry in econodynamics. Both power law and exponential distributions can be accommodated by it. The demonstration is based on a mathematical structure discovered during a study in gene regulatory network dynamics. Further possible analogy between equilibrium economy and thermodynamics is explored.
A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments
Energy Technology Data Exchange (ETDEWEB)
Fisicaro, G., E-mail: giuseppe.fisicaro@unibas.ch; Goedecker, S. [Department of Physics, University of Basel, Klingelbergstrasse 82, 4056 Basel (Switzerland); Genovese, L. [University of Grenoble Alpes, CEA, INAC-SP2M, L-Sim, F-38000 Grenoble (France); Andreussi, O. [Institute of Computational Science, Università della Svizzera Italiana, Via Giuseppe Buffi 13, CH-6904 Lugano (Switzerland); Theory and Simulations of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, Station 12, CH-1015 Lausanne (Switzerland); Marzari, N. [Theory and Simulations of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, Station 12, CH-1015 Lausanne (Switzerland)
2016-01-07
The computational study of chemical reactions in complex, wet environments is critical for applications in many fields. It is often essential to study chemical reactions in the presence of applied electrochemical potentials, taking into account the non-trivial electrostatic screening coming from the solvent and the electrolytes. As a consequence, the electrostatic potential has to be found by solving the generalized Poisson and the Poisson-Boltzmann equations for neutral and ionic solutions, respectively. In the present work, solvers for both problems have been developed. A preconditioned conjugate gradient method has been implemented for the solution of the generalized Poisson equation and the linear regime of the Poisson-Boltzmann, allowing to solve iteratively the minimization problem with some ten iterations of the ordinary Poisson equation solver. In addition, a self-consistent procedure enables us to solve the non-linear Poisson-Boltzmann problem. Both solvers exhibit very high accuracy and parallel efficiency and allow for the treatment of periodic, free, and slab boundary conditions. The solver has been integrated into the BigDFT and Quantum-ESPRESSO electronic-structure packages and will be released as an independent program, suitable for integration in other codes.
Macroscopic model and truncation error of discrete Boltzmann method
Hwang, Yao-Hsin
2016-10-01
A derivation procedure to secure the macroscopically equivalent equation and its truncation error for discrete Boltzmann method is proffered in this paper. Essential presumptions of two time scales and a small parameter in the Chapman-Enskog expansion are disposed of in the present formulation. Equilibrium particle distribution function instead of its original non-equilibrium form is chosen as key variable in the derivation route. Taylor series expansion encompassing fundamental algebraic manipulations is adequate to realize the macroscopically differential counterpart. A self-contained and comprehensive practice for the linear one-dimensional convection-diffusion equation is illustrated in details. Numerical validations on the incurred truncation error in one- and two-dimensional cases with various distribution functions are conducted to verify present formulation. As shown in the computational results, excellent agreement between numerical result and theoretical prediction are found in the test problems. Straightforward extensions to more complicated systems including convection-diffusion-reaction, multi-relaxation times in collision operator as well as multi-dimensional Navier-Stokes equations are also exposed in the Appendix to point out its expediency in solving complicated flow problems.
Lattice-Boltzmann simulations of droplet evaporation
Ledesma-Aguilar, Rodrigo
2014-09-04
© the Partner Organisations 2014. We study the utility and validity of lattice-Boltzmann (LB) simulations to explore droplet evaporation driven by a concentration gradient. Using a binary-fluid lattice-Boltzmann algorithm based on Cahn-Hilliard dynamics, we study the evaporation of planar films and 3D sessile droplets from smooth solid surfaces. Our results show that LB simulations accurately reproduce the classical regime of quasi-static dynamics. Beyond this limit, we show that the algorithm can be used to explore regimes where the evaporative and diffusive timescales are not widely separated, and to include the effect of boundaries of prescribed driving concentration. We illustrate the method by considering the evaporation of a droplet from a solid surface that is chemically patterned with hydrophilic and hydrophobic stripes. This journal is
Directory of Open Access Journals (Sweden)
Hose Rod
2009-10-01
Full Text Available Abstract Background Systolic blood flow has been simulated in the abdominal aorta and the superior mesenteric artery. The simulations were carried out using two different computational hemodynamic methods: the finite element method to solve the Navier Stokes equations and the lattice Boltzmann method. Results We have validated the lattice Boltzmann method for systolic flows by comparing the velocity and pressure profiles of simulated blood flow between methods. We have also analyzed flow-specific characteristics such as the formation of a vortex at curvatures and traces of flow. Conclusion The lattice Boltzmann Method is as accurate as a Navier Stokes solver for computing complex blood flows. As such it is a good alternative for computational hemodynamics, certainly in situation where coupling to other models is required.
Prandtl number effects in MRT lattice Boltzmann models for shocked and unshocked compressible fluids
Institute of Scientific and Technical Information of China (English)
无
2011-01-01
This paper constructs a new multiple relaxation time lattice Boltzmann model which is not only for the shocked compressible fluids,but also for the unshocked compressible fluids.To make the model work for unshocked compressible fluids,a key step is to modify the collision operators of energy flux so that the viscous coefficient in momentum equation is consistent with that in energy equation even in the unshocked system.The unnecessity of the modification for systems under strong shock is analyzed.The model ...
Surface Tension of Acid Solutions: Fluctuations beyond the Non-linear Poisson-Boltzmann Theory
Markovich, Tomer; Podgornik, Rudi
2016-01-01
We extend our previous study of surface tension of ionic solutions and apply it to the case of acids (and salts) with strong ion-surface interactions. These ion-surface interactions yield a non-linear boundary condition with an effective surface charge due to adsorption of ions from the bulk onto the interface. The calculation is done using the loop-expansion technique, where the zero-loop (mean field) corresponds of the non-linear Poisson-Boltzmann equation. The surface tension is obtained analytically to one-loop order, where the mean-field contribution is a modification of the Poisson-Boltzmann surface tension, and the one-loop contribution gives a generalization of the Onsager-Samaras result. Our theory fits well a wide range of different acids and salts, and is in accord with the reverse Hofmeister series for acids.
Universal Property of Quantum Gravity implied by Bekenstein-Hawking Entropy and Boltzmann formula
Saida, Hiromi
2013-01-01
We search for a universal property of quantum gravity. By "universal", we mean the independence from any existing model of quantum gravity (such as the super string theory, loop quantum gravity, causal dynamical triangulation, and so on). To do so, we try to put the basis of our discussion on theories established by some experiments. Thus, we focus our attention on thermodynamical and statistical-mechanical basis of the black hole thermodynamics: Let us assume that the Bekenstein-Hawking entropy is given by the Boltzmann formula applied to the underlying theory of quantum gravity. Under this assumption, the conditions justifying Boltzmann formula together with uniqueness of Bekenstein-Hawking entropy imply a reasonable universal property of quantum gravity. The universal property indicates a repulsive gravity at Planck length scale, otherwise stationary black holes can not be regarded as thermal equilibrium states of gravity. Further, in semi-classical level, we discuss a possible correction of Einstein equat...
Interpolation methods and the accuracy of lattice-Boltzmann mesh refinement
Energy Technology Data Exchange (ETDEWEB)
Guzik, Stephen M. [Colorado State Univ., Fort Collins, CO (United States). Dept. of Mechanical Engineering; Weisgraber, Todd H. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Colella, Phillip [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Alder, Berni J. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
2013-12-10
A lattice-Boltzmann model to solve the equivalent of the Navier-Stokes equations on adap- tively refined grids is presented. A method for transferring information across interfaces between different grid resolutions was developed following established techniques for finite- volume representations. This new approach relies on a space-time interpolation and solving constrained least-squares problems to ensure conservation. The effectiveness of this method at maintaining the second order accuracy of lattice-Boltzmann is demonstrated through a series of benchmark simulations and detailed mesh refinement studies. These results exhibit smaller solution errors and improved convergence when compared with similar approaches relying only on spatial interpolation. Examples highlighting the mesh adaptivity of this method are also provided.
Moment-based boundary conditions for lattice Boltzmann simulations of natural convection in cavities
Allen, Rebecca
2016-06-29
We study a multiple relaxation time lattice Boltzmann model for natural convection with moment-based boundary conditions. The unknown primary variables of the algorithm at a boundary are found by imposing conditions directly upon hydrodynamic moments, which are then translated into conditions for the discrete velocity distribution functions. The method is formulated so that it is consistent with the second order implementation of the discrete velocity Boltzmann equations for fluid flow and temperature. Natural convection in square cavities is studied for Rayleigh numbers ranging from 103 to 108. An excellent agreement with benchmark data is observed and the flow fields are shown to converge with second order accuracy. Copyright © 2016 Inderscience Enterprises Ltd.
Thermal Lattice Boltzmann Simulations for Vapor-Liquid Two-Phase Flows in Two Dimensions
Wei, Yikun; Qian, Yuehong
2011-11-01
A lattice Boltzmann model with double distribution functions is developed to simulate thermal vapor-liquid two-phase flows. In this model, the so-called mesoscopic inter-particle pseudo-potential for the single component multi-phase lattice Boltzmann model is used to simulate the fluid dynamics and the internal energy field is simulated by using a energy distribution function. Theoretical results for large-scale dynamics including the internal energy equation can be derived and numerical results for the coexistence curve of vapor-liquid systems are in good agreement with the theoretical predictions. It is shown from numerical simulations that the model has the ability to mimic phase transitions, bubbly flows and slugging flows. This research is support in part by the grant of Education Ministry of China IRT0844 and the grant of Shanghai CST 11XD1402300.
Lattice boltzmann study on the contact angle and contact line dynamics of liquid-vapor interfaces.
Zhang, Junfeng; Kwok, Daniel Y
2004-09-14
The moving contact line problem of liquid-vapor interfaces was studied using a mean-field free-energy lattice Boltzmann method recently proposed [Phys. Rev. E 2004, 69, 032602]. We have examined the static and dynamic interfacial behaviors by means of the bubble and capillary wave tests and found that both the Laplace equation of capillarity and the dispersion relation were satisfied. Dynamic contact angles followed the general trend of contact line velocity observed experimentally and can be described by Blake's theory. The velocity fields near the interface were also obtained and are in good agreement with fluid mechanics and molecular dynamics studies. Our simulations demonstrated that incorporating interfacial effects into the lattice Boltzmann model can be a valuable and powerful alternative in interfacial studies.
Three ways to lattice Boltzmann: a unified time-marching picture.
Ubertini, S; Asinari, P; Succi, S
2010-01-01
It is shown that the lattice Boltzmann equation (LBE) corresponds to an explicit Verlet time-marching scheme for a continuum generalized Boltzmann equation with a memory delay equal to a half time step. This proves second-order accuracy of LBE with respect to this generalized equation, with no need of resorting to any implicit time-marching procedure (Crank-Nicholson) and associated nonlinear variable transformations. It is also shown, and numerically demonstrated, that this equivalence is not only formal, but it also translates into a complete equivalence of the corresponding computational schemes with respect to the hydrodynamic equations. Second-order accuracy with respect to the continuum kinetic equation is also numerically demonstrated for the case of the Taylor-Green vortex. It is pointed out that the equivalence is however broken for the case in which mass and/or momentum are not conserved, such as for chemically reactive flows and mixtures. For such flows, the time-centered implicit formulation may indeed offer a better numerical accuracy.
Lattice Boltzmann modeling of three-phase incompressible flows
Liang, H.; Shi, B. C.; Chai, Z. H.
2016-01-01
In this paper, based on multicomponent phase-field theory we intend to develop an efficient lattice Boltzmann (LB) model for simulating three-phase incompressible flows. In this model, two LB equations are used to capture the interfaces among three different fluids, and another LB equation is adopted to solve the flow field, where a new distribution function for the forcing term is delicately designed. Different from previous multiphase LB models, the interfacial force is not used in the computation of fluid velocity, which is more reasonable from the perspective of the multiscale analysis. As a result, the computation of fluid velocity can be much simpler. Through the Chapman-Enskog analysis, it is shown that the present model can recover exactly the physical formulations for the three-phase system. Numerical simulations of extensive examples including two circular interfaces, ternary spinodal decomposition, spreading of a liquid lens, and Kelvin-Helmholtz instability are conducted to test the model. It is found that the present model can capture accurate interfaces among three different fluids, which is attributed to its algebraical and dynamical consistency properties with the two-component model. Furthermore, the numerical results of three-phase flows agree well with the theoretical results or some available data, which demonstrates that the present LB model is a reliable and efficient method for simulating three-phase flow problems.
Lattice-Boltzmann-based Simulations of Diffusiophoresis
Castigliego, Joshua; Kreft Pearce, Jennifer
We present results from a lattice-Boltzmann-base Brownian Dynamics simulation on diffusiophoresis and the separation of particles within the system. A gradient in viscosity that simulates a concentration gradient in a dissolved polymer allows us to separate various types of particles by their deformability. As seen in previous experiments, simulated particles that have a higher deformability react differently to the polymer matrix than those with a lower deformability. Therefore, the particles can be separated from each other. This simulation, in particular, was intended to model an oceanic system where the particles of interest were zooplankton, phytoplankton and microplastics. The separation of plankton from the microplastics was achieved.
Application of lattice Boltzmann scheme to nanofluids
Institute of Scientific and Technical Information of China (English)
XUAN Yimin; LI Qiang; YAO Zhengping
2004-01-01
A nanofluid is a particle suspension that consists of base liquids and nanoparticles. Nanofluid has greater potential for heat transfer enhancement than traditional solid-liquid mixture. By accounting for the external and internal forces acting on the suspended nanoparticles and interactions among the nanoparticles and fluid particles,a lattice Boltzmann model for simulating flow and energy transport processes inside the nanofluids is proposed. The irregular motion of the nanoparticles and inherent dynamic behavior of nanofluids are discussed. The distributions of suspended nanoparticles inside nanofluids are calculated.
Dimensional Equations of Entropy
Sparavigna, Amelia Carolina
2015-01-01
Entropy is a quantity which is of great importance in physics and chemistry. The concept comes out of thermodynamics, proposed by Rudolf Clausius in his analysis of Carnot cycle and linked by Ludwig Boltzmann to the number of specific ways in which a physical system may be arranged. Any physics classroom, in its task of learning physics, has therefore to face this crucial concept. As we will show in this paper, the lectures can be enriched by discussing dimensional equations linked to the entropy of some physical systems.
Lattice Boltzmann simulations of multiple-droplet interaction dynamics
Zhou, Wenchao; Loney, Drew; Fedorov, Andrei G.; Degertekin, F. Levent; Rosen, David W.
2014-03-01
A lattice Boltzmann (LB) formulation, which is consistent with the phase-field model for two-phase incompressible fluid, is proposed to model the interface dynamics of droplet impingement. The interparticle force is derived by comparing the macroscopic transport equations recovered from LB equations with the governing equations of the continuous phase-field model. The inconsistency between the existing LB implementations and the phase-field model in calculating the relaxation time at the phase interface is identified and an approximation is proposed to ensure the consistency with the phase-field model. It is also shown that the commonly used equilibrium velocity boundary for the binary fluid LB scheme does not conserve momentum at the wall boundary and a modified scheme is developed to ensure the momentum conservation at the boundary. In addition, a geometric formulation of the wetting boundary condition is proposed to replace the popular surface energy formulation and results show that the geometric approach enforces the prescribed contact angle better than the surface energy formulation in both static and dynamic wetting. The proposed LB formulation is applied to simulating droplet impingement dynamics in three dimensions and results are compared to those obtained with the continuous phase-field model, the LB simulations reported in the literature, and experimental data from the literature. The results show that the proposed LB simulation approach yields not only a significant speed improvement over the phase-field model in simulating droplet impingement dynamics on a submillimeter length scale, but also better accuracy than both the phase-field model and the previously reported LB techniques when compared to experimental data. Upon validation, the proposed LB modeling methodology is applied to the study of multiple-droplet impingement and interactions in three dimensions, which demonstrates its powerful capability of simulating extremely complex interface
Multireflection boundary conditions for lattice Boltzmann models.
Ginzburg, Irina; d'Humières, Dominique
2003-12-01
We present a general framework for several previously introduced boundary conditions for lattice Boltzmann models, such as the bounce-back rule and the linear and quadratic interpolations. The objectives are twofold: first to give theoretical tools to study the existing link-type boundary conditions and their corresponding accuracy; second to design boundary conditions for general flows which are third-order kinetic accurate. Using these new boundary conditions, Couette and Poiseuille flows are exact solutions of the lattice Boltzmann models for a Reynolds number Re=0 (Stokes limit) for arbitrary inclination with the lattice directions. Numerical comparisons are given for Stokes flows in periodic arrays of spheres and cylinders, linear periodic array of cylinders between moving plates, and for Navier-Stokes flows in periodic arrays of cylinders for Re<200. These results show a significant improvement of the overall accuracy when using the linear interpolations instead of the bounce-back reflection (up to an order of magnitude on the hydrodynamics fields). Further improvement is achieved with the new multireflection boundary conditions, reaching a level of accuracy close to the quasianalytical reference solutions, even for rather modest grid resolutions and few points in the narrowest channels. More important, the pressure and velocity fields in the vicinity of the obstacles are much smoother with multireflection than with the other boundary conditions. Finally the good stability of these schemes is highlighted by some simulations of moving obstacles: a cylinder between flat walls and a sphere in a cylinder.
Entropic Lattice Boltzmann Methods for Fluid Mechanics
Chikatamarla, Shyam; Boesch, Fabian; Sichau, David; Karlin, Ilya
2013-11-01
With its roots in statistical mechanics and kinetic theory, the lattice Boltzmann method (LBM) is a paradigm-changing innovation, offering for the first time an intrinsically parallel CFD algorithm. Over the past two decades, LBM has achieved numerous results in the field of CFD and is now in a position to challenge state-of-the art CFD techniques. Our major restyling of LBM resulted in an unconditionally stable entropic LBM which restored Second Law (Boltzmann H theorem) in the LBM kinetics and thus enabled affordable direct simulations of fluid turbulence. We review here recent advances in ELBM as a practical, modeling-free tool for simulation of turbulent flows in complex geometries. We shall present recent simulations including turbulent channel flow, flow past a circular cylinder, knotted vortex tubes, and flow past a surface mounted cube. ELBM listed all admissible lattices supporting a discrete entropy function and has classified them in hierarchically increasing order of accuracy. Applications of these higher-order lattices to simulations of turbulence and thermal flows shall also be presented. This work was supported CSCS grant s437.
Derivation of the high field semiconductor equations
Energy Technology Data Exchange (ETDEWEB)
Hagan, P.S. (Los Alamos National Lab., NM (United States)); Cox, R.W. (Department of Computer Information Science, Indiana University, Purdue University, Indianapolis (USA)); Wagner, B.A. (Arizona Univ., Tucson, AZ (United States). Dept. of Mathematics)
1991-01-01
Electron and hole densities evolve in x-z phase space according to Boltzmann equations. When the mean free path of the particles is short and electric force on the particles is weak, a well-known expansion can be used to solve the Boltzmann equation. This asymptotic solution shows that the spatial density of electrons and holes evolves according to diffusion-drift equations. As devices become smaller, electric fields become stronger, which renders the Basic Semiconductor Equations increasingly inaccurate. To remedy this problem, we use singular perturbation techniques to obtain a new asymptotic expansion for the Boltzmann equation. Like the Hilbert expansion, the new expansion requires the mean free path to be short compared to all macroscopic length scales. However, it does not require the electric forces to be weak. The new expansion shows that spatial densities obey diffusion-drift equations as before, but the diffusivity D and mobility {mu} turn out to be nonlinear functions of the electric field. In particular, our analysis determines the field-dependent mobilities {mu}(E) and diffusivities D(E) directly from the scattering operator. By carrying out this asymptotic expansion to higher order, we obtain the high frequency corrections to the drift velocity and diffusivity, and also the corrections due to gradients in the electric field. Remarkably, we find that Einsteins's relation is still satisfied, even with these corrections. The new diffusion-drift equations, together with Poissons' equation for the electric field, form the high-field semiconductor equations, which can be expected to be accurate regardless of the strength of the electric fields within the semiconductor. In addition, our analysis determines the entire momentum distribution of the particles, so we derive a very accurate first moment model for semi-conductors by substituting the asymptotically-correct distribution back into the Boltzmann equation and taking moments.
A Pseudo-Kinetic Approach for Helmholtz Equation
Institute of Scientific and Technical Information of China (English)
Radjesvarane ALEXANDRE; Jie LIAO
2013-01-01
A lattice Boltzmann type pseudo-kinetic model for a non-homogeneous Helmholtz equation is derived in this paper.Numerical results for some model problems show the robustness and efficiency of this lattice Boltzmann type pseudo-kinetic scheme.The computation at each site is determined only by local parameters,and can be easily adapted to solve multiple scattering problems with many scatterers or wave propagation in nonhomogeneous medium without increasing the computational cost.
Shrestha, Kalyan; Mompean, Gilmar; Calzavarini, Enrico
2016-02-01
A finite-volume (FV) discretization method for the lattice Boltzmann (LB) equation, which combines high accuracy with limited computational cost is presented. In order to assess the performance of the FV method we carry out a systematic comparison, focused on accuracy and computational performances, with the standard streaming lattice Boltzmann equation algorithm. In particular we aim at clarifying whether and in which conditions the proposed algorithm, and more generally any FV algorithm, can be taken as the method of choice in fluid-dynamics LB simulations. For this reason the comparative analysis is further extended to the case of realistic flows, in particular thermally driven flows in turbulent conditions. We report the successful simulation of high-Rayleigh number convective flow performed by a lattice Boltzmann FV-based algorithm with wall grid refinement.
Entropic Lattice Boltzmann Methods for Fluid Mechanics: Thermal, Multi-phase and Turbulence
Chikatamarla, Shyam; Boesch, F.; Frapolli, N.; Mazloomi, A.; Karlin, I.
2014-11-01
With its roots in statistical mechanics and kinetic theory, the lattice Boltzmann method (LBM) is a paradigm-changing innovation, offering for the first time an intrinsically parallel CFD algorithm. Over the past two decades, LBM has achieved numerous results in the field of CFD and is now in a position to challenge state-of-the art CFD techniques. Major restyling of LBM resulted in an unconditionally stable entropic LBM which restored Second Law (Boltzmann H theorem) in the LBM kinetics and thus enabled affordable direct simulations of fluid turbulence. In this talk, we shall review recent advances in ELBM as a practical, modeling-free tool for simulation of complex flow phenomenon. We shall present recent simulations of fluid turbulence including turbulent channel flow, flow past a circular cylinder, creation and dynamics of vortex tubes, and flow past a surface mounted cube. Apart from its achievements in turbulent flow simulations, ELBM has also presented us the opportunity to extend lattice Boltzmann method to higher order lattices which shall be employed for turbulent, multi-phase and thermal flow simulations. A new class of entropy functions are proposed to handle non-ideal equation of state and surface tension terms in multi-phase flows. It is shown the entropy principle brings unconditional stability and thermodynamic consistency to all the three flow regimes considered here. Acknowledgements: ERC Advanced Grant ``ELBM'' and CSCS grant s437 are deeply acknowledged. References:
Munafò, A; Panesi, M; Magin, T E
2014-02-01
A Boltzmann rovibrational collisional coarse-grained model is proposed to reduce a detailed kinetic mechanism database developed at NASA Ames Research Center for internal energy transfer and dissociation in N(2)-N interactions. The coarse-grained model is constructed by lumping the rovibrational energy levels of the N(2) molecule into energy bins. The population of the levels within each bin is assumed to follow a Boltzmann distribution at the local translational temperature. Excitation and dissociation rate coefficients for the energy bins are obtained by averaging the elementary rate coefficients. The energy bins are treated as separate species, thus allowing for non-Boltzmann distributions of their populations. The proposed coarse-grained model is applied to the study of nonequilibrium flows behind normal shock waves and within converging-diverging nozzles. In both cases, the flow is assumed inviscid and steady. Computational results are compared with those obtained by direct solution of the master equation for the rovibrational collisional model and a more conventional multitemperature model. It is found that the proposed coarse-grained model is able to accurately resolve the nonequilibrium dynamics of internal energy excitation and dissociation-recombination processes with only 20 energy bins. Furthermore, the proposed coarse-grained model provides a superior description of the nonequilibrium phenomena occurring in shock heated and nozzle flows when compared with the conventional multitemperature models.
Boltzmann electron PIC simulation of the E-sail effect
Janhunen, Pekka
2015-01-01
The solar wind electric sail (E-sail) is a planned in-space propulsion device that uses the natural solar wind momentum flux for spacecraft propulsion with the help of long, charged, centrifugally stretched tethers. The problem of accurately predicting the E-sail thrust is still somewhat open, however, due to a possible electron population trapped by the tether. Here we develop a new type of particle-in-cell (PIC) simulation for predicting E-sail thrust. In the new simulation, electrons are modelled as a fluid, hence resembling hydrid simulation, but in contrast to normal hybrid simulation, the Poisson equation is used as in normal PIC to calculate the self-consistent electrostatic field. For electron-repulsive parts of the potential, the Boltzmann relation is used. For electron-attractive parts of the potential we employ a power law which contains a parameter that can be used to control the number of trapped electrons. We perform a set of runs varying the parameter and select the one with the smallest number...
Heavy Flavor in Medium Momentum Evolution: Langevin vs Boltzmann
Das, Santosh K; Greco, Vincenzo
2013-01-01
The propagation of heavy quarks through the quark-gluon plasma (QGP) has been often treated within the framework of Langevin equation (LV), i.e. assuming the heavy flavor momentum transfer is small or the scatterings are sufficiently forward peaked, small screening mass $m_D$. We address a thorough study of the approximations involved in Langevin dynamics by mean of a direct comparison with the solution of the Boltzmann collisional integral (BM) when a bulk medium is in equilibrium at fixed temperature. We show that unless the cross section is quite forward peaked ($m_D\\cong T $) or the mass to temperature ratio is quite large ($M_q/T \\gtrsim 8-10$) there are significant differences in the evolution of the $p-$spectra with time and consequently on the so-called nuclear modification factor $R_{AA}(p_T)$. However for charm quark we find that very similar $R_{AA}(p_T)$ between the LV and BM can be obtained, but the estimate of the underlying diffusion coefficient can differ by about $\\sim 15-50\\%$ depending on t...
Spectrum Analysis of Some Kinetic Equations
Yang, Tong; Yu, Hongjun
2016-11-01
We analyze the spectrum structure of some kinetic equations qualitatively by using semigroup theory and linear operator perturbation theory. The models include the classical Boltzmann equation for hard potentials with or without angular cutoff and the Landau equation with {γ≥q-2}. As an application, we show that the solutions to these two fundamental equations are asymptotically equivalent (mod time decay rate {t^{-5/4}}) as {tto∞} to that of the compressible Navier-Stokes equations for initial data around an equilibrium state.
Hejranfar, Kazem; Saadat, Mohammad Hossein; Taheri, Sina
2017-02-01
In this work, a high-order weighted essentially nonoscillatory (WENO) finite-difference lattice Boltzmann method (WENOLBM) is developed and assessed for an accurate simulation of incompressible flows. To handle curved geometries with nonuniform grids, the incompressible form of the discrete Boltzmann equation with the Bhatnagar-Gross-Krook (BGK) approximation is transformed into the generalized curvilinear coordinates and the spatial derivatives of the resulting lattice Boltzmann equation in the computational plane are solved using the fifth-order WENO scheme. The first-order implicit-explicit Runge-Kutta scheme and also the fourth-order Runge-Kutta explicit time integrating scheme are adopted for the discretization of the temporal term. To examine the accuracy and performance of the present solution procedure based on the WENOLBM developed, different benchmark test cases are simulated as follows: unsteady Taylor-Green vortex, unsteady doubly periodic shear layer flow, steady flow in a two-dimensional (2D) cavity, steady cylindrical Couette flow, steady flow over a 2D circular cylinder, and steady and unsteady flows over a NACA0012 hydrofoil at different flow conditions. Results of the present solution are compared with the existing numerical and experimental results which show good agreement. To show the efficiency and accuracy of the solution methodology, the results are also compared with the developed second-order central-difference finite-volume lattice Boltzmann method and the compact finite-difference lattice Boltzmann method. It is shown that the present numerical scheme is robust, efficient, and accurate for solving steady and unsteady incompressible flows even at high Reynolds number flows.
Institute of Scientific and Technical Information of China (English)
Zhen-Hua Chai; Tian-Shou Zhao
2012-01-01
In this paper,a pseudopotential-based multiplerelaxation-time lattice Boltzmann model is proposed for multicomponent/multiphase flow systems.Unlike previous models in the literature,the present model not only enables the study of multicomponent flows with different molecular weights,different viscosities and different Schmidt numbers,but also ensures that the distribution function of each component evolves on the same square lattice without invoking additional interpolations.Furthermore,the Chapman-Enskog analysis shows that the present model results in the correct hydrodynamic equations,and satisfies the indifferentiability principle.The numerical validation exercises further demonstrate that the favorable performance of the present model.
Field-wide flow simulation in fractured porous media within lattice Boltzmann framework
Benamram, Z.; Tarakanov, A.; Nasrabadi, H.; Gildin, E.
2016-10-01
In this paper, a generalized lattice Boltzmann model for simulating fluid flow in porous media at the representative volume element scale is extended towards applications of hydraulically and naturally fractured reservoirs. The key element within the model is the development of boundary conditions for a vertical well and horizontal fracture with minimal node usage. In addition, the governing non-dimensional equations are derived and a new set of dimensionless numbers are presented for the simulation of a fractured reservoir system. Homogenous and heterogeneous vertical well and fracture systems are simulated and verified against commercial reservoir simulation suites. Results are in excellent agreement to analytical and finite difference solutions.
Classification of Sets using Restricted Boltzmann Machines
Louradour, Jérôme
2011-01-01
We consider the problem of classification when inputs correspond to sets of vectors. This setting occurs in many problems such as the classification of pieces of mail containing several pages, of web sites with several sections or of images that have been pre-segmented into smaller regions. We propose generalizations of the restricted Boltzmann machine (RBM) that are appropriate in this context and explore how to incorporate different assumptions about the relationship between the input sets and the target class within the RBM. In experiments on standard multiple-instance learning datasets, we demonstrate the competitiveness of approaches based on RBMs and apply the proposed variants to the problem of incoming mail classification.
Lattice Boltzmann modeling of water entry problems
Zarghami, A.; Falcucci, G.; Jannelli, E.; Succi, S.; Porfiri, M.; Ubertini, S.
2014-12-01
This paper deals with the simulation of water entry problems using the lattice Boltzmann method (LBM). The dynamics of the free surface is treated through the mass and momentum fluxes across the interface cells. A bounce-back boundary condition is utilized to model the contact between the fluid and the moving object. The method is implemented for the analysis of a two-dimensional flow physics produced by a symmetric wedge entering vertically a weakly-compressible fluid at a constant velocity. The method is used to predict the wetted length, the height of water pile-up, the pressure distribution and the overall force on the wedge. The accuracy of the numerical results is demonstrated through comparisons with data reported in the literature.
Training Restricted Boltzmann Machines on Word Observations
Dahl, George E; Larochelle, Hugo
2012-01-01
The restricted Boltzmann machine (RBM) is a flexible tool for modeling complex data, however there have been significant computational difficulties in using RBMs to model high-dimensional multinomial observations. In natural language processing applications, words are naturally modeled by K-ary discrete distributions, where K is determined by the vocabulary size and can easily be in the hundred thousands. The conventional approach to training RBMs on word observations is limited because it requires sampling the states of K-way softmax visible units during block Gibbs updates, an operation that takes time linear in K. In this work, we address this issue by employing a more general class of Markov chain Monte Carlo operators on the visible units, yielding updates with computational complexity independent of K. We demonstrate the success of our approach by training RBMs on hundreds of millions of word n-grams using larger vocabularies than previously feasible with RBMs and using the learned features to improve p...
Boltzmann babies in the proper time measure
Energy Technology Data Exchange (ETDEWEB)
Bousso, Raphael; Bousso, Raphael; Freivogel, Ben; Yang, I-Sheng
2007-12-20
After commenting briefly on the role of the typicality assumption in science, we advocate a phenomenological approach to the cosmological measure problem. Like any other theory, a measure should be simple, general, well defined, and consistent with observation. This allows us to proceed by elimination. As an example, we consider the proper time cutoff on a geodesic congruence. It predicts that typical observers are quantum fluctuations in the early universe, or Boltzmann babies. We sharpen this well-known youngness problem by taking into account the expansion and open spatial geometry of pocket universes. Moreover, we relate the youngness problem directly to the probability distribution for observables, such as the temperature of the cosmic background radiation. We consider a number of modifications of the proper time measure, but find none that would make it compatible with observation.
The Lattice Boltzmann method principles and practice
Krüger, Timm; Kuzmin, Alexandr; Shardt, Orest; Silva, Goncalo; Viggen, Erlend Magnus
2017-01-01
This book is an introduction to the theory, practice, and implementation of the Lattice Boltzmann (LB) method, a powerful computational fluid dynamics method that is steadily gaining attention due to its simplicity, scalability, extensibility, and simple handling of complex geometries. The book contains chapters on the method's background, fundamental theory, advanced extensions, and implementation. To aid beginners, the most essential paragraphs in each chapter are highlighted, and the introductory chapters on various LB topics are front-loaded with special "in a nutshell" sections that condense the chapter's most important practical results. Together, these sections can be used to quickly get up and running with the method. Exercises are integrated throughout the text, and frequently asked questions about the method are dealt with in a special section at the beginning. In the book itself and through its web page, readers can find example codes showing how the LB method can be implemented efficiently on a va...
Lattice Boltzmann model for resistive relativistic magnetohydrodynamics
Mohseni, F; Succi, S; Herrmann, H J
2015-01-01
In this paper, we develop a lattice Boltzmann model for relativistic magnetohydrodynamics (MHD). Even though the model is derived for resistive MHD, it is shown that it is numerically robust even in the high conductivity (ideal MHD) limit. In order to validate the numerical method, test simulations are carried out for both ideal and resistive limits, namely the propagation of Alfv\\'en waves in the ideal MHD and the evolution of current sheets in the resistive regime, where very good agreement is observed comparing to the analytical results. Additionally, two-dimensional magnetic reconnection driven by Kelvin-Helmholtz instability is studied and the effects of different parameters on the reconnection rate are investigated. It is shown that the density ratio has negligible effect on the magnetic reconnection rate, while an increase in shear velocity decreases the reconnection rate. Additionally, it is found that the reconnection rate is proportional to $\\sigma^{-\\frac{1}{2}}$, $\\sigma$ being the conductivity, w...
Ordinal Boltzmann Machines for Collaborative Filtering
Truyen, Tran The; Venkatesh, Svetha
2012-01-01
Collaborative filtering is an effective recommendation technique wherein the preference of an individual can potentially be predicted based on preferences of other members. Early algorithms often relied on the strong locality in the preference data, that is, it is enough to predict preference of a user on a particular item based on a small subset of other users with similar tastes or of other items with similar properties. More recently, dimensionality reduction techniques have proved to be equally competitive, and these are based on the co-occurrence patterns rather than locality. This paper explores and extends a probabilistic model known as Boltzmann Machine for collaborative filtering tasks. It seamlessly integrates both the similarity and co-occurrence in a principled manner. In particular, we study parameterisation options to deal with the ordinal nature of the preferences, and propose a joint modelling of both the user-based and item-based processes. Experiments on moderate and large-scale movie recomm...
Flux Limiter Lattice Boltzmann for Compressible Flows
Institute of Scientific and Technical Information of China (English)
陈峰; 许爱国; 张广财; 李英骏
2011-01-01
In this paper, a new flux limiter scheme with the splitting technique is successfully incorporated into a multiple-relaxation-time lattice Boltzmann （LB） model for shacked compressible flows. The proposed flux limiter scheme is efficient in decreasing the artificial oscillations and numerical diffusion around the interface. Due to the kinetic nature, some interface problems being difficult to handle at the macroscopic level can be modeled more naturally through the LB method. Numerical simulations for the Richtmyer-Meshkov instability show that with the new model the computed interfaces are smoother and more consistent with physical analysis. The growth rates of bubble and spike present a satisfying agreement with the theoretical predictions and other numerical simulations.
Poisson-Boltzmann thermodynamics of counterions confined by curved hard walls
Šamaj, Ladislav; Trizac, Emmanuel
2016-01-01
We consider a set of identical mobile pointlike charges (counterions) confined to a domain with curved hard walls carrying a uniform fixed surface charge density, the system as a whole being electroneutral. Three domain geometries are considered: a pair of parallel plates, the cylinder, and the sphere. The particle system in thermal equilibrium is assumed to be described by the nonlinear Poisson-Boltzmann theory. While the effectively one-dimensional plates and the two-dimensional cylinder have already been solved, the three-dimensional sphere problem is not integrable. It is shown that the contact density of particles at the charged surface is determined by a first-order Abel differential equation of the second kind which is a counterpart of Enig's equation in the critical theory of gravitation and combustion or explosion. This equation enables us to construct the exact series solutions of the contact density in the regions of small and large surface charge densities. The formalism provides, within the mean-field Poisson-Boltzmann framework, the complete thermodynamics of counterions inside a charged sphere (salt-free system).
Erik M. Salomons; Lohman, Walter J. A.; Han Zhou
2016-01-01
Propagation of sound waves in air can be considered as a special case of fluid dynamics. Consequently, the lattice Boltzmann method (LBM) for fluid flow can be used for simulating sound propagation. In this article application of the LBM to sound propagation is illustrated for various cases: free-field propagation, propagation over porous and non-porous ground, propagation over a noise barrier, and propagation in an atmosphere with wind. LBM results are compared with solutions of the equation...
Simulation of Rayleigh-Bénard convection using lattice Boltzmann method
Shan, X
1996-01-01
Rayleigh-Bénard convection is numerically simulated in two- and three-dimensions using a recently developed two-component lattice Boltzmann equation (LBE) method. The density field of the second component, which evolves according to the advection-diffusion equation of a passive-scalar, is used to simulate the temperature field. A body force proportional to the temperature is applied, and the system satisfies the Boussinesq equation except for a slight compressibility. A no-slip, isothermal boundary condition is imposed in the vertical direction, and periodic boundary conditions are used in horizontal directions. The critical Rayleigh number for the onset of the Rayleigh-Bénard convection agrees with the theoretical prediction. As the Rayleigh number is increased higher, the steady two-dimensional convection rolls become unstable. The wavy instability and aperiodic motion observed, as well as the Nusselt number as a function of the Rayleigh number, are in good agreement with experimental observations and the...
Chen, Li; Zhang, Lei; Tao, Wenquan
2014-01-01
Size, morphology and distributions of pores in organic matters of shale matrix are discussed based on high resolution images from experiments in the literature. 150 nanoscale structures of the organic matters are then reconstructed by randomly placing pore spheres with different diameters and overlap tolerances. Effects of porosity, the mean diameter and the overlap tolerance on void space connectivity and pore size distribution are studied. Further, a pore-scale model based on the Lattice Boltzmann method is developed to predict the Knudsen diffusivity and permeability of the reconstructed organic matters. The simulation results show that the mean pore diameter and overlap tolerance significantly affect the transport properties. The predicted Knudsen effective diffusivity is compared with Bruggeman equation and it is found that this equation underestimate the tortuosity. A modified Bruggeman equation is proposed based on the simulation results. The predicted intrinsic permeability is in acceptable agreement ...
The Approach to Equilibrium: Detailed Balance and the Master Equation
Alexander, Millard H.; Hall, Gregory E.; Dagdigian, Paul J.
2011-01-01
The approach to the equilibrium (Boltzmann) distribution of populations of internal states of a molecule is governed by inelastic collisions in the gas phase and with surfaces. The set of differential equations governing the time evolution of the internal state populations is commonly called the master equation. An analytic solution to the master…
Directory of Open Access Journals (Sweden)
Haiqing Si
2015-03-01
Full Text Available Lattice Boltzmann method combined with large eddy simulation is developed in the article to simulate fluid flow at high Reynolds numbers. A subgrid model is used as a large eddy simulation model in the numerical simulation for high Reynolds flow. The idea of subgrid model is based on an assumption to include the physical effects that the unresolved motion has on the resolved fluid motion. It takes a simple form of eddy viscosity models for the Reynolds stress. Lift and drag evaluation in the lattice Boltzmann equation takes momentum-exchange method for curved body surface. First of all, the present numerical method is validated at low Reynolds numbers. Second, the developed lattice Boltzmann method/large eddy simulation method is performed to solve flow problems at high Reynolds numbers. Some detailed quantitative comparisons are implemented to show the effectiveness of the present method. It is demonstrated that lattice Boltzmann method combined with large eddy simulation model can efficiently simulate high Reynolds numbers’ flows.
Mei, Ren-Wei; Shyy, Wei; Yu, Da-Zhi; Luo, Li-Shi; Rudy, David (Technical Monitor)
2001-01-01
The lattice Boltzmann equation (LBE) is a kinetic formulation which offers an alternative computational method capable of solving fluid dynamics for various systems. Major advantages of the method are owing to the fact that the solution for the particle distribution functions is explicit, easy to implement, and the algorithm is natural to parallelize. In this final report, we summarize the works accomplished in the past three years. Since most works have been published, the technical details can be found in the literature. Brief summary will be provided in this report. In this project, a second-order accurate treatment of boundary condition in the LBE method is developed for a curved boundary and tested successfully in various 2-D and 3-D configurations. To evaluate the aerodynamic force on a body in the context of LBE method, several force evaluation schemes have been investigated. A simple momentum exchange method is shown to give reliable and accurate values for the force on a body in both 2-D and 3-D cases. Various 3-D LBE models have been assessed in terms of efficiency, accuracy, and robustness. In general, accurate 3-D results can be obtained using LBE methods. The 3-D 19-bit model is found to be the best one among the 15-bit, 19-bit, and 27-bit LBE models. To achieve desired grid resolution and to accommodate the far field boundary conditions in aerodynamics computations, a multi-block LBE method is developed by dividing the flow field into various blocks each having constant lattice spacing. Substantial contribution to the LBE method is also made through the development of a new, generalized lattice Boltzmann equation constructed in the moment space in order to improve the computational stability, detailed theoretical analysis on the stability, dispersion, and dissipation characteristics of the LBE method, and computational studies of high Reynolds number flows with singular gradients. Finally, a finite difference-based lattice Boltzmann method is
Hu, Yang; Li, Decai; Shu, Shi; Niu, Xiaodong
2016-02-01
Based on the Darcy-Brinkman-Forchheimer equation, a finite-volume computational model with lattice Boltzmann flux scheme is proposed for incompressible porous media flow in this paper. The fluxes across the cell interface are calculated by reconstructing the local solution of the generalized lattice Boltzmann equation for porous media flow. The time-scaled midpoint integration rule is adopted to discretize the governing equation, which makes the time step become limited by the Courant-Friedricks-Lewy condition. The force term which evaluates the effect of the porous medium is added to the discretized governing equation directly. The numerical simulations of the steady Poiseuille flow, the unsteady Womersley flow, the circular Couette flow, and the lid-driven flow are carried out to verify the present computational model. The obtained results show good agreement with the analytical, finite-difference, and/or previously published solutions.
Permit Allocation in Emissions Trading using the Boltzmann Distribution
Park, Ji-Won; Isard, Walter
2011-01-01
In emissions trading, the initial permit allocation is an intractable issue because it needs to be essentially fair to the participating countries. There are many ways to distribute a given total amount of emissions permits among countries, but the existing distribution methods such as auctioning and grandfathering have been debated. Here we describe a new model for permit allocation in emissions trading using the Boltzmann distribution. The Boltzmann distribution is introduced to permit allocation by combining it with concepts in emissions trading. A price determination mechanism for emission permits is then developed in relation to the {\\beta} value in the Boltzmann distribution. Finally, it is demonstrated how emissions permits can be practically allocated among participating countries in empirical results. The new allocation model using the Boltzmann distribution describes a most probable, natural, and unbiased distribution of emissions permits among multiple countries. Based on its simplicity and versati...
Lattice Boltzmann modeling of directional wetting: Comparing simulations to experiments
Jansen, H.P.; Sotthewes, K.; Swigchem, van J.; Zandvliet, H.J.W.; Kooij, E.S.
2013-01-01
Lattice Boltzmann Modeling (LBM) simulations were performed on the dynamic behavior of liquid droplets on chemically striped patterned surfaces, ultimately with the aim to develop a predictive tool enabling reliable design of future experiments. The simulations accurately mimic experimental results,
A new lattice Boltzmann model for incompressible magnetohydrodynamics
Institute of Scientific and Technical Information of China (English)
Chen Xing-Wang; Shi Bao-Chang
2005-01-01
Most of the existing lattice Boltzmann magnetohydrodynamics (MHD) models can be viewed as compressible schemes to simulate incompressible MHD flows. The compressible effect might lead to some undesired errors in numerical simulations. In this paper a new incompressible lattice Boltzmann MHD model without compressible effect is presented for simulating incompressible MHD flows. Numerical simulations of the Hartmann flow are performed. We do numerous tests and make comparison with Dellar's model in detail. The numerical results are in good agreement with the analytical error.
Boltzmann Samplers for v-balanced Colored Necklaces
Bodini, Olivier
2009-01-01
This paper is devoted to the random generation of particular colored necklaces for which the number of beads of a given color is constrained (these necklaces are called v-balanced). We propose an efficient sampler (its expected time complexity is linear) which satisfies the Boltzmann model principle introduced by Duchon, Flajolet, Louchard and Schaeffer. Our main motivation is to show that the absence of a decomposable specification can be circumvented by mixing the Boltzmann samplers with other types of samplers.
KOMPUTASI DISTRIBUSI NEUTRON DALAM STATISTIK MAXWELL BOLTZMANN
Directory of Open Access Journals (Sweden)
Tuti Purwoningsih
2013-03-01
Full Text Available The migration of neutron is arranged by some probability distributions such as probability of spread distribution, probability of distance distribution, probability of energy distribution and probability of flux distribution. One application of these pattern distributions is modelling the reaction between neutron and elements which compose the tissue related to the absorption of neutron in brain cancer tissues. This article explores computation analysis of pattern of distribution of neutron flux in a reactor system. Variables were the amount of neutron simulated and the depth of cylindrical reactor system. Simulations showed that 20-120 minutes was needed in executing 100,000 neutrons to build the distribution pattern of neutrons flux. This pattern was also depended on the depth of the system. In all depths, the peak of neutron flux distribution pattern was in the 3rd bin. Comparison between this simulations and experiment results in literatures showed that by analyzing the simulation of the distribution of neutron flux, a Poisson distribution which follows the Maxwell-Boltzmann was resulted. Perpindahan neutron diatur dengan beberapa peluang distribusi, seperti peluang distribusi sudut hamburan, peluang distribusi jarak perpindahan, peluang distribusi energi transfer, serta peluang distribusi fluks neutron. Salah satu aplikasi dari pola distribusi ini adalah pemodelan reaksi antara neutron dengan elemen-elemen penyusun jaringan yang terkait dengan serapan neutron dan dosis yang terserap oleh jaringan tumor otak pada terapi BNCT (Boron Neutron Capture Therapy. Dalam penelitian ini dibahas analisis komputasi tentang pola distribusi fluks neutron dalam suatu sistem reaktor. Variabel dalam penelitian ini adalah banyaknya neutron yang disimulasikan, serta kedalaman sistem reaktor yang dalam penelitian ini menggunakan sistem reaktor berbentuk silinder. Hasil simulasi menunjukkan bahwa dengan neutron sebanyak 100.000 diperlukan waktu eksekusi sekitar
Nonequilibrium Spin Magnetization Quantum Transport Equations
Buot, F A; Otadoy, R E S; Villarin, D L
2011-01-01
The classical Bloch equations of spin magnetization transport is extended to fully time-dependent and highly-nonlinear nonequilibrium quantum distribution function (QDF) transport equations. The leading terms consist of the Boltzmann kinetic equation with spin-orbit coupling in a magnetic field together with spin-dependent scattering terms which do not have any classical analogue, but should incorporate the spatio-temporal-dependent phase-space dynamics of Elliot-Yafet and D'yakonov-Perel scatterings. The resulting magnetization QDF transport equation serves as a foundation for computational spintronic and nanomagnetic device applications, in performing simulation of ultrafast-switching-speed/low-power performance and reliability analyses.
Third-order analysis of pseudopotential lattice Boltzmann model for multiphase flow
Huang, Rongzong
2016-01-01
In this work, a third-order Chapman-Enskog analysis of the multiple-relaxation-time (MRT) pseudopotential lattice Boltzmann (LB) model for multiphase flow is performed for the first time. The leading terms on the interaction force, consisting of an anisotropic and an isotropic term, are successfully identified in the third-order macroscopic equation recovered by the lattice Boltzmann equation (LBE), and then new mathematical insights into the pseudopotential LB model are provided. For the third-order anisotropic term, numerical tests show that it can cause the stationary droplet to become out-of-round, which suggests the isotropic property of the LBE needs to be seriously considered in the pseudopotential LB model. By adopting the classical equilibrium moment or setting the so-called "magic" parameter to 1/12, the anisotropic term can be eliminated, which is found from the present third-order analysis and also validated numerically. As for the third-order isotropic term, when and only when it is considered, a...
An improved lattice Boltzmann scheme for multiphase fluid with multi-range interactions
Energy Technology Data Exchange (ETDEWEB)
Maquignon, Nicolas; Duchateau, Julien; Roussel, Gilles; Rousselle, François; Renaud, Christophe [Laboratoire Informatique Signal et Image de la Côte d' Opale, 50 rue Ferdinand Buisson, 62100 Calais (France); Université du Littoral Côte d' Opale, 1 place de l' Yser, 59140, Dunkerque (France); Association INNOCOLD, MREI 1, 145 (France)
2014-10-06
Modeling of fluids with liquid to gas phase transition has become important for understanding many environmental or industrial processes. Such simulations need new techniques, because traditional solvers are often limited. The Lattice Boltzmann Model (LBM) allows simulate complex fluids, because its mesoscopic nature gives possibility to incorporate additional physics in comparison to usual methods. In this work, an improved lattice Boltzmann model for phase transition flow will be introduced. First, the state of art for Shan and Chen (SC) type of LBM will be reminded. Then, link to real thermodynamics will be established with Maxwell equal areas construction. Convergence to isothermal liquid vapor equilibrium will be shown and discussed. Inclusion of an equation of state for real fluid and better incorporation of force term is presented. Multi-range interactions have been used for SC model, but it hasn't been yet applied to real fluid with non-ideal equation of state. In this work, we evaluate this model when it is applied to real liquid-vapor equilibrium. We show that important differences are found for evaluation of gas density. In order to recover thermodynamic consistency, we use a new scheme for calculation of force term, which is a combination of multi range model and numerical weighting used by Gong and Cheng. We show the superiority of our new model by studying convergence to equilibrium values over a large temperature range. We prove that spurious velocities remaining at equilibrium are decreased.
Atanasov, Atanas Todorov
2016-12-01
The unicellular organisms and phages are the first appeared fundamental living organisms on the Earth. The total metabolic energy (Els, J) of these organisms can be expressed by their lifespan metabolic potential (Als, J/kg) and body mass (M, kg): Els =Als M. In this study we found a different expression - by Boltzmann's constant (k, J/K), nucleon mass (mp+, kg) of protons (and neutrons), body mass (M, kg) of organism or mass (Ms) of biomolecules (proteins, nucleotides, polysaccharides and lipids) building organism, and the absolute temperature (T, K). The found equations are: Els= (M/mp+)kT for phages and Els=(Ms/mp+)kT for the unicellular organisms. From these equations the lifespan metabolic potential can be expressed as: Als=Els/M= (k/mp+)T for phages and Als=Els/M= (k/3.3mp+)T for unicellular organisms. The temperature-normated lifespan metabolic potential (Als/T, J/K.kg) is equals to the ratio between Boltzmann's constant and nucleon mass: Als/T=k/mp+ for phages and Als/T=k/3.3mp+ for unicellular organisms. The numerical value of the k/mp+ ratio is equals to 8.254×103 J/K.kg, and the numerical value of k/3.3mp+ ratio is equal to 2.497×103 J/K.kg. These values of temperature-normated lifespan metabolic potential could be considered fundamental for the unicellular organisms.
Features of CPB: a Poisson-Boltzmann solver that uses an adaptive Cartesian grid.
Fenley, Marcia O; Harris, Robert C; Mackoy, Travis; Boschitsch, Alexander H
2015-02-05
The capabilities of an adaptive Cartesian grid (ACG)-based Poisson-Boltzmann (PB) solver (CPB) are demonstrated. CPB solves various PB equations with an ACG, built from a hierarchical octree decomposition of the computational domain. This procedure decreases the number of points required, thereby reducing computational demands. Inside the molecule, CPB solves for the reaction-field component (ϕrf ) of the electrostatic potential (ϕ), eliminating the charge-induced singularities in ϕ. CPB can also use a least-squares reconstruction method to improve estimates of ϕ at the molecular surface. All surfaces, which include solvent excluded, Gaussians, and others, are created analytically, eliminating errors associated with triangulated surfaces. These features allow CPB to produce detailed surface maps of ϕ and compute polar solvation and binding free energies for large biomolecular assemblies, such as ribosomes and viruses, with reduced computational demands compared to other Poisson-Boltzmann equation solvers. The reader is referred to http://www.continuum-dynamics.com/solution-mm.html for how to obtain the CPB software.
Lattice Boltzmann model for resistive relativistic magnetohydrodynamics.
Mohseni, F; Mendoza, M; Succi, S; Herrmann, H J
2015-08-01
In this paper, we develop a lattice Boltzmann model for relativistic magnetohydrodynamics (MHD). Even though the model is derived for resistive MHD, it is shown that it is numerically robust even in the high conductivity (ideal MHD) limit. In order to validate the numerical method, test simulations are carried out for both ideal and resistive limits, namely the propagation of Alfvén waves in the ideal MHD and the evolution of current sheets in the resistive regime, where very good agreement is observed comparing to the analytical results. Additionally, two-dimensional magnetic reconnection driven by Kelvin-Helmholtz instability is studied and the effects of different parameters on the reconnection rate are investigated. It is shown that the density ratio has a negligible effect on the magnetic reconnection rate, while an increase in shear velocity decreases the reconnection rate. Additionally, it is found that the reconnection rate is proportional to σ-1/2, σ being the conductivity, which is in agreement with the scaling law of the Sweet-Parker model. Finally, the numerical model is used to study the magnetic reconnection in a stellar flare. Three-dimensional simulation suggests that the reconnection between the background and flux rope magnetic lines in a stellar flare can take place as a result of a shear velocity in the photosphere.
Accurate lineshape spectroscopy and the Boltzmann constant.
Truong, G-W; Anstie, J D; May, E F; Stace, T M; Luiten, A N
2015-10-14
Spectroscopy has an illustrious history delivering serendipitous discoveries and providing a stringent testbed for new physical predictions, including applications from trace materials detection, to understanding the atmospheres of stars and planets, and even constraining cosmological models. Reaching fundamental-noise limits permits optimal extraction of spectroscopic information from an absorption measurement. Here, we demonstrate a quantum-limited spectrometer that delivers high-precision measurements of the absorption lineshape. These measurements yield a very accurate measurement of the excited-state (6P1/2) hyperfine splitting in Cs, and reveals a breakdown in the well-known Voigt spectral profile. We develop a theoretical model that accounts for this breakdown, explaining the observations to within the shot-noise limit. Our model enables us to infer the thermal velocity dispersion of the Cs vapour with an uncertainty of 35 p.p.m. within an hour. This allows us to determine a value for Boltzmann's constant with a precision of 6 p.p.m., and an uncertainty of 71 p.p.m.
Genuinely Multidimensional Kinetic Scheme For Euler Equations
Tiwari, Praveer
2015-01-01
A new framework based on Boltzmann equation which is genuinely multidimensional and mesh-less is developed for solving Euler's equations. The idea is to use the method of moment of Boltzmann equation to operate in multidimensions using polar coordinates. The aim is to develop a framework which is genuinely multidimensional and can be implemented with different methodologies, no matter whether it is in finite difference, finite volume or finite element form. There is a considerable improvement in capturing shocks and other discontinuities. Also, since the method is multidimensional, the flow features are captured isotropically. The method is further extended to second order using 'Arc of Approach' concept. The framework is developed as a finite difference method (called as GINEUS) and is tested on the benchmark test cases. The results are compared against Kinetic Flux Vector Splitting Method.
Boltzmann analyses of swarm experiments over the years
Pitchford, Leanne
2013-09-01
Art Phelps was one of the ``grand old men'' in field of gaseous electronics. He was a graduate student when the GEC got started and he attended almost all of the meetings over the years. During his remarkably long career, he produced a number of the classic papers in our field as a glance at Web of Science will show. Art was my mentor and friend, and I had the privilege of working with him for many years on various topics related mainly to electron scattering and transport in weakly ionized gases. In this talk, I will discuss the originality of some of his early work on these subjects in the context of their times, focusing in particular on his publications from the mid-1960's with his colleagues from Westinghouse Research Laboratories. These report the first numerical solutions of the Boltzmann equation for electrons, to my knowledge, and they inspired much subsequent work related to the extraction of quantitative information about low-energy electron scatting with simple gases from measurements of macroscopic parameters (mobility, diffusion,..). I will outline some of the work he and I did together in this topical area using more sophisticated numerical techniques. This and other work in the field eventually led to the establishment of the ongoing GEC Plasma Data Exchange Project which now involves a number of people (the LXCat team), as discussed in Tuesday's workshop. The LXCat team had completed work on noble gases and had just started working on evaluations of cross sections for simple molecules when Art died. We are fortunate to have had his involvement on these projects. Art had ideas for future work in these areas, and some are included in a long e-mail message from Art a couple of years ago that I will share because it includes some suggestions [to the community] for future work.
Lattice Boltzmann Simulations for High Density Ratio Flows of Multiphase Fluids
Wei, Yikun; Qian, Yuehong
2010-11-01
In the present communication, we will show that the compression effect of the Redlich-Kwong equation of state(EOS) is lower than that of the van der Waals (vdW) EOS. The Redlich-Kwong equation of state has a better agreement with experimental data for the coexistence curve than the van derWaals (vdW) EOS. We implement the Redlich-Kwong EOS in the lattice Boltzmann simulations via a pseudo-potential. As a result, multi-phase flows with large density ratios may be simulated, thus many real applications in engineering problems can be applied. Acknowledgement: This research is supported in part by Ministry of Education in China via project IRT0844 and NSFC project 10625210 and Shanghai Sci and Tech. Com. Project 08ZZ43
Wind-Driven Ocean Circulation in Shallow Water Lattice Boltzmann Model
Institute of Scientific and Technical Information of China (English)
ZHONG Linhao; FENG Shide; GAO Shouting
2005-01-01
A lattice Boltzmann (LB) model with overall second-order accuracy is applied to the 1.5-layer shallow water equation for a wind-driven double-gyre ocean circulation. By introducing the second-order integral approximation for the collision operator, the model becomes fully explicit. In this case, any iterative technique is not needed. The Coriolis force and other external forces are included in the model with second-order accuracy, which is consistent with the discretized accuracy of the LB equation. The numerical results show correct physics of the ocean circulation driven by the double-gyre wind stress with different Reynolds numbers and different spatial resolutions. An intrinsic low-frequency variability of the shallow water model is also found. The wind-driven ocean circulation exhibits subannual and interannual oscillations, which are comparable to those of models in which the conventional numerical methods are used.
Hafez, M. G.; Talukder, M. R.
2015-09-01
This work investigates the theoretical and numerical studies on nonlinear propagation of ion acoustic solitary waves (IASWs) in an unmagnetized plasma consisting of nonextensive electrons, Boltzmann positrons and relativistic thermal ions. The Korteweg-de Vries (KdV) equation is derived by using the well known reductive perturbation method. This equation admits the soliton like solitary wave solution. The effects of phase velocity, amplitude of soliton, width of soliton and electrostatic nonlinear propagation of weakly relativistic ion-acoustic solitary waves have been discussed with graphical representation found in the variation of the plasma parameters. The obtained results can be helpful in understanding the features of small but finite amplitude localized relativistic ion-acoustic waves for an unmagnetized three component plasma system in astrophysical compact objects.
Additional interfacial force in lattice Boltzmann models for incompressible multiphase flows
Li, Q; Gao, Y J
2011-01-01
The existing lattice Boltzmann models for incompressible multiphase flows are mostly constructed with two distribution functions, one is the order parameter distribution function, which is used to track the interface between different phases, and the other is the pressure distribution function for solving the velocity field. In this brief report, it is shown that in these models the recovered momentum equation is inconsistent with the target one: an additional interfacial force is included in the recovered momentum equation. The effects of the additional force are investigated by numerical simulations of droplet splashing on a thin liquid film and falling droplet under gravity. In the former test, it is found that the formation and evolution of secondary droplets are greatly affected, while in the latter the additional force is found to increase the falling velocity and limit the stretch of the droplet.
Lattice-Boltzmann-based two-phase thermal model for simulating phase change.
Kamali, M R; Gillissen, J J J; van den Akker, H E A; Sundaresan, Sankaran
2013-09-01
A lattice Boltzmann (LB) method is presented for solving the energy conservation equation in two phases when the phase change effects are included in the model. This approach employs multiple distribution functions, one for a pseudotemperature scalar variable and the rest for the various species. A nonideal equation of state (EOS) is introduced by using a pseudopotential LB model. The evolution equation for the pseudotemperature variable is constructed in such a manner that in the continuum limit one recovers the well known macroscopic energy conservation equation for the mixtures. Heats of reaction, the enthalpy change associated with the phase change, and the diffusive transport of enthalpy are all taken into account; but the dependence of enthalpy on pressure, which is usually a small effect in most nonisothermal flows encountered in chemical reaction systems, is ignored. The energy equation is coupled to the LB equations for species transport and pseudopotential interaction forces through the EOS by using the filtered local pseudotemperature field. The proposed scheme is validated against simple test problems for which analytical solutions can readily be obtained.
Coclite, Alessandro; Pascazio, Giuseppe; Decuzzi, Paolo
2016-01-01
Modelling the vascular transport and adhesion of man-made particles is crucial for optimizing their efficacy in the detection and treatment of diseases. Here, a Lattice Boltzmann and Immersed Boundary methods are combined together for predicting the near wall dynamics of particles with different shapes in a laminar flow. For the lattice Boltzmann modelling, a Gauss-Hermite projection is used to derive the lattice equation, wall boundary conditions are imposed through the Zou-He framework, and a moving least squares algorithm accurately reconstructs the forcing term accounting for the immersed boundary. First, the computational code is validated against two well-known test cases: the sedimentation of circular and elliptical cylinders in a quiescent fluid. A very good agreement is observed between the present results and those available in the literature. Then, the transport of circular, elliptical, rectangular, square and triangular particles is analyzed in a Couette flow, at Re=20. All particles drifted later...
Dupuis, Alexandre; Chatelain, Philippe; Koumoutsakos, Petros
2008-04-01
We present a lattice-Boltzmann method coupled with an immersed boundary technique for the simulation of bluff body flows. The lattice-Boltzmann method for the modeling of the Navier-Stokes equations, is enhanced by a forcing term to account for the no-slip boundary condition on a non-grid conforming boundary. We investigate two alternatives of coupling the boundary forcing term with the grid nodes, namely the direct and the interpolated forcing techniques. The present LB-IB methods are validated in simulations of the incompressible flow past an impulsively started cylinder at low and moderate Reynolds numbers. We present diagnostics such as the near wall vorticity field and the drag coefficient and comparisons with previous computational and experimental works and assess the advantages and drawbacks of the two techniques.
Liu, Qing; He, Ya-Ling
2015-11-01
In this paper, a double multiple-relaxation-time lattice Boltzmann model is developed for simulating transient solid-liquid phase change problems in porous media at the representative elementary volume scale. The model uses two different multiple-relaxation-time lattice Boltzmann equations, one for the flow field and the other for the temperature field with nonlinear latent heat source term. The model is based on the generalized non-Darcy formulation, and the solid-liquid interface is traced through the liquid fraction which is determined by the enthalpy-based method. The present model is validated by numerical simulations of conduction melting in a semi-infinite space, solidification in a semi-infinite corner, and convection melting in a square cavity filled with porous media. The numerical results demonstrate the efficiency and accuracy of the present model for simulating transient solid-liquid phase change problems in porous media.
Liu, Qing
2015-01-01
In this paper, a double multiple-relaxation-time lattice Boltzmann model is developed for simulating transient solid-liquid phase change problems in porous media at the representative elementary volume scale. The model uses two different multiple-relaxation-time lattice Boltzmann equations, one for the flow field and the other for the temperature field with nonlinear latent heat source term. The model is based on the generalized non-Darcy formulation, and the solid-liquid phase change interface is traced through the liquid fraction which is determined by the enthalpy method. The model is validated by numerical simulations of conduction melting in a semi-infinite space, solidification in a semi-infinite corner, and convection melting in a square cavity filled with porous media. The numerical results demonstrate the efficiency and accuracy of the present model for simulating transient solid-liquid phase change problems in porous media.
An integrated Boltzmann+hydrodynamics approach to heavy ion collisions
Energy Technology Data Exchange (ETDEWEB)
Petersen, Hannah
2009-04-22
In this thesis the first fully integrated Boltzmann+hydrodynamics approach to relativistic heavy ion reactions has been developed. After a short introduction that motivates the study of heavy ion reactions as the tool to get insights about the QCD phase diagram, the most important theoretical approaches to describe the system are reviewed. The hadron-string transport approach that this work is based on is the Ultra-relativistic Quantum Molecular Dynamics (UrQMD) approach. Predictions for the charged particle multiplicities at LHC energies are made. The next step is the development of a new framework to calculate the baryon number density in a transport approach. Time evolutions of the net baryon number and the quark density have been calculated at AGS, SPS and RHIC energies. Studies of phase diagram trajectories using hydrodynamics are performed. The hybrid approach that has been developed as the main part of this thesis is based on the UrQMD transport approach with an intermediate hydrodynamical evolution for the hot and dense stage of the collision. The full (3+1) dimensional ideal relativistic one fluid dynamics evolution is solved using the SHASTA algorithm. Three different equations of state have been used, namely a hadron gas equation of state without a QGP phase transition, a chiral EoS and a bag model EoS including a strong first order phase transition. For the freeze-out transition from hydrodynamics to the cascade calculation two different set-ups are employed. The parameter dependences of the model are investigated and the time evolution of different quantities is explored. The hybrid model calculation is able to reproduce the experimentally measured integrated as well as transverse momentum dependent v{sub 2} values for charged particles. The multiplicity and mean transverse mass excitation function is calculated for pions, protons and kaons in the energy range from E{sub lab}=2-160 A GeV. The HBT correlation of the negatively charged pion source
Lattice Boltzmann Methods to Address Fundamental Boiling and Two-Phase Problems
Energy Technology Data Exchange (ETDEWEB)
Uddin, Rizwan
2012-01-01
This report presents the progress made during the fourth (no cost extension) year of this three-year grant aimed at the development of a consistent Lattice Boltzmann formulation for boiling and two-phase flows. During the first year, a consistent LBM formulation for the simulation of a two-phase water-steam system was developed. Results of initial model validation in a range of thermo-dynamic conditions typical for Boiling Water Reactors (BWRs) were shown. Progress was made on several fronts during the second year. Most important of these included the simulation of the coalescence of two bubbles including the surface tension effects. Work during the third year focused on the development of a new lattice Boltzmann model, called the artificial interface lattice Boltzmann model (AILB model) for the 3 simulation of two-phase dynamics. The model is based on the principle of free energy minimization and invokes the Gibbs-Duhem equation in the formulation of non-ideal forcing function. This was reported in detail in the last progress report. Part of the efforts during the last (no-cost extension) year were focused on developing a parallel capability for the 2D as well as for the 3D codes developed in this project. This will be reported in the final report. Here we report the work carried out on testing the AILB model for conditions including the thermal effects. A simplified thermal LB model, based on the thermal energy distribution approach, was developed. The simplifications are made after neglecting the viscous heat dissipation and the work done by pressure in the original thermal energy distribution model. Details of the model are presented here, followed by a discussion of the boundary conditions, and then results for some two-phase thermal problems.
Mahakrishnan, Sathiya; Chakraborty, Subrata; Vijay, Amrendra
2016-09-15
Diffusion, an emergent nonequilibrium transport phenomenon, is a nontrivial manifestation of the correlation between the microscopic dynamics of individual molecules and their statistical behavior observed in experiments. We present a thorough investigation of this viewpoint using the mathematical tools of quantum scattering, within the framework of Boltzmann transport theory. In particular, we ask: (a) How and when does a normal diffusive transport become anomalous? (b) What physical attribute of the system is conceptually useful to faithfully rationalize large variations in the coefficient of normal diffusion, observed particularly within the dynamical environment of biological cells? To characterize the diffusive transport, we introduce, analogous to continuous phase transitions, the curvature of the mean square displacement as an order parameter and use the notion of quantum scattering length, which measures the effective interactions between the diffusing molecules and the surrounding, to define a tuning variable, η. We show that the curvature signature conveniently differentiates the normal diffusion regime from the superdiffusion and subdiffusion regimes and the critical point, η = ηc, unambiguously determines the coefficient of normal diffusion. To solve the Boltzmann equation analytically, we use a quantum mechanical expression for the scattering amplitude in the Boltzmann collision term and obtain a general expression for the effective linear collision operator, useful for a variety of transport studies. We also demonstrate that the scattering length is a useful dynamical characteristic to rationalize experimental observations on diffusive transport in complex systems. We assess the numerical accuracy of the present work with representative experimental results on diffusion processes in biological systems. Furthermore, we advance the idea of temperature-dependent effective voltage (of the order of 1 μV or less in a biological environment, for example
Directory of Open Access Journals (Sweden)
Khoie R.
1996-01-01
Full Text Available A self-consistent Boltzmann-Poisson-Schrödinger solver for High Electron Mobility Transistor is presented. The quantization of electrons in the quantum well normal to the heterojunction is taken into account by solving the two higher moments of Boltzmann equation along with the Schrödinger and Poisson equations, self-consistently. The Boltzmann transport equation in the form of a current continuity equation and an energy balance equation are solved to obtain the transient and steady-state transport behavior. The numerical instability problems associated with the simulator are presented, and the criteria for smooth convergence of the solutions are discussed. The current-voltage characteristics, transconductance, gate capacitance, and unity-gain frequency of a single quantum well HEMT is discussed. It has been found that a HEMT device with a gate length of 0.7 μ m , and with a gate bias voltage of 0.625 V, has a transconductance of 579.2 mS/mm, which together with the gate capacitance of 19.28 pF/cm, can operate at a maximum unity-gain frequency of 47.8 GHz.
Directory of Open Access Journals (Sweden)
R. Khoie
1996-01-01
Full Text Available A self-consistent Boltzmann-Poisson-Schrödinger solver for High Electron Mobility Transistor is presented. The quantization of electrons in the quantum well normal to the heterojunction is taken into account by solving the two higher moments of Boltzmann equation along with the Schrödinger and Poisson equations, self-consistently. The Boltzmann transport equation in the form of a current continuity equation and an energy balance equation are solved to obtain the transient and steady-state transport behavior. The numerical instability problems associated with the simulator are presented, and the criteria for smooth convergence of the solutions are discussed. The current-voltage characteristics, transconductance, gate capacitance, and unity-gain frequency of a single quantum well HEMT is discussed. It has been found that a HEMT device with a gate length of 0.7 μm, and with a gate bias voltage of 0.625 V, has a transconductance of 579.2 mS/mm, which together with the gate capacitance of 19.28 pF/cm, can operate at a maximum unity-gain frequency of 47.8 GHz.
Fractional Diffusion Limit for Collisional Kinetic Equations
Mellet, Antoine
2010-08-20
This paper is devoted to diffusion limits of linear Boltzmann equations. When the equilibrium distribution function is a Maxwellian distribution, it is well known that for an appropriate time scale, the small mean free path limit gives rise to a diffusion equation. In this paper, we consider situations in which the equilibrium distribution function is a heavy-tailed distribution with infinite variance. We then show that for an appropriate time scale, the small mean free path limit gives rise to a fractional diffusion equation. © 2010 Springer-Verlag.
Lattice Boltzmann Model for Electronic Structure Simulations
Mendoza, M; Succi, S
2015-01-01
Recently, a new connection between density functional theory and kinetic theory has been proposed. In particular, it was shown that the Kohn-Sham (KS) equations can be reformulated as a macroscopic limit of the steady-state solution of a suitable single-particle kinetic equation. By using a discrete version of this new formalism, the exchange and correlation energies of simple atoms and the geometrical configuration of the methane molecule were calculated accurately. Here, we discuss the main ideas behind the lattice kinetic approach to electronic structure computations, offer some considerations for prospective extensions, and also show additional numerical results, namely the geometrical configuration of the water molecule.
Lattice Boltzmann simulations of turbulent shear flow between parallel porous walls
Institute of Scientific and Technical Information of China (English)
唐政; 刘难生; 董宇红
2014-01-01
The effects of two parallel porous walls are investigated, consisting of the Darcy number and the porosity of a porous medium, on the behavior of turbulent shear flows as well as skin-friction drag. The turbulent channel flow with a porous surface is directly simulated by the lattice Boltzmann method (LBM). The Darcy-Brinkman-Forcheimer (DBF) acting force term is added in the lattice Boltzmann equation to simu-late the turbulent flow bounded by porous walls. It is found that there are two opposite trends (enhancement or reduction) for the porous medium to modify the intensities of the velocity fluctuations and the Reynolds stresses in the near wall region. The parametric study shows that flow modification depends on the Darcy number and the porosity of the porous medium. The results show that, with respect to the conventional impermeable wall, the degree of turbulence modification does not depend on any simple set of param-eters obviously. Moreover, the drag in porous wall-bounded turbulent flow decreases if the Darcy number is smaller than the order of O(10−4) and the porosity of porous walls is up to 0.4.
High-order lattice Boltzmann models for wall-bounded flows at finite Knudsen numbers.
Feuchter, C; Schleifenbaum, W
2016-07-01
We analyze a large number of high-order discrete velocity models for solving the Boltzmann-Bhatnagar-Gross-Krook equation for finite Knudsen number flows. Using the Chapman-Enskog formalism, we prove for isothermal flows a relation identifying the resolved flow regimes for low Mach numbers. Although high-order lattice Boltzmann models recover flow regimes beyond the Navier-Stokes level, we observe for several models significant deviations from reference results. We found this to be caused by their inability to recover the Maxwell boundary condition exactly. By using supplementary conditions for the gas-surface interaction it is shown how to systematically generate discrete velocity models of any order with the inherent ability to fulfill the diffuse Maxwell boundary condition accurately. Both high-order quadratures and an exact representation of the boundary condition turn out to be crucial for achieving reliable results. For Poiseuille flow, we can reproduce the mass flow and slip velocity up to the Knudsen number of 1. Moreover, for small Knudsen numbers, the Knudsen layer behavior is recovered.
Study on the melting process of phase change materials in metal foams using lattice Boltzmann method
Institute of Scientific and Technical Information of China (English)
无
2010-01-01
A thermal lattice Boltzmann model is developed for the melting process of phase change material (PCM) embedded in open-cell metal foams. Natural convection in the melt PCM is considered. Under the condition of local thermal non-equilibrium between the metal matrix and PCM, two evolution equations of temperature distribution function are pre-sented through selecting an equilibrium distribution function and a nonlinear source term properly. The enthalpy-based method is employed to copy with phase change problem. Melting process in a cavity of the metal foams is simulated using the present model. The melting front locations and the temperature distributions in the metal foams filled with PCM are obtained by the lattice Boltzmann method. The effects of the porosity and pore size on the melting are also investigated and discussed. The re-sults indicate that the effects of foam porosity play important roles in the overall heat transfer. For the lower porosity foams, the melting rate is comparatively greater than the higher porosity foams, due to greater heat conduction from metal foam with high heat conductivity. The foam pore size has a limited effect on the melting rate due to two counteracting effects between conduction and convection heat transfer.
Two-dimensional lattice Boltzmann model for magnetohydrodynamics.
Schaffenberger, Werner; Hanslmeier, Arnold
2002-10-01
We present a lattice Boltzmann model for the simulation of two-dimensional magnetohydro dynamic (MHD) flows. The model is an extension of a hydrodynamic lattice Boltzman model with 9 velocities on a square lattice resulting in a model with 17 velocities. Earlier lattice Boltzmann models for two-dimensional MHD used a bidirectional streaming rule. However, the use of such a bidirectional streaming rule is not necessary. In our model, the standard streaming rule is used, allowing smaller viscosities. To control the viscosity and the resistivity independently, a matrix collision operator is used. The model is then applied to the Hartmann flow, giving reasonable results.
On a Boltzmann-type price formation model
Burger, Martin
2013-06-26
In this paper, we present a Boltzmann-type price formation model, which is motivated by a parabolic free boundary model for the evolution of price presented by Lasry and Lions in 2007. We discuss the mathematical analysis of the Boltzmann-type model and show that its solutions converge to solutions of the model by Lasry and Lions as the transaction rate tends to infinity. Furthermore, we analyse the behaviour of the initial layer on the fast time scale and illustrate the price dynamics with various numerical experiments. © 2013 The Author(s) Published by the Royal Society. All rights reserved.
Boundary Conditions for Free Interfaces with the Lattice Boltzmann Method
Bogner, Simon; Rüde, Ulrich
2014-01-01
In this paper we analyze the boundary treatment of the Lattice Boltzmann method for simulating 3D flows with free surfaces. The widely used free surface boundary condition of K\\"orner et al. (2005) is shown to be first order accurate. The article presents new free surface boundary schemes that are suitable for the lattice Boltzmann method and that have second order spatial accuracy. The new method takes the free boundary position and orientation with respect to the computational lattice into account. Numerical experiments confirm the theoretical findings and illustrate the the difference between the old and the new method.
Sukop, Michael C.; Huang, Haibo; Alvarez, Pedro F.; Variano, Evan A.; Cunningham, Kevin J.
2013-01-01
Lattice Boltzmann flow simulations provide a physics-based means of estimating intrinsic permeability from pore structure and accounting for inertial flow that leads to departures from Darcy's law. Simulations were used to compute intrinsic permeability where standard measurement methods may fail and to provide better understanding of departures from Darcy's law under field conditions. Simulations also investigated resolution issues. Computed tomography (CT) images were acquired at 0.8 mm interscan spacing for seven samples characterized by centimeter-scale biogenic vuggy macroporosity from the extremely transmissive sole-source carbonate karst Biscayne aquifer in southeastern Florida. Samples were as large as 0.3 m in length; 7–9 cm-scale-length subsamples were used for lattice Boltzmann computations. Macroporosity of the subsamples was as high as 81%. Matrix porosity was ignored in the simulations. Non-Darcy behavior led to a twofold reduction in apparent hydraulic conductivity as an applied hydraulic gradient increased to levels observed at regional scale within the Biscayne aquifer; larger reductions are expected under higher gradients near wells and canals. Thus, inertial flows and departures from Darcy's law may occur under field conditions. Changes in apparent hydraulic conductivity with changes in head gradient computed with the lattice Boltzmann model closely fit the Darcy-Forchheimer equation allowing estimation of the Forchheimer parameter. CT-scan resolution appeared adequate to capture intrinsic permeability; however, departures from Darcy behavior were less detectable as resolution coarsened.
Reis, Tim
2012-01-01
We present lattice Boltzmann simulations of rarefied flows driven by pressure drops along two-dimensional microchannels. Rarefied effects lead to non-zero cross-channel velocities, nonlinear variations in the pressure along the channel. Both effects are absent in flows driven by uniform body forces. We obtain second-order accuracy for the two components of velocity the pressure relative to asymptotic solutions of the compressible Navier-Stokes equations with slip boundary conditions. Since the common lattice Boltzmann formulations cannot capture Knudsen boundary layers, we replace the usual discrete analogs of the specular diffuse reflection conditions from continuous kinetic theory with a moment-based implementation of the first-order Navier-Maxwell slip boundary conditions that relate the tangential velocity to the strain rate at the boundary. We use these conditions to solve for the unknown distribution functions that propagate into the domain across the boundary. We achieve second-order accuracy by reformulating these conditions for the second set of distribution functions that arise in the derivation of the lattice Boltzmann method by an integration along characteristics. Our moment formalism is also valuable for analysing the existing boundary conditions. It reveals the origin of numerical slip in the bounce-back other common boundary conditions that impose conditions on the higher moments, not on the local tangential velocity itself. © 2012 American Institute of Physics.
Institute of Scientific and Technical Information of China (English)
Yue Wenzheng; Tao Guo; Liu Dongming; Yang Wendu
2009-01-01
The electrophysical property of saturated rocks is very important for reservoir identification and evaluation. In this paper, the lattice Boltzmann method (LBM) was used to study the electrophysical property of rock saturated with fluid because of its advantages over conventional numerical approaches in handling complex pore geometry and boundary conditions. The digital core model was constructed through the accumulation of matrix grains based on their radius distribution obtained by the measurements of core samples. The flow of electrical current through the core model saturated with oil and water was simulated on the mesoscopic scale to reveal the non-Archie relationship between resistivity index and water saturation (Ⅰ-Sw). The results from LBM simulation and laboratory measurements demonstrated that the Ⅰ-Sw relation in the range of low water saturation was generally not a straight line in the log-log coordinates as described by the Archie equation. We thus developed a new equation based on numerical simulation and physical experiments. This new equation was used to fit the data from laboratory core measurements and previously published data. Determination of fluid saturation and reservoir evaluation could be significantly improved by using the new equation.
Energy Technology Data Exchange (ETDEWEB)
Moufekkir, F.; Moussaoui, M.A.; Mezrhab, A. [Laboratoire de Mecanique and Energetique, Faculte des sciences, Departement de physique 60000 Oujda (Morocco); Lemonnier, D. [Institut Pprime, CNRS-ENSMA-Univ. Poitiers, ENSMA, BP 40109, 86961 Futuroscope Chasseneuil cedex (France); Naji, H. [Universite Lille Nord de France, F-59000 Lille (France); Laboratoire Genie Civil and geo-Environnement - LGCgE- EA 4515, UArtois/FSA Bethune, F-62400 Bethune (France)
2012-04-15
A numerical analysis is carried out for natural convection while in an asymmetrically heated square cavity containing an absorbing emitting medium. The numerical approach adopted uses a hybrid thermal lattice Boltzmann method (HTLBM) in which the mass and momentum conservation equations are solved by using multiple relaxation time (MRT) model and the energy equation is solved separately by using the finite difference method (FDM). In addition, the radiative transfer equation (RTE) is treated by the discrete ordinates method (DOM) using the S8 quadrature to evaluate the source term of the energy equation. The effects of parameters such as the Rayleigh number Ra, the optical thickness {tau} and the inclination angle {phi}, are studied numerically to assess their impact on the flow and temperature distribution. The results presented in terms of isotherms, streamlines and averaged Nusselt number, show that in the absence of the radiation, the temperature and the flow fields are centro-symmetric and the cavity core is thermally stratified. However, radiation causes an overall increase in temperature and velocity gradients along both thermally active walls
Performance evaluation of a parallel sparse lattice Boltzmann solver
Axner, L.; Bernsdorf, J.; Zeiser, T.; Lammers, P.; Linxweiler, J.; Hoekstra, A.G.
2008-01-01
We develop a performance prediction model for a parallelized sparse lattice Boltzmann solver and present performance results for simulations of flow in a variety of complex geometries. A special focus is on partitioning and memory/load balancing strategy for geometries with a high solid fraction and
Measuring Boltzmann's Constant with Carbon Dioxide
Ivanov, Dragia; Nikolov, Stefan
2013-01-01
In this paper we present two experiments to measure Boltzmann's constant--one of the fundamental constants of modern-day physics, which lies at the base of statistical mechanics and thermodynamics. The experiments use very basic theory, simple equipment and cheap and safe materials yet provide very precise results. They are very easy and…
Lattice Boltzmann simulations of droplet formation during microchannel emulsification
Zwan, van der E.A.; Sman, van der R.G.M.; Schroën, C.G.P.H.; Boom, R.M.
2009-01-01
In this study, we compared microchannel droplet formation in a microfluidics device with a two phase lattice Boltzmann simulation. The droplet formation was found to be qualitatively described, with a slightly smaller droplet in the simulation. This was due to the finite thickness of the interface i
The lattice Boltzmann method and the problem of turbulence
Energy Technology Data Exchange (ETDEWEB)
Djenidi, L. [School of Engineering The University of Newcastle, Callaghan NSW 2308 (Australia)
2015-03-10
This paper reports a brief review of numerical simulations of homogeneous isotopic turbulence (HIT) using the lattice Boltzmann method (LBM). The LBM results shows that the details of HIT are well captured and in agreement with existing data. This clearly indicates that the LBM is as good as current Navier-Stokes solvers and is very much adequate for investigating the problem of turbulence.
Distribution Learning in Evolutionary Strategies and Restricted Boltzmann Machines
DEFF Research Database (Denmark)
Krause, Oswin
The thesis is concerned with learning distributions in the two settings of Evolutionary Strategies (ESs) and Restricted Boltzmann Machines (RBMs). In both cases, the distributions are learned from samples, albeit with different goals. Evolutionary Strategies are concerned with finding an optimum ...
Analytical solutions of the lattice Boltzmann BGK model
Zou, Q; Doolen, G D; Zou, Qisu; Hou, Shuling; Doolen, Gary D.
1995-01-01
Abstract: Analytical solutions of the two dimensional triangular and square lattice Boltzmann BGK models have been obtained for the plain Poiseuille flow and the plain Couette flow. The analytical solutions are written in terms of the characteristic velocity of the flow, the single relaxation time representation of these two flows without any approximation.
Determining Planetary Temperatures with the Stefan-Boltzmann Law
LoPresto, Michael C.; Hagoort, Nichole
2011-01-01
What follows is a description of several activities involving the Stefan-Boltzmann radiation law that can provide laboratory experience beyond what is normally found in traditional introductory thermodynamics experiments on thermal expansion, specific heat, and heats of transformation. The activities also provide more extensive coverage of and…
A Parallel Lattice Boltzmann Model of a Carotid Artery
Boyd, J.; Ryan, S. J.; Buick, J. M.
2008-11-01
A parallel implementation of the lattice Boltzmann model is considered for a three dimensional model of the carotid artery. The computational method and its parallel implementation are described. The performance of the parallel implementation on a Beowulf cluster is presented, as are preliminary hemodynamic results.
d'Eon, Eugene
2013-01-01
We derive new diffusion solutions to the monoenergetic generalized linear Boltzmann transport equation (GLBE) for the stationary collision density and scalar flux about an isotropic point source in an infinite $d$-dimensional absorbing medium with isotropic scattering. We consider both classical transport theory with exponentially-distributed free paths in arbitrary dimensions as well as a number of non-classical transport theories (non-exponential random flights) that describe a broader class of transport processes within partially-correlated random media. New rigorous asymptotic diffusion approximations are derived where possible. We also generalize Grosjean's moment-preserving approach of separating the first (or uncollided) distribution from the collided portion and approximating only the latter using diffusion. We find that for any spatial dimension and for many free-path distributions Grosjean's approach produces compact, analytic approximations that are, overall, more accurate for high absorption and f...
Ambia-Garrido, Joaquin; Montgomery Pettitt, Bernard
2007-10-01
The change in some thermodynamic quantities such as Gibbs' free energy, entropy and enthalpy of the binding of a particle tethered to a surface or particle are analytically calculated. These particles are considered ellipsoids and submerged in a liquid. The ionic strength of the media allows the linearized version of the Poisson-Boltzmann equation (from the theory of the double layer interaction) to properly describe the interactions between an ion penetrable spheroid and a hard plate. We believe that this is an adequate model for a DNA chip and the predicted electrostatic effects suggest the feasibility of electronic control and detection of DNA hybridization and design of chips, avoiding the DNA folding problem.
Ambia-Garrido, Joaquin; Pettitt, Montgomery
2008-03-01
The change in some thermodynamic quantities such as Gibbs' free energy, entropy and enthalpy of the binding of a particle tethered to a surface or particle are analytically calculated. These particles are considered ellipsoids and submerged in a liquid. The ionic strength of the media allows the linearized version of the Poisson-Boltzmann equation (from the theory of the double layer interaction) to properly describe the interactions between an ion penetrable spheroid and a hard plate. We believe that this is an adequate model for a DNA chip and the predicted electrostatic effects suggest the feasibility of electronic control and detection of DNA hybridization and design of chips underline avoiding the DNA folding problem.
Chen, Li; Kang, Qinjun; Yao, Jun; Tao, Wenquan
2014-01-01
Porous structures of shales are reconstructed based on scanning electron microscopy (SEM) images of shale samples from Sichuan Basin, China. Characterization analyzes of the nanoscale reconstructed shales are performed, including porosity, pore size distribution, specific surface area and pore connectivity. The multiple-relaxation-time (MRT) lattice Boltzmann method (LBM) fluid flow model and single-relaxation-time (SRT) LBM diffusion model are adopted to simulate the fluid flow and Knudsen diffusion process within the reconstructed shales, respectively. Tortuosity, intrinsic permeability and effective Knudsen diffusivity are numerically predicted. The tortuosity is much higher than that commonly employed in Bruggeman equation. Correction of the intrinsic permeability by taking into consideration the contribution of Knudsen diffusion, which leads to the apparent permeability, is performed. The correction factor under different Knudsen number and pressure are estimated and compared with existing corrections re...
A new multiple-relaxation-time lattice Boltzmann model for incompressible flows in porous media
Liu, Qing; He, Chao
2013-01-01
In this paper, a two-dimensional eight-velocity (D2Q8) multiple-relaxation-time (MRT) lattice Boltzmann (LB) model is proposed for incompressible porous flows at the representative elementary volume scale based on the Brinkman-Forchheimer-extended Darcy formulation. In the MRT-LB model, newly defined equilibrium moments are employed to account for the porosity of the porous media, and the linear and nonlinear drag forces of the media are incorporated into the model by adding a forcing term to the MRT-LB equation in the moment space. The model is validated by simulating the 2D Poiseuille flow, Couette flow and lid-driven cavity flow in porous media. The numerical results are in excellent agreement with the analytical solutions and/or the well-documented data available in the literature.
Lattice Boltzmann simulations of apparent slip and contact angle in hydrophobic micro-channels
Zhang, Renliang; Gao, Guohua; Wang, Xinliang; Ding, Weipeng; Gong, Wei
2013-01-01
In this paper, we applied the Shan-Chen multiphase Lattice Boltzmann method to simulate two different parameters, contact angle (a static parameter) and slip length (a dynamic parameter), and we proposed a relationship between them by fitting those numerical simulation results. By changing the values of the strength of interaction between fluid particles (SIF) and the strength of interaction between fluid and solid surface (SIFS), we simulated a series of contact angles and slip lengths. Our numerical simulation results show that both SIF and SIFS have little effects on the relationship between contact angle and slip length. Using the proposed relationship between slip length and contact angle, we further derived an equation to determine the upper limit of nano-particles' diameter under which drag-reduction can be achieved when using nano-particles adsorbing method.
GPU linear and non-linear Poisson–Boltzmann solver module for DelPhi
Colmenares, José; Ortiz, Jesús; Rocchia, Walter
2014-01-01
Summary: In this work, we present a CUDA-based GPU implementation of a Poisson–Boltzmann equation solver, in both the linear and non-linear versions, using double precision. A finite difference scheme is adopted and made suitable for the GPU architecture. The resulting code was interfaced with the electrostatics software for biomolecules DelPhi, which is widely used in the computational biology community. The algorithm has been implemented using CUDA and tested over a few representative cases of biological interest. Details of the implementation and performance test results are illustrated. A speedup of ∼10 times was achieved both in the linear and non-linear cases. Availability and implementation: The module is open-source and available at http://www.electrostaticszone.eu/index.php/downloads. Contact: walter.rocchia@iit.it Supplementary information: Supplementary data are available at Bioinformatics online PMID:24292939
Cooper, Christopher D
2015-01-01
Interactions between surfaces and proteins occur in many vital processes and are crucial in biotechnology: the ability to control specific interactions is essential in fields like biomaterials, biomedical implants and biosensors. In the latter case, biosensor sensitivity hinges on ligand proteins adsorbing on bioactive surfaces with a favorable orientation, exposing reaction sites to target molecules. Protein adsorption, being a free-energy-driven process, is difficult to study experimentally. This paper develops and evaluates a computational model to study electrostatic interactions of proteins and charged nanosurfaces, via the Poisson-Boltzmann equation. We extended the implicit-solvent model used in the open-source code PyGBe to include surfaces of imposed charge or potential. This code solves the boundary integral formulation of the Poisson-Boltzmann equation, discretized with surface elements. PyGBe has at its core a treecode-accelerated Krylov iterative solver, resulting in O(N log N) scaling, with furt...
Nagakura, Hiroki; Yamada, Shoichi
2014-01-01
We propose a novel numerical method for solving multi-dimensional, special relativistic Boltzmann equations for neutrinos coupled to hydrodynamics equations. It is meant to be applied to simulations of core-collapse supernovae. We handle special relativity in a non-conventional way, taking account of all orders of v/c. Consistent treatment of advection and collision terms in the Boltzmann equations is the source of difficulties, which we overcome by employing two different energy grids: Lagrangian remapped and laboratory fixed grids. We conduct a series of basic tests and perform a one-dimensional simulation of core-collapse, bounce and shock-stall for a 15M_{sun} progenitor model with a minimum but essential set of microphysics. We demonstrate in the latter simulation that our new code is capable of handling all phases in core-collapse supernova. For comparison, a non-relativistic simulation is also conducted with the same code, and we show that they produce qualitatively wrong results in neutrino transfer. ...
Institute of Scientific and Technical Information of China (English)
SHEN Zai-Yi; HE Ying
2012-01-01
A computational simulation for the separation of red blood cells (RBCs) is presented.The deformability of RBCs is expressed by the spring network model,which is based on the minimum energy principle.In the computation of the fluid flow,the lattice Boltzmann method is used to solve the Navier-Stokes equations.Coupling of the fluid-membrane interaction is carried out by using the immersed boundary method.To verify our method,the motions of RBCs in shear flow are simulated.Typical motions of RBCs observed in the experiments are reproduced,including tank-treading,swinging and tumbling.The motions of 8 RBCs at the bifurcation are simulated when the two daughter vessels have different ratios.The results indicate that when the ratio of the daughter vessel diameter becomes smaller,the distribution of RBCs in the two vessels becomes more non-uniform.%A computational simulation for the separation of red blood cells (RBCs) is presented. The deformability of RBCs is expressed by the spring network model, which is based on the minimum energy principle. In the computation of the fluid Bow, the lattice Boltzmann method is used to solve the Navier-Stokes equations. Coupling of the fluid-membrane interaction is carried out by using the immersed boundary method. To verify our method, the motions of RBCs in shear How are simulated. Typical motions of RBCs observed in the experiments are reproduced, including tank-treading, swinging and tumbling. The motions of 8 RBCs at the bifurcation are simulated when the two daughter vessels have different ratios. The results indicate that when the ratio of te daughter vessel diameter becomes smaller, the distribution of RBCs in the two vessels becomes more non-uniform.
Asgarani, Somayeh
2015-02-01
A method of finding entropic form for a given stationary probability distribution and specified potential field is discussed, using the steady-state Fokker-Planck equation. As examples, starting with the Boltzmann and Tsallis distribution and knowing the force field, we obtain the Boltzmann-Gibbs and Tsallis entropies. Also, the associated entropy for the gamma probability distribution is found, which seems to be in the form of the gamma function. Moreover, the related Fokker-Planck equations are given for the Boltzmann, Tsallis, and gamma probability distributions.
Riccati-coupled similarity shock wave solutions for multispeed discrete Boltzmann models
Energy Technology Data Exchange (ETDEWEB)
Cornille, H. (Service de Physique Theorique, Gif-sur-Yvette (France)); Platkowski, T. (Warsaw Univ. (Poland))
1993-05-01
The authors study nonstandard shock wave similarity solutions for three multispeed discrete boltzmann models: (1) the square 8[upsilon][sub i] model with speeds 1 and [radical]2 with the x axis along one median, (2) the Cabannes cubic 14[upsilon][sub i] model with speeds 1 and [radical]3 and the x axis perpendicular to one face, and (3) another 14[upsilon][sub i] model with speeds 1 and [radical]2. These models have five independent densities and two nonlinear Riccati-coupled equations. The standard similarity shock waves, solutions of scalar Riccati equations, are monotonic and the same behavior holds for the conservative macroscopic quantities. First, the exact similarity shock-wave solutions of coupled Riccati equations are determined and the nonmonotonic behavior for one density and a smaller effect for one conservative macroscopic quantity are observed when a violation of the microreversibility is allowed. Second, new results are obtained on the Whitham weak shock wave propagation. Third, the corresponding dynamical system is numerically solved, with microreversibility satisfied or not, and the analogous nonmonotonic behavior is observed. 9 refs., 2 figs., 1 tab.
Accuracy analysis of high-order lattice Boltzmann models for rarefied gas flows
Meng, Jianping
2009-01-01
In this work, we have theoretically analyzed and numerically evaluated the accuracy of high-order lattice Boltzmann (LB) models for capturing non-equilibrium effects in rarefied gas flows. In the incompressible limit, the LB equation is proved to be equivalent to the linearized Bhatnagar-Gross-Krook (BGK) equation. Therefore, when the same Gauss-Hermite quadrature is used, LB method closely assembles the discrete velocity method (DVM). In addition, the order of Hermite expansion for the equilibrium distribution function is found not to be correlated with the approximation order in terms of the Knudsen number to the BGK equation, which was previously suggested by \\cite{2006JFM...550..413S}. Furthermore, we have numerically evaluated the LB models for a standing-shear-wave problem, which is designed specifically for assessing model accuracy by excluding the influence of gas molecule/surface interactions at wall boundaries. The numerical simulation results confirm that the high-order terms in the discrete equili...
Application of Lattice Boltzmann Methods in Complex Mass Transfer Systems
Sun, Ning
Lattice Boltzmann Method (LBM) is a novel computational fluid dynamics method that can easily handle complex and dynamic boundaries, couple local or interfacial interactions/reactions, and be easily parallelized allowing for simulation of large systems. While most of the current studies in LBM mainly focus on fluid dynamics, however, the inherent power of this method makes it an ideal candidate for the study of mass transfer systems involving complex/dynamic microstructures and local reactions. In this thesis, LBM is introduced to be an alternative computational method for the study of electrochemical energy storage systems (Li-ion batteries (LIBs) and electric double layer capacitors (EDLCs)) and transdermal drug design on mesoscopic scale. Based on traditional LBM, the following in-depth studies have been carried out: (1) For EDLCs, the simulation of diffuse charge dynamics is carried out for both the charge and the discharge processes on 2D systems of complex random electrode geometries (pure random, random spheres and random fibers). Steric effect of concentrated solutions is considered by using modified Poisson-Nernst-Plank (MPNP) equations and compared with regular Poisson-Nernst-Plank (PNP) systems. The effects of electrode microstructures (electrode density, electrode filler morphology, filler size, etc.) on the net charge distribution and charge/discharge time are studied in detail. The influence of applied potential during discharging process is also discussed. (2) For the study of dendrite formation on the anode of LIBs, it is shown that the Lattice Boltzmann model can capture all the experimentally observed features of microstructure evolution at the anode, from smooth to mossy to dendritic. The mechanism of dendrite formation process in mesoscopic scale is discussed in detail and compared with the traditional Sand's time theories. It shows that dendrite formation is closely related to the inhomogeneous reactively at the electrode-electrolyte interface
Conjugate heat transfer with the entropic lattice Boltzmann method.
Pareschi, G; Frapolli, N; Chikatamarla, S S; Karlin, I V
2016-07-01
A conjugate heat-transfer model is presented based on the two-population entropic lattice Boltzmann method. The present approach relies on the extension of Grad's boundary conditions to the two-population model for thermal flows, as well as on the appropriate exact conjugate heat-transfer condition imposed at the fluid-solid interface. The simplicity and efficiency of the lattice Boltzmann method (LBM), and in particular of the entropic multirelaxation LBM, are retained in the present approach, thus enabling simulations of turbulent high Reynolds number flows and complex wall boundaries. The model is validated by means of two-dimensional parametric studies of various setups, including pure solid conduction, conjugate heat transfer with a backward-facing step flow, and conjugate heat transfer with the flow past a circular heated cylinder. Further validations are performed in three dimensions for the case of a turbulent flow around a heated mounted cube.
Contact angles in the pseudopotential lattice Boltzmann modeling of wetting
Li, Q; Kang, Q J; Chen, Q
2014-01-01
In this paper, we aim to investigate the implementation of contact angles in the pseudopotential lattice Boltzmann modeling of wetting at a large density ratio. The pseudopotential lattice Boltzmann model [X. Shan and H. Chen, Phys. Rev. E 49, 2941 (1994)] is a popular mesoscopic model for simulating multiphase flows and interfacial dynamics. In this model, the contact angle is usually realized by a fluid-solid interaction. Two widely used fluid-solid interactions: the density-based interaction and the pseudopotential-based interaction, as well as a modified pseudopotential-based interaction formulated in the present paper, are numerically investigated and compared in terms of the achievable contact angles, the maximum and the minimum densities, and the spurious currents. It is found that the pseudopotential-based interaction works well for simulating small static (liquid) contact angles, however, is unable to reproduce static contact angles close to 180 degrees. Meanwhile, it is found that the proposed modif...
Big-Bang Nucleosynthesis verifies classical Maxwell-Boltzmann distribution
Hou, S Q; Parikh, A; Daid, K; Bertulani, C
2014-01-01
We provide the most stringent constraint to date on possible deviations from the usually-assumed Maxwell-Boltzmann (MB) velocity distribution for nuclei in the Big-Bang plasma. The impact of non-extensive Tsallis statistics on thermonuclear reaction rates involved in standard models of Big-Bang Nucleosynthesis (BBN) has been investigated. We find that the non-extensive parameter $q$ may deviate by, at most, $|\\delta q|$=6$\\times$10$^{-4}$ from unity for BBN predictions to be consistent with observed primordial abundances; $q$=1 represents the classical Boltzmann-Gibbs statistics. This constraint arises primarily from the {\\em super}sensitivity of endothermic rates on the value of $q$, which is found for the first time. As such, the implications of non-extensive statistics in other astrophysical environments should be explored. This may offer new insight into the nucleosynthesis of heavy elements.
Accelerated Monte Carlo simulations with restricted Boltzmann machines
Huang, Li; Wang, Lei
2017-01-01
Despite their exceptional flexibility and popularity, Monte Carlo methods often suffer from slow mixing times for challenging statistical physics problems. We present a general strategy to overcome this difficulty by adopting ideas and techniques from the machine learning community. We fit the unnormalized probability of the physical model to a feed-forward neural network and reinterpret the architecture as a restricted Boltzmann machine. Then, exploiting its feature detection ability, we utilize the restricted Boltzmann machine to propose efficient Monte Carlo updates to speed up the simulation of the original physical system. We implement these ideas for the Falicov-Kimball model and demonstrate an improved acceptance ratio and autocorrelation time near the phase transition point.
Accelerate Monte Carlo Simulations with Restricted Boltzmann Machines
Huang, Li
2016-01-01
Despite their exceptional flexibility and popularity, the Monte Carlo methods often suffer from slow mixing times for challenging statistical physics problems. We present a general strategy to overcome this difficulty by adopting ideas and techniques from the machine learning community. We fit the unnormalized probability of the physical model to a feedforward neural network and reinterpret the architecture as a restricted Boltzmann machine. Then, exploiting its feature detection ability, we utilize the restricted Boltzmann machine for efficient Monte Carlo updates and to speed up the simulation of the original physical system. We implement these ideas for the Falicov-Kimball model and demonstrate improved acceptance ratio and autocorrelation time near the phase transition point.
Boltzmann learning of parameters in cellular neural networks
DEFF Research Database (Denmark)
Hansen, Lars Kai
1992-01-01
The use of Bayesian methods to design cellular neural networks for signal processing tasks and the Boltzmann machine learning rule for parameter estimation is discussed. The learning rule can be used for models with hidden units, or for completely unsupervised learning. The latter is exemplified...... by unsupervised adaptation of an image segmentation cellular network. The learning rule is applied to adaptive segmentation of satellite imagery...
On the Spectral Problems for the Discrete Boltzmann Models
Institute of Scientific and Technical Information of China (English)
Aq Kwang-Hua Chu; J. FANG Jing
2000-01-01
The discrete Boltzmann models are used to study the spectral problems related to the one-dimensional plane wave propaogation in monatomic gases which are fundamental in the nonequilibrium tatistical thermodynamics. The results show that the 8-velocity model can only describe the propagation of the diffusion mode (entropy wave) in the intermediate Knudsen number regime. The 4- and 6-velocity models, instead, can describe the propagation of sound modes quite well, after comparison with the continuum-mechanical results.
A non-slip boundary condition for lattice Boltzmann simulations
Inamuro, T; Ogino, F; Inamuro, Takaji; Yoshino, Masato; Ogino, Fumimaru
1995-01-01
A non-slip boundary condition at a wall for the lattice Boltzmann method is presented. In the present method unknown distribution functions at the wall are assumed to be an equilibrium distribution function with a counter slip velocity which is determined so that fluid velocity at the wall is equal to the wall velocity. Poiseuille flow and Couette flow are calculated with the nine-velocity model to demonstrate the accuracy of the present boundary condition.
Porter, Mark L.; Coon, E. T.; Kang, Q.; Moulton, J. D.; Carey, J. W.
2012-09-01
This work focuses on an improved multicomponent interparticle-potential lattice Boltzmann model. The model results in viscosity-independent equilibrium densities and is capable of simulating kinematic viscosity ratios greater than 1000. External forces are incorporated into the discrete Boltzmann equation, rather than through an equilibrium velocity shift as in the original Shan and Chen (hereafter, SC) model. The model also requires the derivation of a momentum conserving effective velocity, which is substituted into the equilibrium distribution function and applies to both the single- and multiple-relaxation-time formulations. Additionally, higher-order isotropy is used in the calculation of the fluid-fluid interaction forces to reduce the magnitude of spurious currents (i.e., numerical errors) in the vicinity of interfaces. First, we compare the model to the SC model for static bubble simulations. We demonstrate that the model results in viscosity-independent equilibrium bubble densities for a wide range of kinematic viscosities, which is not the case for the SC model. Furthermore, we show that the model is capable of simulating stable bubbles for kinematic viscosity ratios greater than 1000 (when higher-order isotropy is used), whereas the SC model is known to be limited to kinematic viscosity ratios on the order of 10. Next we verify the model for surface tension via Laplace's law and show that the model results in the same surface tension values for a range of kinematic viscosities and kinematic viscosity ratios of 10, 100, and 1000. The model is also verified for layered cocurrent flow though parallel plates. We show that the simulated velocity profiles preserve continuity at the interface for kinematic viscosity ratios ranging from 0.001 to 1000 and that the model accurately predicts nonwetting and wetting phase relative permeability for kinematic viscosity ratios of 0.01 to 100.
Non-Boltzmann Ensembles and Monte Carlo Simulations
Murthy, K. P. N.
2016-10-01
Boltzmann sampling based on Metropolis algorithm has been extensively used for simulating a canonical ensemble and for calculating macroscopic properties of a closed system at desired temperatures. An estimate of a mechanical property, like energy, of an equilibrium system, is made by averaging over a large number microstates generated by Boltzmann Monte Carlo methods. This is possible because we can assign a numerical value for energy to each microstate. However, a thermal property like entropy, is not easily accessible to these methods. The reason is simple. We can not assign a numerical value for entropy, to a microstate. Entropy is not a property associated with any single microstate. It is a collective property of all the microstates. Toward calculating entropy and other thermal properties, a non-Boltzmann Monte Carlo technique called Umbrella sampling was proposed some forty years ago. Umbrella sampling has since undergone several metamorphoses and we have now, multi-canonical Monte Carlo, entropic sampling, flat histogram methods, Wang-Landau algorithm etc. This class of methods generates non-Boltzmann ensembles which are un-physical. However, physical quantities can be calculated as follows. First un-weight a microstates of the entropic ensemble; then re-weight it to the desired physical ensemble. Carry out weighted average over the entropic ensemble to estimate physical quantities. In this talk I shall tell you of the most recent non- Boltzmann Monte Carlo method and show how to calculate free energy for a few systems. We first consider estimation of free energy as a function of energy at different temperatures to characterize phase transition in an hairpin DNA in the presence of an unzipping force. Next we consider free energy as a function of order parameter and to this end we estimate density of states g(E, M), as a function of both energy E, and order parameter M. This is carried out in two stages. We estimate g(E) in the first stage. Employing g
Development of a Prototype Lattice Boltzmann Code for CFD of Fusion Systems.
Energy Technology Data Exchange (ETDEWEB)
Pattison, Martin J; Premnath, Kannan N; Banerjee, Sanjoy; Dwivedi, Vinay
2007-02-26
Designs of proposed fusion reactors, such as the ITER project, typically involve the use of liquid metals as coolants in components such as heat exchangers, which are generally subjected to strong magnetic fields. These fields induce electric currents in the fluids, resulting in magnetohydrodynamic (MHD) forces which have important effects on the flow. The objective of this SBIR project was to develop computational techniques based on recently developed lattice Boltzmann techniques for the simulation of these MHD flows and implement them in a computational fluid dynamics (CFD) code for the study of fluid flow systems encountered in fusion engineering. The code developed during this project, solves the lattice Boltzmann equation, which is a kinetic equation whose behaviour represents fluid motion. This is in contrast to most CFD codes which are based on finite difference/finite volume based solvers. The lattice Boltzmann method (LBM) is a relatively new approach which has a number of advantages compared with more conventional methods such as the SIMPLE or projection method algorithms that involve direct solution of the Navier-Stokes equations. These are that the LBM is very well suited to parallel processing, with almost linear scaling even for very large numbers of processors. Unlike other methods, the LBM does not require solution of a Poisson pressure equation leading to a relatively fast execution time. A particularly attractive property of the LBM is that it can handle flows in complex geometries very easily. It can use simple rectangular grids throughout the computational domain -- generation of a body-fitted grid is not required. A recent advance in the LBM is the introduction of the multiple relaxation time (MRT) model; the implementation of this model greatly enhanced the numerical stability when used in lieu of the single relaxation time model, with only a small increase in computer time. Parallel processing was implemented using MPI and demonstrated the
Balla-Arabé, Souleymane; Gao, Xinbo; Wang, Bin
2013-06-01
In the last decades, due to the development of the parallel programming, the lattice Boltzmann method (LBM) has attracted much attention as a fast alternative approach for solving partial differential equations. In this paper, we first designed an energy functional based on the fuzzy c-means objective function which incorporates the bias field that accounts for the intensity inhomogeneity of the real-world image. Using the gradient descent method, we obtained the corresponding level set equation from which we deduce a fuzzy external force for the LBM solver based on the model by Zhao. The method is fast, robust against noise, independent to the position of the initial contour, effective in the presence of intensity inhomogeneity, highly parallelizable and can detect objects with or without edges. Experiments on medical and real-world images demonstrate the performance of the proposed method in terms of speed and efficiency.
A combination of energy method and spectral analysis for study of equations of gas motion
Institute of Scientific and Technical Information of China (English)
Renjun DUAN; Seiji UKAI; Tong YANG
2009-01-01
There have been extensive studies on the large time behavior of solutions to systems on gas motions, such as the Navier-Stokes equations and the Boltzmann equation. Recently, an approach is introduced by combining the energy method and the spectral analysis to the study of the optimal rates of convergence to the asymptotic profiles. In this paper, we will first illustrate this method by using some simple model and then we will present some recent results on the Navier-Stokes equations and the Boltzmann equation. Precisely, we prove the stability of the non-trivial steady state for the Navier-Stokes equations with potential forces and also obtain the optimal rate of convergence of solutions toward the steady state. The same issue was also studied for the Boltzmann equation in the presence of the general time-space dependent forces. It is expected that this approach can also be applied to other dissipative systems in fluid dynamics and kinetic models such as the model system of radiating gas and the Vlasov-Poisson-Boltzmann system.
Hypocoercivity for linear kinetic equations conserving mass
Dolbeault, Jean
2015-02-03
We develop a new method for proving hypocoercivity for a large class of linear kinetic equations with only one conservation law. Local mass conservation is assumed at the level of the collision kernel, while transport involves a confining potential, so that the solution relaxes towards a unique equilibrium state. Our goal is to evaluate in an appropriately weighted $ L^2$ norm the exponential rate of convergence to the equilibrium. The method covers various models, ranging from diffusive kinetic equations like Vlasov-Fokker-Planck equations, to scattering models or models with time relaxation collision kernels corresponding to polytropic Gibbs equilibria, including the case of the linear Boltzmann model. In this last case and in the case of Vlasov-Fokker-Planck equations, any linear or superlinear growth of the potential is allowed. - See more at: http://www.ams.org/journals/tran/2015-367-06/S0002-9947-2015-06012-7/#sthash.ChjyK6rc.dpuf
Directory of Open Access Journals (Sweden)
Mandana Samari Kermani
2016-01-01
Full Text Available The interaction of spherical solid particles with turbulent eddies in a 3-D turbulent channel flow with friction Reynolds number was studied. A generalized lattice Boltzmann equation (GLBE was used for computation of instantaneous turbulent flow field for which large eddy simulation (LES was employed. The sub-grid-scale (SGS turbulence effects were simulated through a shear-improved Smagorinsky model (SISM, which can predict turbulent near wall region without any wall function. Statistical properties of particles behavior such as root mean square (RMS velocities were studied as a function of dimensionless particle relaxation time ( by using a Lagrangian approach. Combination of SISM in GLBE with particle tracking analysis in turbulent channel flow is novelty of the present work. Both GLBE and SISM solve the flow field equations locally. This is an advantage of this method and makes it easy implementing. Comparison of the present results with previous available data indicated that SISM in GLBE is a reliable method for simulation of turbulent flows which is a key point to predict particles behavior correctly.
A GPU-accelerated Direct-sum Boundary Integral Poisson-Boltzmann Solver
Geng, Weihua
2013-01-01
In this paper, we present a GPU-accelerated direct-sum boundary integral method to solve the linear Poisson-Boltzmann (PB) equation. In our method, a well-posed boundary integral formulation is used to ensure the fast convergence of Krylov subspace based linear algebraic solver such as the GMRES. The molecular surfaces are discretized with flat triangles and centroid collocation. To speed up our method, we take advantage of the parallel nature of the boundary integral formulation and parallelize the schemes within CUDA shared memory architecture on GPU. The schemes use only $11N+6N_c$ size-of-double device memory for a biomolecule with $N$ triangular surface elements and $N_c$ partial charges. Numerical tests of these schemes show well-maintained accuracy and fast convergence. The GPU implementation using one GPU card (Nvidia Tesla M2070) achieves 120-150X speed-up to the implementation using one CPU (Intel L5640 2.27GHz). With our approach, solving PB equations on well-discretized molecular surfaces with up ...
Chatterjee, Dipankar; Amiroudine, Sakir
2011-02-01
A comprehensive non-isothermal Lattice Boltzmann (LB) algorithm is proposed in this article to simulate the thermofluidic transport phenomena encountered in a direct-current (DC) magnetohydrodynamic (MHD) micropump. Inside the pump, an electrically conducting fluid is transported through the microchannel by the action of an electromagnetic Lorentz force evolved out as a consequence of the interaction between applied electric and magnetic fields. The fluid flow and thermal characteristics of the MHD micropump depend on several factors such as the channel geometry, electromagnetic field strength and electrical property of the conducting fluid. An involved analysis is carried out following the LB technique to understand the significant influences of the aforementioned controlling parameters on the overall transport phenomena. In the LB framework, the hydrodynamics is simulated by a distribution function, which obeys a single scalar kinetic equation associated with an externally imposed electromagnetic force field. The thermal history is monitored by a separate temperature distribution function through another scalar kinetic equation incorporating the Joule heating effect. Agreement with analytical, experimental and other available numerical results is found to be quantitative.
Li, Qingfeng; Steinheimer, Jan; Petersen, Hannah; Bleicher, Marcus; Stöcker, Horst
2009-04-01
A systematic study of HBT radii of pions, produced in heavy ion collisions in the intermediate energy regime (SPS), from an integrated (3 + 1)d Boltzmann + hydrodynamics approach is presented. The calculations in this hybrid approach, incorporating an hydrodynamic stage into the Ultra-relativistic Quantum Molecular Dynamics transport model, allow for a comparison of different equations of state retaining the same initial conditions and final freeze-out. The results are also compared to the pure cascade transport model calculations in the context of the available data. Furthermore, the effect of different treatments of the hydrodynamic freeze-out procedure on the HBT radii are investigated. It is found that the HBT radii are essentially insensitive to the details of the freeze-out prescription as long as the final hadronic interactions in the cascade are taken into account. The HBT radii RL and RO and the RO /RS ratio are sensitive to the EoS that is employed during the hydrodynamic evolution. We conclude that the increased lifetime in case of a phase transition to a QGP (via a Bag Model equation of state) is not supported by the available data.
Energy Technology Data Exchange (ETDEWEB)
Li Qingfeng [School of Science, Huzhou Teachers College, Huzhou 313000 (China); Frankfurt Institute for Advanced Studies (FIAS), Johann Wolfgang Goethe-Universitaet, Ruth-Moufang-Str. 1, D-60438 Frankfurt am Main (Germany)], E-mail: liqf@fias.uni-frankfurt.de; Steinheimer, Jan [Institut fuer Theoretische Physik, Johann Wolfgang Goethe-Universitaet, Max-von-Laue-Str. 1, D-60438 Frankfurt am Main (Germany)], E-mail: steinheimer@th.physik.uni-frankfurt.de; Petersen, Hannah [Frankfurt Institute for Advanced Studies (FIAS), Johann Wolfgang Goethe-Universitaet, Ruth-Moufang-Str. 1, D-60438 Frankfurt am Main (Germany); Institut fuer Theoretische Physik, Johann Wolfgang Goethe-Universitaet, Max-von-Laue-Str. 1, D-60438 Frankfurt am Main (Germany)], E-mail: petersen@th.physik.uni-frankfurt.de; Bleicher, Marcus [Institut fuer Theoretische Physik, Johann Wolfgang Goethe-Universitaet, Max-von-Laue-Str. 1, D-60438 Frankfurt am Main (Germany)], E-mail: bleicher@th.physik.uni-frankfurt.de; Stoecker, Horst [Frankfurt Institute for Advanced Studies (FIAS), Johann Wolfgang Goethe-Universitaet, Ruth-Moufang-Str. 1, D-60438 Frankfurt am Main (Germany); Institut fuer Theoretische Physik, Johann Wolfgang Goethe-Universitaet, Max-von-Laue-Str. 1, D-60438 Frankfurt am Main (Germany); Gesellschaft fuer Schwerionenforschung (GSI), Planckstr. 1, D-64291 Darmstadt (Germany)], E-mail: h.stoecker@gsi.de
2009-04-13
A systematic study of HBT radii of pions, produced in heavy ion collisions in the intermediate energy regime (SPS), from an integrated (3+1)d Boltzmann + hydrodynamics approach is presented. The calculations in this hybrid approach, incorporating an hydrodynamic stage into the Ultra-relativistic Quantum Molecular Dynamics transport model, allow for a comparison of different equations of state retaining the same initial conditions and final freeze-out. The results are also compared to the pure cascade transport model calculations in the context of the available data. Furthermore, the effect of different treatments of the hydrodynamic freeze-out procedure on the HBT radii are investigated. It is found that the HBT radii are essentially insensitive to the details of the freeze-out prescription as long as the final hadronic interactions in the cascade are taken into account. The HBT radii R{sub L} and R{sub O} and the R{sub O}/R{sub S} ratio are sensitive to the EoS that is employed during the hydrodynamic evolution. We conclude that the increased lifetime in case of a phase transition to a QGP (via a Bag Model equation of state) is not supported by the available data.
Lu, Benzhuo; Cheng, Xiaolin; Huang, Jingfang; McCammon, J. Andrew
2013-11-01
A Fortran program package is introduced for rapid evaluation of the electrostatic potentials and forces in biomolecular systems modeled by the linearized Poisson-Boltzmann equation. The numerical solver utilizes a well-conditioned boundary integral equation (BIE) formulation, a node-patch discretization scheme, a Krylov subspace iterative solver package with reverse communication protocols, and an adaptive new version of the fast multipole method in which the exponential expansions are used to diagonalize the multipole-to-local translations. The program and its full description, as well as several closely related libraries and utility tools are available at http://lsec.cc.ac.cn/~lubz/afmpb.html and a mirror site at http://mccammon.ucsd.edu/. This paper is a brief summary of the program: the algorithms, the implementation and the usage. Restrictions: Only three or six significant digits options are provided in this version. Unusual features: Most of the codes are in Fortran77 style. Memory allocation functions from Fortran90 and above are used in a few subroutines. Additional comments: The current version of the codes is designed and written for single core/processor desktop machines. Check http://lsec.cc.ac.cn/lubz/afmpb.html for updates and changes. Running time: The running time varies with the number of discretized elements (N) in the system and their distributions. In most cases, it scales linearly as a function of N.
Hekmat, Mohamad Hamed; Mirzaei, Masoud
2015-01-01
In the present research, we tried to improve the performance of the lattice Boltzmann (LB) -based adjoint approach by utilizing the mesoscopic inherent of the LB method. In this regard, two macroscopic discrete adjoint (MADA) and microscopic discrete adjoint (MIDA) approaches are used to answer the following two challenging questions. Is it possible to extend the concept of the macroscopic and microscopic variables of the flow field to the corresponding adjoint ones? Further, similar to the conservative laws in the LB method, is it possible to find the comparable conservation equations in the adjoint approach? If so, then a definite framework, similar to that used in the flow solution by the LB method, can be employed in the flow sensitivity analysis by the MIDA approach. This achievement can decrease the implementation cost and coding efforts of the MIDA method in complicated sensitivity analysis problems. First, the MADA and MIDA equations are extracted based on the LB method using the duality viewpoint. Meanwhile, using an elementary case, inverse design of a two-dimensional unsteady Poiseuille flow in a periodic channel with constant body forces, the procedure of analytical evaluation of the adjoint variables is described. The numerical results show that similar correlations between the distribution functions can be seen between the corresponding adjoint ones. Besides, the results are promising, emphasizing the flow field adjoint variables can be evaluated via the adjoint distribution functions. Finally, the adjoint conservative laws are introduced.
Numerical solution of the Fokker--Planck equations for a multi-species plasma
Energy Technology Data Exchange (ETDEWEB)
Killeen, J.; Mirin, A.A.
1977-03-11
Two numerical models used for studying collisional multispecies plasmas are described. The mathematical model is the Boltzmann kinetic equation with Fokker-Planck collision terms. A one-dimensional code and a two-dimensional code, used for the solution of the time-dependent Fokker-Planck equations for ion and electron distribution functions in velocity space, are described. The required equations and boundary conditions are derived and numerical techniques for their solution are given.
Kadomtsev−Petviashvili equation for a flow of highly nonisothermal collisionless plasma
Energy Technology Data Exchange (ETDEWEB)
Movsesyants, Yu. B., E-mail: yumovsesyants@gmail.com [All-Russian Electrotechnical Institute (Russian Federation); Rukhadze, A. A., E-mail: rukh@fpl.gpi.ru [Russian Academy of Sciences, Prokhorov General Physics Institute (Russian Federation); Tyuryukanov, P. M. [All-Russian Electrotechnical Institute (Russian Federation)
2016-01-15
It is shown that the equations of two-fluid electrodynamics for a cold ions flow and Boltzmann electrons in the vicinity of the ion-sound point can be reduced to the Kadomtsev−Petviashvili equation. Examples of two-dimensional equilibria with pole singularities obtained by exactly solving the equations are presented. An exact self-similar solution describing a two-dimensional transonic flow and having no pole singularities is found.
A higher order lattice BGK model for simulating some nonlinear partial differential equations
Institute of Scientific and Technical Information of China (English)
LAI HuiLin; MA ChangFeng
2009-01-01
In this paper, we consider a one-dimensional nonlinear partial differential equation that has the form ut + αuux+βunux-γuxx+δuxxx= F(U). A higher order lattice Bhatnager-Gross-Krook (BGK) model with an amending-function is proposed. With the Chapman-Enskog expansion, different kinds of nonlinear partial differential equations are recovered correctly from the continuous Boltzmann equation. The numerical results show that this method is very effective.
A higher order lattice BGK model for simulating some nonlinear partial differential equations
Institute of Scientific and Technical Information of China (English)
无
2009-01-01
In this paper, we consider a one-dimensional nonlinear partial differential equation that has the form ut + αuux + βunux - γuxx + δuxxx = F(u). A higher order lattice Bhatnager-Gross-Krook (BGK) model with an amending-function is proposed. With the Chapman-Enskog expansion, different kinds of nonlinear partial differential equations are recovered correctly from the continuous Boltzmann equation. The numerical results show that this method is very effective.
Relativistic rotating Boltzmann gas using the tetrad formalism
Ambrus, Victor E
2015-01-01
We consider an application of the tetrad formalism introduced by Cardall et al. [Phys. Rev. D 88 (2013) 023011] to the problem of a rigidly rotating relativistic gas in thermal equilibrium and discuss the possible applications of this formalism to relativistic lattice Boltzmann simulations. We present in detail the transformation to the comoving frame, the choice of tetrad, as well as the explicit calculation and analysis of the components of the equilibrium particle flow four-vector and of the equilibrium stress-energy tensor.
Lattice-Boltzmann Method for Geophysical Plastic Flows
Leonardi, Alessandro; Mendoza, Miller; Herrmann, Hans J
2015-01-01
We explore possible applications of the Lattice-Boltzmann Method for the simulation of geophysical flows. This fluid solver, while successful in other fields, is still rarely used for geotechnical applications. We show how the standard method can be modified to represent free-surface realization of mudflows, debris flows, and in general any plastic flow, through the implementation of a Bingham constitutive model. The chapter is completed by an example of a full-scale simulation of a plastic fluid flowing down an inclined channel and depositing on a flat surface. An application is given, where the fluid interacts with a vertical obstacle in the channel.
Coupling lattice Boltzmann and molecular dynamics models for dense fluids
Dupuis, A.; Kotsalis, E. M.; Koumoutsakos, P.
2007-04-01
We propose a hybrid model, coupling lattice Boltzmann (LB) and molecular dynamics (MD) models, for the simulation of dense fluids. Time and length scales are decoupled by using an iterative Schwarz domain decomposition algorithm. The MD and LB formulations communicate via the exchange of velocities and velocity gradients at the interface. We validate the present LB-MD model in simulations of two- and three-dimensional flows of liquid argon past and through a carbon nanotube. Comparisons with existing hybrid algorithms and with reference MD solutions demonstrate the validity of the present approach.
Thrombosis modeling in intracranial aneurysms: a lattice Boltzmann numerical algorithm
Ouared, R.; Chopard, B.; Stahl, B.; Rüfenacht, D. A.; Yilmaz, H.; Courbebaisse, G.
2008-07-01
The lattice Boltzmann numerical method is applied to model blood flow (plasma and platelets) and clotting in intracranial aneurysms at a mesoscopic level. The dynamics of blood clotting (thrombosis) is governed by mechanical variations of shear stress near wall that influence platelets-wall interactions. Thrombosis starts and grows below a shear rate threshold, and stops above it. Within this assumption, it is possible to account qualitatively well for partial, full or no occlusion of the aneurysm, and to explain why spontaneous thrombosis is more likely to occur in giant aneurysms than in small or medium sized aneurysms.
Jet propagation within a Linearized Boltzmann Transport model
Energy Technology Data Exchange (ETDEWEB)
Luo, Tan; He, Yayun [Key Laboratory of Quark and Lepton Physics (MOE) and Institute of Particle Physics, Central China Normal University, Wuhan 430079 (China); Wang, Xin-Nian [Key Laboratory of Quark and Lepton Physics (MOE) and Institute of Particle Physics, Central China Normal University, Wuhan 430079 (China); Nuclear Science Division, Mailstop 70R0319, Lawrence Berkeley National Laboratory, Berkeley, CA 94740 (United States); Zhu, Yan [Departamento de Física de Partículas and IGFAE, Universidade de Santiago de Compostela, E-15706 Santiago de Compostela, Galicia (Spain)
2014-12-15
A Linearized Boltzmann Transport (LBT) model has been developed for the study of parton propagation inside quark–gluon plasma. Both leading and thermal recoiled partons are tracked in order to include the effect of jet-induced medium excitation. In this talk, we present a study within the LBT model in which we implement the complete set of elastic parton scattering processes. We investigate elastic parton energy loss and their energy and length dependence. We further investigate energy loss and transverse shape of reconstructed jets. Contributions from the recoiled thermal partons and jet-induced medium excitations are found to have significant influences on the jet energy loss and transverse profile.
Numerical Poisson-Boltzmann Model for Continuum Membrane Systems.
Botello-Smith, Wesley M; Liu, Xingping; Cai, Qin; Li, Zhilin; Zhao, Hongkai; Luo, Ray
2013-01-01
Membrane protein systems are important computational research topics due to their roles in rational drug design. In this study, we developed a continuum membrane model utilizing a level set formulation under the numerical Poisson-Boltzmann framework within the AMBER molecular mechanics suite for applications such as protein-ligand binding affinity and docking pose predictions. Two numerical solvers were adapted for periodic systems to alleviate possible edge effects. Validation on systems ranging from organic molecules to membrane proteins up to 200 residues, demonstrated good numerical properties. This lays foundations for sophisticated models with variable dielectric treatments and second-order accurate modeling of solvation interactions.
New approach to the solution of the Boltzmann radiation transport equation
Boffi, Vinicio C.; Dunn, William L.
1987-03-01
Transport monodimensional stationary solutions for the angular space-energy neutron flux, of interest in radiation penetration problems, are studied by Green's function method. Explicit analytical results for the spatial moments of the sought solution are obtained for the case of an isotropically scattering slab of infinite thickness and of a continuous slowing down model in energy.
Inelastic Quantum Transport in Superlattices: Success and Failure of the Boltzmann Equation
DEFF Research Database (Denmark)
Wacker, Andreas; Jauho, Antti-Pekka; Rott, Stephan;
1999-01-01
Electrical transport in semiconductor superlattices is studied within a fully self-consistent quantum transport model based on nonequilibrium Green functions, including phonon and impurity scattering. We compute both the drift-velocity-held relation and the momentum distribution function covering...
Puglisi, Andrea
2015-01-01
This brief offers a concise presentation of granular fluids from the point of view of non-equilibrium statistical physics. The emphasis is on fluctuations, which can be large in granular fluids due to the small system size (the number of grains is many orders of magnitude smaller than in molecular fluids). Firstly, readers will be introduced to the most intriguing experiments on fluidized granular fluids. Then granular fluid theory, which goes through increasing levels of coarse-graining and emerging collective phenomena, is described. Problems and questions are initially posed at the level of kinetic theory, which describes particle densities in full or reduced phase-space. Some answers become clear through hydrodynamics, which describes the evolution of slowly evolving fields. Granular fluctuating hydrodynamics, which builds a bridge to the most recent results in non-equilibrium statistical mechanics, is also introduced. Further and more interesting answers come when the dynamics of a massive intruder are...
Energy Technology Data Exchange (ETDEWEB)
Clarke, Peter; Varghese, Philip; Goldstein, David [ASE-EM Department, UT Austin, 210 East 24th St, C0600, Austin, TX 78712 (United States)
2014-12-09
We extend a variance reduced discrete velocity method developed at UT Austin [1, 2] to gas mixtures with large mass ratios and flows with trace species. The mixture is stored as a collection of independent velocity distribution functions, each with a unique grid in velocity space. Different collision types (A-A, A-B, B-B, etc.) are treated independently, and the variance reduction scheme is formulated with different equilibrium functions for each separate collision type. The individual treatment of species enables increased focus on species important to the physics of the flow, even if the important species are present in trace amounts. The method is verified through comparisons to Direct Simulation Monte Carlo computations and the computational workload per time step is investigated for the variance reduced method.
Normal Solutions of the Boltzmann Equation for Fourier and Couette Flow
Torczynski, J. R.
2005-11-01
Bird's Direct Simulation Monte Carlo (DSMC) method is used to simulate Fourier flow (uniform heat flux) and Couette flow (uniform shear stress) for highly nonequilibrium conditions. The gas is confined between two parallel, fully-accommodating walls at unequal temperatures with opposite tangential velocities. For small system Knudsen numbers, the solution is normal in the central region of the domain (outside the Knudsen layers). For small heat-flux Knudsen numbers, the normal solution exhibits Chapman-Enskog (CE) behavior. More specifically, excellent agreement is observed between the DSMC and CE thermal conductivity, viscosity, and Sonine-polynomial coefficients of the molecular velocity distribution function. At larger heat-flux Knudsen numbers, the normal solution systematically departs from the CE solution. Under these conditions, the DSMC results for Maxwell molecules are in excellent agreement with the exact solution of Santos and co-workers, and the DSMC results for hard-sphere molecules exhibit similar trends. Sandia is a multiprogram laboratory operated by Sandia Corporation, a Lockheed Martin Company, for the United States Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000.
Magnus, Wilhelm
2004-01-01
The hundreds of applications of Hill's equation in engineering and physics range from mechanics and astronomy to electric circuits, electric conductivity of metals, and the theory of the cyclotron. New applications are continually being discovered and theoretical advances made since Liapounoff established the equation's fundamental importance for stability problems in 1907. Brief but thorough, this volume offers engineers and mathematicians a complete orientation to the subject.""Hill's equation"" connotes the class of homogeneous, linear, second order differential equations with real, period
Directory of Open Access Journals (Sweden)
Savita Agrawal
2015-11-01
Full Text Available In the last decades, image segmentation has proved its applicability in various areas like satellite image processing, medical image processing and many more. In the present scenario the researchers tries to develop hybrid image segmentation techniques to generates efficient segmentation. Due to the development of the parallel programming, the lattice Boltzmann method (LBM has attracted much attention as a fast alternative approach for solving partial differential equations. In this project work, first designed an energy functional based on the fuzzy c-means objective function which incorporates the bias field that accounts for the intensity in homogeneity of the real-world image. Using the gradient descent method, corresponding level set equations are obtained from which we deduce a fuzzy external force for the LBM solver based on the model by Zhao. The method is speedy, robust for denoise, and does not dependent on the position of the initial contour, effective in the presence of intensity in homogeneity, highly parallelizable and can detect objects with or without edges. For the implementation of segmentation techniques defined for gray images, most of the time researchers determines single channel segments of the images and superimposes the single channel segment information on color images. This idea leads to provide color image segmentation using single channel segments of multi channel images. Though this method is widely adopted but doesn’t provide complete true segmentation of multichannel ie color images because a color image contains three different channels for Red, green and blue components. Hence segmenting a color image, by having only single channel segments information, will definitely loose important segment regions of color images. To overcome this problem this paper work starts with the development of Enhanced Level Set Segmentation for single channel Images Using Fuzzy Clustering and Lattice Boltzmann Method. For the
Directory of Open Access Journals (Sweden)
Savita Agrawal
2014-05-01
Full Text Available In the last decades, image segmentation has proved its applicability in various areas like satellite image processing, medical image processing and many more. In the present scenario the researchers tries to develop hybrid image segmentation techniques to generates efficient segmentation. Due to the development of the parallel programming, the lattice Boltzmann met hod (LBM has attracted much attention as a fast alternative approach for solving partial differential equations. In this project work, first designed an energy functional based on the fuzzy c-means objective function which incorporates the bias field that accounts for the intensity in homogeneity of the real-world image. Using the gradient descent method, corresponding level set equations are obtained from which we deduce a fuzzy external force for the LBM solver based on the model by Zhao. The method is speedy, robust for denoise, and does not dependent on the position of the initial contour, effective in the presence of intensity in homogeneity, highly parallelizable and can detect objects with or without edges. For the implementation of segmentation techniques defined for gr ay images, most of the time researchers determines single channel segments of the images and superimposes the single channel segment information on color images. This idea leads to provide color image segmentation using single channel segments of multi chann el images. Though this method is widely adopted but doesn’t provide complete true segmentation of multichannel ie color images because a color image contains three different channels for Red, green and blue components. Hence segmenting a color image, b y having only single channel segments information, will definitely loose important segment regions of color images. To overcome this problem this paper work starts with the development of Enhanced Level Set Segmentation for single channel Images Using Fuzzy Clustering and Lattice Boltzmann Method. For the
Energy Technology Data Exchange (ETDEWEB)
Elton, A.B.H.
1990-09-24
A numerical theory for the massively parallel lattice gas and lattice Boltzmann methods for computing solutions to nonlinear advective-diffusive systems is introduced. The convergence theory is based on consistency and stability arguments that are supported by the discrete Chapman-Enskog expansion (for consistency) and conditions of monotonicity (in establishing stability). The theory is applied to four lattice methods: Two of the methods are for some two-dimensional nonlinear diffusion equations. One of the methods is for the one-dimensional lattice method for the one-dimensional viscous Burgers equation. And one of the methods is for a two-dimensional nonlinear advection-diffusion equation. Convergence is formally proven in the L{sub 1}-norm for the first three methods, revealing that they are second-order, conservative, conditionally monotone finite difference methods. Computational results which support the theory for lattice methods are presented. In addition, a domain decomposition strategy using mesh refinement techniques is presented for lattice gas and lattice Boltzmann methods. The strategy allows concentration of computational resources on regions of high activity. Computational evidence is reported for the strategy applied to the lattice gas method for the one-dimensional viscous Burgers equation. 72 refs., 19 figs., 28 tabs.
Huang, Rongzong; Wu, Huiying
2015-08-01
In this paper, phase interface effects, including the differences in thermophysical properties between solid and liquid phases and the numerical diffusion across phase interface, are investigated for the recently developed total enthalpy-based lattice Boltzmann model for solid-liquid phase change, which has high computational efficiency by avoiding iteration procedure and linear equation system solving. For the differences in thermophysical properties (thermal conductivity and specific heat) between solid and liquid phases, a novel reference specific heat is introduced to improve the total enthalpy-based lattice Boltzmann model, which makes the thermal conductivity and specific heat decoupled. Therefore, the differences in thermal conductivity and specific heat can be handled by the dimensionless relaxation time and equilibrium distribution function, respectively. As for the numerical diffusion across phase interface, it is revealed for the first time and found to be induced by solid-liquid phase change. To reduce such numerical diffusion, multiple-relaxation-time collision scheme is exploited, and a special value (one fourth) for the so-called "magic" parameter, a combination of two relaxation parameters, is found. Numerical tests show that the differences in thermophysical properties can be correctly handled and the numerical diffusion across phase interface can be dramatically reduced. Finally, theoretical analyses are carried out to offer insights into the roles of the reference specific heat and "magic" parameter in the treatments of phase interface effects.
Fiorentino, Eve-Agnès; Toussaint, Renaud; Jouniaux, Laurence
2017-02-01
The streaming potential phenomenon is an electrokinetic effect that occurs in porous media. It is characterized by an electrokinetic (EK) coefficient. The aim of this paper is to simulate the EK coefficient in unsaturated conditions using the Lattice Boltzmann method in a 2-D capillary channel. The multiphase flow is simulated with the model of Shan & Chen. The Poisson-Boltzmann equation is solved by implementing the model of Chai & Shi. The streaming potential response shows a non-monotonous behaviour due to the combination of the increase of charge density and decrease of flow velocity with decreasing water saturation. Using a ζ potential of -20 mV at the air-water interface, an enhancement of a factor 5-30 of the EK coefficient, compared to the saturated state, can be observed due to the positive charge excess at this interface which is magnified by the fluid velocity away from the rock surface. This enhancement is correlated to the fractioning of the bubbles, and to the dynamic state of these bubbles, moving or entrapped in the crevices of the channel.
Detection of Hypertension Retinopathy Using Deep Learning and Boltzmann Machines
Triwijoyo, B. K.; Pradipto, Y. D.
2017-01-01
hypertensive retinopathy (HR) in the retina of the eye is disturbance caused by high blood pressure disease, where there is a systemic change of arterial in the blood vessels of the retina. Most heart attacks occur in patients caused by high blood pressure symptoms of undiagnosed. Hypertensive retinopathy Symptoms such as arteriolar narrowing, retinal haemorrhage and cotton wool spots. Based on this reasons, the early diagnosis of the symptoms of hypertensive retinopathy is very urgent to aim the prevention and treatment more accurate. This research aims to develop a system for early detection of hypertension retinopathy stage. The proposed method is to determine the combined features artery and vein diameter ratio (AVR) as well as changes position with Optic Disk (OD) in retinal images to review the classification of hypertensive retinopathy using Deep Neural Networks (DNN) and Boltzmann Machines approach. We choose this approach of because based on previous research DNN models were more accurate in the image pattern recognition, whereas Boltzmann machines selected because It requires speedy iteration in the process of learning neural network. The expected results from this research are designed a prototype system early detection of hypertensive retinopathy stage and analysed the effectiveness and accuracy of the proposed methods.
Avoiding Boltzmann Brain domination in holographic dark energy models
Horvat, R
2015-01-01
In a spatially infinite and eternal universe approaching ultimately a de Sitter (or quasi-de Sitter) regime, structure can form by thermal fluctuations as such a space is thermal. The models of Dark Energy invoking holographic principle fit naturally into such a category, and spontaneous formation of isolated brains in otherwise empty space seems the most perplexing, creating the paradox of Boltzmann Brains (BB). It is thus appropriate to ask if such models can be made free from domination by Boltzmann Brains. Here we consider only the simplest model, but adopt both the local and the global viewpoint in the description of the Universe. In the former case, we find that if a parameter $c$, which modulates the Dark Energy density, lies outside the exponentially narrow strip around the most natural $c = 1$ line, the theory is rendered BB-safe. In the later case, the bound on $c$ is exponentially stronger, and seemingly at odds with those bounds on $c$ obtained from various observational tests.
Avoiding Boltzmann Brain domination in holographic dark energy models
Horvat, R.
2015-11-01
In a spatially infinite and eternal universe approaching ultimately a de Sitter (or quasi-de Sitter) regime, structure can form by thermal fluctuations as such a space is thermal. The models of Dark Energy invoking holographic principle fit naturally into such a category, and spontaneous formation of isolated brains in otherwise empty space seems the most perplexing, creating the paradox of Boltzmann Brains (BB). It is thus appropriate to ask if such models can be made free from domination by Boltzmann Brains. Here we consider only the simplest model, but adopt both the local and the global viewpoint in the description of the Universe. In the former case, we find that if a dimensionless model parameter c, which modulates the Dark Energy density, lies outside the exponentially narrow strip around the most natural c = 1 line, the theory is rendered BB-safe. In the latter case, the bound on c is exponentially stronger, and seemingly at odds with those bounds on c obtained from various observational tests.
Wall Orientation and Shear Stress in the Lattice Boltzmann Model
Matyka, Maciej; Mirosław, Łukasz
2013-01-01
The wall shear stress is a quantity of profound importance for clinical diagnosis of artery diseases. The lattice Boltzmann is an easily parallelizable numerical method of solving the flow problems, but it suffers from errors of the velocity field near the boundaries which leads to errors in the wall shear stress and normal vectors computed from the velocity. In this work we present a simple formula to calculate the wall shear stress in the lattice Boltzmann model and propose to compute wall normals, which are necessary to compute the wall shear stress, by taking the weighted mean over boundary facets lying in a vicinity of a wall element. We carry out several tests and observe an increase of accuracy of computed normal vectors over other methods in two and three dimensions. Using the scheme we compute the wall shear stress in an inclined and bent channel fluid flow and show a minor influence of the normal on the numerical error, implying that that the main error arises due to a corrupted velocity field near ...
Avoiding Boltzmann Brain domination in holographic dark energy models
Directory of Open Access Journals (Sweden)
R. Horvat
2015-11-01
Full Text Available In a spatially infinite and eternal universe approaching ultimately a de Sitter (or quasi-de Sitter regime, structure can form by thermal fluctuations as such a space is thermal. The models of Dark Energy invoking holographic principle fit naturally into such a category, and spontaneous formation of isolated brains in otherwise empty space seems the most perplexing, creating the paradox of Boltzmann Brains (BB. It is thus appropriate to ask if such models can be made free from domination by Boltzmann Brains. Here we consider only the simplest model, but adopt both the local and the global viewpoint in the description of the Universe. In the former case, we find that if a dimensionless model parameter c, which modulates the Dark Energy density, lies outside the exponentially narrow strip around the most natural c=1 line, the theory is rendered BB-safe. In the latter case, the bound on c is exponentially stronger, and seemingly at odds with those bounds on c obtained from various observational tests.
Contact angles in the pseudopotential lattice Boltzmann modeling of wetting
Li, Qing; Luo, K. H.; Kang, Q. J.; Chen, Q.
2014-11-01
In this paper we investigate the implementation of contact angles in the pseudopotential lattice Boltzmann modeling of wetting at a large density ratio ρL/ρV=500 . The pseudopotential lattice Boltzmann model [X. Shan and H. Chen, Phys. Rev. E 49, 2941 (1994), 10.1103/PhysRevE.49.2941] is a popular mesoscopic model for simulating multiphase flows and interfacial dynamics. In this model the contact angle is usually realized by a fluid-solid interaction. Two widely used fluid-solid interactions, the density-based interaction and the pseudopotential-based interaction, as well as a modified pseudopotential-based interaction formulated in the present paper are numerically investigated and compared in terms of the achievable contact angles, the maximum and the minimum densities, and the spurious currents. It is found that the pseudopotential-based interaction works well for simulating small static (liquid) contact angles θ static contact angles close to 180∘. Meanwhile, it is found that the proposed modified pseudopotential-based interaction performs better in light of the maximum and the minimum densities and is overall more suitable for simulating large contact angles θ >90∘ as compared with the two other types of fluid-solid interactions. Furthermore, the spurious currents are found to be enlarged when the fluid-solid interaction force is introduced. Increasing the kinematic viscosity ratio between the vapor and liquid phases is shown to be capable of reducing the spurious currents caused by the fluid-solid interactions.
Haubold, H. J.; Mathai, A. M.; Saxena, R. K.
2004-01-01
Classical statistical mechanics of macroscopic systems in equilibrium is based on Boltzmann's principle. Tsallis has proposed a generalization of Boltzmann-Gibbs statistics. Its relation to dynamics and nonextensivity of statistical systems are matters of intense investigation and debate. This essay review has been prepared at the occasion of awarding the 'Mexico Prize for Science and Technology 2003'to Professor Constantino Tsallis from the Brazilian Center for Research in Physics.
Boltzmann and Einstein: Statistics and dynamics –An unsolved problem
Indian Academy of Sciences (India)
E G D Cohen
2005-05-01
The struggle of Boltzmann with the proper description of the behavior of classical macroscopic bodies in equilibrium in terms of the properties of the particles out of which they consist will be sketched. He used both a dynamical and a statistical method. However, Einstein strongly disagreed with Boltzmann's statistical method, arguing that a statistical description of a system should be based on the dynamics of the system. This opened the way, especially for complex systems, for other than Boltzmann statistics. The first non-Boltzmann statistics, not based on dynamics though, was proposed by Tsallis. A generalization of Tsallis' statistics as a special case of a new class of superstatistics, based on Einstein's criticism of Boltzmann, is discussed. It seems that perhaps a combination of dynamics and statistics is necessary to describe systems with complicated dynamics.
Amiri Delouei, A; Nazari, M; Kayhani, M H; Succi, S
2014-05-01
In this study, the immersed boundary-thermal lattice Boltzmann method has been used to simulate non-Newtonian fluid flow over a heated circular cylinder. The direct-forcing algorithm has been employed to couple the off-lattice obstacles and on-lattice fluid nodes. To investigate the effect of boundary sharpness, two different diffuse interface schemes are considered to interpolate the velocity and temperature between the boundary and computational grid points. The lattice Boltzmann equation with split-forcing term is applied to consider the effects of the discrete lattice and the body force to the momentum flux, simultaneously. A method for calculating the Nusselt number based on diffuse interface schemes is developed. The rheological and thermal properties of non-Newtonian fluids are investigated under the different power-law indices and Reynolds numbers. The effect of numerical parameters on the accuracy of the proposed method has been investigated in detail. Results show that the rheological and thermal properties of non-Newtonian fluids in the presence of a heated immersed body can be suitably captured using the immersed boundary thermal lattice Boltzmann method.
Park, J.; Matsubara, M.; Li, X.
The electrode of a PEM fuel cell is a porous medium generally made of carbon cloth or paper. Such a porous electrode has been widely modeled as a homogeneous porous medium with a constant permeability in the literature of PEM fuel cell. In fact, most of gas diffusion media are not homogeneous having non-isotropic permeability. In case of carbon cloth, the porous structure consists of carbon fiber tows, the bundles of carbon fiber, and void spaces among tows. The combinational effect of the void space and tow permeability results in the effective permeability of the porous electrode. In this work, the lattice Boltzmann method is applied to the simulation of the flow in the electrode of a PEM fuel cell. The electrode is modeled as void space and porous region which has certain permeability and the Stokes and Brinkman equations are solved in the flow field using the lattice Boltzmann model. The effective permeability of the porous medium is calculated and compared to an analytical calculation showing a good agreement. It has been shown that the permeability of porous medium is strongly dependant on the fiber tow orientation in three-dimensional simulations. The lattice Boltzmann method is an efficient and effective numerical scheme to analyze the flow in a complicated geometry such as the porous medium.
Tamashiro, M. N.; Schiessel, H.
2003-07-01
The Poisson-Boltzmann (PB) spherical Wigner-Seitz cell model—introduced to theoretically describe suspensions of spherical charged colloidal particles—is investigated at the nonlinear and linearized levels. The linearization of the mean-field PB functional yields linearized Debye-Hückel-type equations agreeing asymptotically with the nonlinear PB results in the weak-coupling (high-temperature) limit. Both the canonical (fixed number of microions) as well as the semigrand-canonical (in contact with an infinite salt reservoir) cases are considered and discussed in a unified linearized framework. In disagreement with the exact nonlinear PB solution inside a Wigner-Seitz cell, the linearized theory predicts the occurrence of a thermodynamical instability with an associated phase separation of the homogeneous suspension into dilute (gas) and dense (liquid) phases, being thus a spurious result of the linearization. We show that these artifacts, although thermodynamically consistent with quadratic expansions of the nonlinear functional and osmotic pressure, may be traced back to the nonfulfillment of the underlying assumptions of the linearization. This raises questions about the reliability of the prediction of gas/liquid-like phase separation in deionized aqueous suspensions of charged colloids mediated by monovalent counterions obtained by linearized theories.
Electronic transport in VO{sub 2}—Experimentally calibrated Boltzmann transport modeling
Energy Technology Data Exchange (ETDEWEB)
Kinaci, Alper; Rosenmann, Daniel; Chan, Maria K. Y., E-mail: debasish.banerjee@toyota.com, E-mail: mchan@anl.gov [Center for Nanoscale Materials, Argonne National Laboratory, Argonne, Illinois 60439 (United States); Kado, Motohisa [Higashifuji Technical Center, Toyota Motor Corporation, Susono, Shizuoka 410-1193 (Japan); Ling, Chen; Zhu, Gaohua; Banerjee, Debasish, E-mail: debasish.banerjee@toyota.com, E-mail: mchan@anl.gov [Materials Research Department, Toyota Motor Engineering and Manufacturing North America, Inc., Ann Arbor, Michigan 48105 (United States)
2015-12-28
Materials that undergo metal-insulator transitions (MITs) are under intense study, because the transition is scientifically fascinating and technologically promising for various applications. Among these materials, VO{sub 2} has served as a prototype due to its favorable transition temperature. While the physical underpinnings of the transition have been heavily investigated experimentally and computationally, quantitative modeling of electronic transport in the two phases has yet to be undertaken. In this work, we establish a density-functional-theory (DFT)-based approach with Hubbard U correction (DFT + U) to model electronic transport properties in VO{sub 2} in the semiconducting and metallic regimes, focusing on band transport using the Boltzmann transport equations. We synthesized high quality VO{sub 2} films and measured the transport quantities across the transition, in order to calibrate the free parameters in the model. We find that the experimental calibration of the Hubbard correction term can efficiently and adequately model the metallic and semiconducting phases, allowing for further computational design of MIT materials for desirable transport properties.
Coupled Boltzmann computation of mixed axion neutralino dark matter in the SUSY DFSZ axion model
Bae, Kyu Jung; Lessa, Andre; Serce, Hasan
2014-01-01
The supersymmetrized DFSZ axion model is highly motivated not only because it offers solutions to both the gauge hierarchy and strong CP problems, but also because it provides a solution to the SUSY mu problem which naturally allows for a Little Hierarchy. We compute the expected mixed axion-neutralino dark matter abundance for the SUSY DFSZ axion model in two benchmark cases-- a natural SUSY model with a standard neutralino underabundance (SUA) and an mSUGRA/CMSSM model with a standard overabundance (SOA). Our computation implements coupled Boltzmann equations which track the radiation density along with neutralino, axion (produced thermally (TH) and via coherent oscillations (CO)), saxion (TH- and CO-produced), axino and gravitino densities. In the SUSY DFSZ model, axions, axinos and saxions go through the process of freeze-in-- in contrast to freeze-out or out-of-equilibrium production as in the SUSY KSVZ model-- resulting in thermal yields which are largely independent of the re-heat temperature. We find ...
A lattice Boltzmann method for axisymmetric multicomponent flows with high viscosity ratio
Liu, Haihu; Wu, Lei; Ba, Yan; Xi, Guang; Zhang, Yonghao
2016-12-01
A color-gradient lattice Boltzmann method (LBM) is proposed to simulate axisymmetric multicomponent flows. This method uses a collision operator that is a combination of three separate parts, namely single-component collision operator, perturbation operator, and recoloring operator. A source term is added into the single-component collision operator such that in each single-component region the axisymmetric continuity and momentum equations can be exactly recovered. The interfacial tension effect is realized by the perturbation operator, in which an interfacial force of axisymmetric form is derived using the concept of continuum surface force. A recoloring operator proposed by Latva-Kokko and Rothman is extended to the axisymmetric case for phase segregation and maintenance of the interface. To enhance the method's numerical stability for handling binary fluids with high viscosity ratio, a multiple-relaxation-time model is used for the collision operator. Several numerical examples, including static droplet test, oscillation of a viscous droplet, and breakup of a liquid thread, are presented to test the capability and accuracy of the proposed color-gradient LBM. It is found that the present method is able to accurately capture the phase interface and produce low spurious velocities. Also, the LBM results are all in good agreement with the analytical solutions and/or available experimental data for a very broad range of viscosity ratios.
Effects of a phase transition on HBT correlations in an integrated Boltzmann+Hydrodynamics approach
Li, Qingfeng; Petersen, Hannah; Bleicher, Marcus; Stoecker, Horst
2008-01-01
A systematic study of HBT radii of pions, produced in heavy ion collisions in the intermediate energy regime (SPS), from an integrated (3+1)d Boltzmann+hydrodynamics approach is presented. The calculations in this hybrid approach, incorporating an hydrodynamic stage into the Ultra-relativistic Quantum Molecular Dynamics (UrQMD) transport model, allow for a comparison of different equations of state (EoS) retaining the same initial conditions and final freeze-out. The results are also compared to the pure cascade transport model calculations in the context of the available data. Furthermore, the effect of different treatments of the hydrodynamic freeze-out procedure on the HBT radii are investigated. It is found that the HBT radii are essentially insensitive to the details of the freeze-out prescription as long as the final state interactions in the cascade are taken into account. The HBT radii $R_L$ and $R_O$ and the $R_O/R_S$ ratio are sensitive to the EoS that is employed during the hydrodynamic evolution. ...
Li, Q; Li, X J
2012-01-01
Owing to its conceptual simplicity and computational efficiency, the pseudopotential multiphase lattice Boltzmann (LB) model has attracted significant attention since its emergence. In this work, we aim to extend the pseudopotential LB model to the simulations of multiphase flows at large density ratio and relatively high Reynolds number. First, based on our recent work [Li et al., Phys. Rev. E. 86, 016709 (2012)], an improved forcing scheme is proposed for the multiple-relaxation-time (MRT) pseudopotential LB model in order to achieve thermodynamic consistency and large density ratio in the model. Next, through investigating the effects of the parameter a in the Carnahan-Starling equation of state, we find that, as compared with a = 1, a = 0.25 is capable of greatly reducing the magnitude of the spurious currents at large density ratio. Furthermore, it is found that a lower liquid viscosity can be gained in the pseudopotential LB model by increasing the kinematic viscosity ratio between the vapor and liquid ...
Lattice Boltzmann simulations for proton transport in 2-D model channels of Nafion.
Akinaga, Yoshinobu; Hyodo, Shi-aki; Ikeshoji, Tamio
2008-10-01
Proton conductance in a 2-D channel with a slab-like structure was studied to verify that the lattice Boltzmann method (LBM) can be used as a simulation tool for proton conduction in a Nafion membrane, which is a mesoscopic system with a highly disordered porous structure. Diffusion resulting from a concentration gradient and migration by an electrostatic force were considered as the origins of proton transport. The electrostatic force acting on a proton was computed by solving the Poisson equation. The proton concentration in the membrane is expressed as a continuous function and the sulfonic charge is placed discretely. The space-averaged conductance of protons in a nonequilibrium stationary state was evaluated as a function of the structural parameters: namely, channel width and distribution of the sulfonic groups. The resulting space-averaged conductance deviates from the bulk values, depending particularly on the sulfonic group distribution. Details of the simulation scheme are described and the applicability of the present scheme to real membranes is discussed.
Least-squares finite-element scheme for the lattice Boltzmann method on an unstructured mesh.
Li, Yusong; LeBoeuf, Eugene J; Basu, P K
2005-10-01
A numerical model of the lattice Boltzmann method (LBM) utilizing least-squares finite-element method in space and the Crank-Nicolson method in time is developed. This method is able to solve fluid flow in domains that contain complex or irregular geometric boundaries by using the flexibility and numerical stability of a finite-element method, while employing accurate least-squares optimization. Fourth-order accuracy in space and second-order accuracy in time are derived for a pure advection equation on a uniform mesh; while high stability is implied from a von Neumann linearized stability analysis. Implemented on unstructured mesh through an innovative element-by-element approach, the proposed method requires fewer grid points and less memory compared to traditional LBM. Accurate numerical results are presented through two-dimensional incompressible Poiseuille flow, Couette flow, and flow past a circular cylinder. Finally, the proposed method is applied to estimate the permeability of a randomly generated porous media, which further demonstrates its inherent geometric flexibility.
Poisson-Boltzmann model of electrolytes containing uniformly charged spherical nanoparticles.
Bohinc, Klemen; Volpe Bossa, Guilherme; Gavryushov, Sergei; May, Sylvio
2016-12-21
Like-charged macromolecules typically repel each other in aqueous solutions that contain small mobile ions. The interaction tends to turn attractive if mobile ions with spatially extended charge distributions are added. Such systems can be modeled within the mean-field Poisson-Boltzmann formalism by explicitly accounting for charge-charge correlations within the spatially extended ions. We consider an aqueous solution that contains a mixture of spherical nanoparticles with uniform surface charge density and small mobile salt ions, sandwiched between two like-charged planar surfaces. We perform the minimization of an appropriate free energy functional, which leads to a non-linear integral-differential equation for the electrostatic potential that we solve numerically and compare with predictions from Monte Carlo simulations. Nanoparticles with uniform surface charge density are contrasted with nanoparticles that have all their charges relocated at the center. Our mean-field model predicts that only the former (especially when large and highly charged particles) but not the latter are able to mediate attractive interactions between like-charged planar surfaces. We also demonstrate that at high salt concentration attractive interactions between like-charged planar surfaces turn into repulsion.
Li, Q
2013-01-01
In this paper, we aim to address an important issue about the pseudopotential lattice Boltzmann (LB) model, which has attracted much attention as a mesoscopic model for simulating interfacial dynamics of complex fluids, but suffers from the problem that the surface tension cannot be tuned independently of the density ratio. In the literature, a multi-range potential was devised to adjust the surface tension [Sbragaglia et al., Phys. Rev. E, 2007, 75, 026702; Sbragaglia et al. Soft Matter, 2012, 8, 10773]. However, this approach was found to be unable to keep the density ratio unchanged when the surface tension is adjusted. An alternative approach is therefore proposed in the present work. The basic strategy is to add a new source term to the LB equation so as to tune the surface tension of the pseudopotential LB model. The proposed approach can guarantee that the adjustment of the surface tension does not affect the mechanical stability condition of the pseudopotential LB model, and thus provides a separate c...
Moiseiwitsch, B L
2005-01-01
Two distinct but related approaches hold the solutions to many mathematical problems--the forms of expression known as differential and integral equations. The method employed by the integral equation approach specifically includes the boundary conditions, which confers a valuable advantage. In addition, the integral equation approach leads naturally to the solution of the problem--under suitable conditions--in the form of an infinite series.Geared toward upper-level undergraduate students, this text focuses chiefly upon linear integral equations. It begins with a straightforward account, acco
Energy Technology Data Exchange (ETDEWEB)
Borges, P. D., E-mail: pdborges@gmail.com, E-mail: lscolfaro@txstate.edu; Scolfaro, L., E-mail: pdborges@gmail.com, E-mail: lscolfaro@txstate.edu [Department of Physics, Texas State University, San Marcos, Texas 78666 (United States)
2014-12-14
The thermoelectric properties of indium nitride in the most stable wurtzite phase (w-InN) as a function of electron and hole concentrations and temperature were studied by solving the semiclassical Boltzmann transport equations in conjunction with ab initio electronic structure calculations, within Density Functional Theory. Based on maximally localized Wannier function basis set and the ab initio band energies, results for the Seebeck coefficient are presented and compared with available experimental data for n-type as well as p-type systems. Also, theoretical results for electric conductivity and power factor are presented. Most cases showed good agreement between the calculated properties and experimental data for w-InN unintentionally and p-type doped with magnesium. Our predictions for temperature and concentration dependences of electrical conductivity and power factor revealed a promising use of InN for intermediate and high temperature thermoelectric applications. The rigid band approach and constant scattering time approximation were utilized in the calculations.
Lattice Boltzmann method for shape optimization of fluid distributor
Wang, Limin; Luo, Lingai
2013-01-01
This paper presents the shape optimization of a flat-type arborescent fluid distributor for the purpose of process intensification. A shape optimization algorithm based on the lattice Boltzmann method (LBM) is proposed with the objective of decreasing the flow resistance of such distributor at the constraint of constant fluid volume. Prototypes of the initial distributor as well as the optimized one are designed. Fluid distribution and hydraulic characteristics of these distributors are investigated numerically. Results show that the pressure drop of the optimized distributor is between 15.9% and 25.1% lower than that of the initial reference while keeping a uniform flow distribution, demonstrating the process intensification in fluid distributor, and suggesting the interests of the proposed optimization algorithm in engineering optimal design.
Emergence of Compositional Representations in Restricted Boltzmann Machines
Tubiana, Jérôme
2016-01-01
Extracting automatically the complex set of features composing real high-dimensional data is crucial for achieving high performance in machine--learning tasks. Restricted Boltzmann Machines (RBM) are empirically known to be efficient for this purpose, and to be able to generate distributed and graded representations of the data. We characterize the structural conditions (sparsity of the weights, low effective temperature, nonlinearities in the activation functions of hidden units, and adaptation of fields maintaining the activity in the visible layer) allowing RBM to operate in such a compositional phase. Evidence is provided by the replica analysis of an adequate statistical ensemble of random RBMs and by RBM trained on the handwritten digits dataset MNIST.
Boundary Slip and Surface Interaction: A Lattice Boltzmann Simulation
Institute of Scientific and Technical Information of China (English)
CHEN Yan-Yan; YI Hou-Hui; LI Hua-Bing
2008-01-01
The factors affecting slip length in Couette geometry flows are analysed by means of a two-phase mesoscopic lattice Boltzmann model including non-ideal fluid-fluid and fluid-wall interactions.The main factors influencing the boundary slip are the strength of interactions between fluid-fluid and fluid-wall particles.Other factors,such as fluid viscosity,bulk pressure may also change the slip length.We find that boundary slip only occurs under a certain density(bulk pressure).If the density is large enough,the slip length will tend to zero.In our simulations,a low density layer near the wall does not need to be postulated a priori but emerges naturally from the underlying non-ideal mesoscopic dynamics.It is the low density layer that induces the boundary slip.The results may be helpful to understand recent experimental observations on the slippage of micro flows.
Free Surface Lattice Boltzmann with Enhanced Bubble Model
Anderl, Daniela; Rauh, Cornelia; Rüde, Ulrich; Delgado, Antonio
2016-01-01
This paper presents an enhancement to the free surface lattice Boltzmann method (FSLBM) for the simulation of bubbly flows including rupture and breakup of bubbles. The FSLBM uses a volume of fluid approach to reduce the problem of a liquid-gas two-phase flow to a single-phase free surface simulation. In bubbly flows compression effects leading to an increase or decrease of pressure in the suspended bubbles cannot be neglected. Therefore, the free surface simulation is augmented by a bubble model that supplies the missing information by tracking the topological changes of the free surface in the flow. The new model presented here is capable of handling the effects of bubble breakup and coalesce without causing a significant computational overhead. Thus, the enhanced bubble model extends the applicability of the FSLBM to a new range of practically relevant problems, like bubble formation and development in chemical reactors or foaming processes.
Lattice Boltzmann modeling of water-like fluids
Directory of Open Access Journals (Sweden)
Sauro eSucci
2014-04-01
Full Text Available We review recent advances on the mesoscopic modeling of water-like fluids,based on the lattice Boltzmann (LB methodology.The main idea is to enrich the basic LB (hydro-dynamics with angular degrees of freedom responding to suitable directional potentials between water-like molecules.The model is shown to reproduce some microscopic features of liquid water, such as an average number of hydrogen bonds per molecules (HBs between $3$ and $4$, as well as a qualitatively correctstatistics of the hydrogen bond angle as a function of the temperature.Future developments, based on the coupling the present water-like LB model with the dynamics of suspended bodies,such as biopolymers, may open new angles of attack to the simulation of complex biofluidic problems, such as protein folding and aggregation, and the motion of large biomolecules in complex cellular environments.
Determination of the Boltzmann Constant Using the Differential - Cylindrical Procedure
Feng, X J; Lin, H; Gillis, K A; Moldover, M R
2015-01-01
We report in this paper the progresses on the determination of the Boltzmann constant using the acoustic gas thermometer (AGT) of fixed-length cylindrical cavities. First, we present the comparison of the molar masses of pure argon gases through comparing speeds of sound of gases. The procedure is independent from the methodology by Gas Chromatography-Mass Spectrometry (GC-MS). The experimental results show good agreement between both methods. The comparison offers an independent inspection of the analytical results by GC-MS. Second, we present the principle of the novel differential-cylindrical procedure based on the AGT of two fixed-length cavities. The deletion mechanism for some major perturbations is analyzed for the new procedure. The experimental results of the differential-cylindrical procedure demonstrate some major improvements on the first, second acoustic and third virial coefficients, and the excess half-widths. The three acoustic virial coefficients agree well with the stated-of-the-art experime...
Approximate message passing with restricted Boltzmann machine priors
Tramel, Eric W.; Drémeau, Angélique; Krzakala, Florent
2016-07-01
Approximate message passing (AMP) has been shown to be an excellent statistical approach to signal inference and compressed sensing problems. The AMP framework provides modularity in the choice of signal prior; here we propose a hierarchical form of the Gauss-Bernoulli prior which utilizes a restricted Boltzmann machine (RBM) trained on the signal support to push reconstruction performance beyond that of simple i.i.d. priors for signals whose support can be well represented by a trained binary RBM. We present and analyze two methods of RBM factorization and demonstrate how these affect signal reconstruction performance within our proposed algorithm. Finally, using the MNIST handwritten digit dataset, we show experimentally that using an RBM allows AMP to approach oracle-support performance.
Spreading Dynamics of Nanodrops: A Lattice Boltzmann Study
Gross, Markus
2014-01-01
Spreading of nano-droplets is an interesting and technologically relevant phenomenon where thermal fluctuations lead to unexpected deviations from well-known deterministic laws. Here, we apply the newly developed fluctuating non-ideal lattice Boltzmann method [Gross et al., J. Stat. Mech., P03030 (2011)] for the study of this issue. Confirming the predictions of Davidovich and coworkers [PRL 95, 244905 (2005)], we provide the first independent evidence for the existence of an asymptotic, self-similar noise-driven spreading regime in both two- and three-dimensional geometry. The cross over from the deterministic Tanner's law, where the drop's base radius $b$ grows (in 3D) with time as $b \\sim t^{1/10}$ and the noise dominated regime where $b \\sim t^{1/6}$ is also observed by tuning the strength of thermal noise.
Modeling Image Structure with Factorized Phase-Coupled Boltzmann Machines
Cadieu, Charles F
2010-01-01
We describe a model for capturing the statistical structure of local amplitude and local spatial phase in natural images. The model is based on a recently developed, factorized third-order Boltzmann machine that was shown to be effective at capturing higher-order structure in images by modeling dependencies among squared filter outputs (Ranzato and Hinton, 2010). Here, we extend this model to $L_p$-spherically symmetric subspaces. In order to model local amplitude and phase structure in images, we focus on the case of two dimensional subspaces, and the $L_2$-norm. When trained on natural images the model learns subspaces resembling quadrature-pair Gabor filters. We then introduce an additional set of hidden units that model the dependencies among subspace phases. These hidden units form a combinatorial mixture of phase coupling distributions, concentrated in the sum and difference of phase pairs. When adapted to natural images, these distributions capture local spatial phase structure in natural images.
A Lattice Boltzmann Model for Oscillating Reaction-Diffusion
Rodríguez-Romo, Suemi; Ibañez-Orozco, Oscar; Sosa-Herrera, Antonio
2016-07-01
A computational algorithm based on the lattice Boltzmann method (LBM) is proposed to model reaction-diffusion systems. In this paper, we focus on how nonlinear chemical oscillators like Belousov-Zhabotinsky (BZ) and the chlorite-iodide-malonic acid (CIMA) reactions can be modeled by LBM and provide with new insight into the nature and applications of oscillating reactions. We use Gaussian pulse initial concentrations of sulfuric acid in different places of a bidimensional reactor and nondiffusive boundary walls. We clearly show how these systems evolve to a chaotic attractor and produce specific pattern images that are portrayed in the reactions trajectory to the corresponding chaotic attractor and can be used in robotic control.
Approximate Message Passing with Restricted Boltzmann Machine Priors
Tramel, Eric W; Krzakala, Florent
2015-01-01
Approximate Message Passing (AMP) has been shown to be an excellent statistical approach to signal inference and compressed sensing problem. The AMP framework provides modularity in the choice of signal prior; here we propose a hierarchical form of the Gauss-Bernouilli prior which utilizes a Restricted Boltzmann Machine (RBM) trained on the signal support to push reconstruction performance beyond that of simple iid priors for signals whose support can be well represented by a trained binary RBM. We present and analyze two methods of RBM factorization and demonstrate how these affect signal reconstruction performance within our proposed algorithm. Finally, using the MNIST handwritten digit dataset, we show experimentally that using an RBM allows AMP to approach oracle-support performance.
The peeling process of infinite Boltzmann planar maps
Budd, Timothy
2015-01-01
We start by studying a peeling process on finite random planar maps with faces of arbitrary degrees determined by a general weight sequence, which satisfies an admissibility criterion. The corresponding perimeter process is identified as a biased random walk, in terms of which the admissibility criterion has a very simple interpretation. The finite random planar maps under consideration were recently proved to possess a well-defined local limit known as the infinite Boltzmann planar map (IBPM). Inspired by recent work of Curien and Le Gall, we show that the peeling process on the IBPM can be obtained from the peeling process of finite random maps by conditioning the perimeter process to stay positive. The simplicity of the resulting description of the peeling process allows us to obtain the scaling limit of the associated perimeter and volume process for arbitrary regular critical weight sequences.
Simulating High Reynolds Number Flow by Lattice Boltzmann Method
Institute of Scientific and Technical Information of China (English)
KANG Xiu-Ying; LIU Da-He; ZHOU Jing; JIN Yong-Juan
2005-01-01
@@ A two-dimensional channel flow with different Reynolds numbers is tested by using the lattice Boltzmann method under different pressure and velocity boundary conditions. The results show that the simulation error increases,and the pressure and the flow rate become unstable under a high Reynolds number. To improve the simulation precision under a high Reynolds number, the number of fluid nodes should be enlarged. For a higher Reynoldsnumber flow, the velocity boundary with an approximately parabolic velocity profile is found to be more adaptive.Blood flow in an artery with cosine shape symmetrical narrowing is then simulated under a velocity boundary condition. Its velocity, pressure and wall shear stress distributions are consistent with previous studies.
From bijels to Pickering emulsions: A lattice Boltzmann study
Jansen, Fabian; Harting, Jens
2011-04-01
Particle stabilized emulsions are ubiquitous in the food and cosmetics industry, but our understanding of the influence of microscopic fluid-particle and particle-particle interactions on the macroscopic rheology is still limited. In this paper we present a simulation algorithm based on a multicomponent lattice Boltzmann model to describe the solvents combined with a molecular dynamics solver for the description of the solved particles. It is shown that the model allows a wide variation of fluid properties and arbitrary contact angles on the particle surfaces. We demonstrate its applicability by studying the transition from a “bicontinuous interfacially jammed emulsion gel” (bijel) to a “Pickering emulsion” in dependence on the contact angle, the particle concentration, and the ratio of the solvents.
Boltzmann-Shannon entropy and the double-slit experiment
Norwich, Kenneth H.
2016-11-01
We study the Boltzmann-Shannon entropy lost (information gained) by the observer in a double-slit experiment when the slit taken by a photon is known, and when the corresponding entropy gained by the photon at the level of the screen can be calculated. Using a Gedanken experiment involving infinitesimal slits and a distant cylindrical screen, entropy values assume a very simple form. The entropy changes (at the slit and screen) are found to be equal in magnitude and opposite in sign, and correspond to the minimum change permitted by Heisenberg's Uncertainty Principle. Moreover, when welcher Weg information is knowable a priori, we see that the "cost" of this information (knowing which slit is taken) is reversion to a single slit pattern.
Lattice Boltzmann simulations of convection heat transfer in porous media
Liu, Qing; He, Ya-Ling
2017-01-01
A non-orthogonal multiple-relaxation-time (MRT) lattice Boltzmann (LB) method is developed to study convection heat transfer in porous media at the representative elementary volume scale based on the generalized non-Darcy model. In the method, two different LB models are constructed: one is constructed in the framework of the double-distribution-function approach, and the other is constructed in the framework of the hybrid approach. In particular, the transformation matrices used in the MRT-LB models are non-orthogonal matrices. The present method is applied to study mixed convection flow in a porous channel and natural convection flow in a porous cavity. It is found that the numerical results are in good agreement with the analytical solutions and/or other results reported in previous studies. Furthermore, the non-orthogonal MRT-LB method shows better numerical stability in comparison with the BGK-LB method.
Modeling of metal foaming with lattice Boltzmann automata
Energy Technology Data Exchange (ETDEWEB)
Koerner, C.; Thies, M.; Singer, R.F. [WTM Institute, Department of Materials Science, University of Erlangen, Martensstrasse 5, D-91058 Erlangen (Germany)
2002-10-01
The formation and decay of foams produced by gas bubble expansion in a molten metal is numerically simulated with the Lattice Boltzmann Method (LBM) which belongs to the cellular automaton techniques. The present state of the two dimensional model allows the investigation of the foam evolution process comprising bubble expansion, bubble coalescence, drainage, and eventually foam collapse. Examples demonstrate the influence of the surface tension, viscosity and gravity on the foaming process and the resulting cell structure. In addition, the potential of the LBM to solve problems with complex boundary conditions is illustrated by means of a foam developing within the constraints of a mould as well as a foaming droplet exposed to gravity. (Abstract Copyright [2002], Wiley Periodicals, Inc.)
Lattice Boltzmann implementation for Fluids Flow Simulation in Porous Media
Directory of Open Access Journals (Sweden)
Xinming Zhang
2011-06-01
Full Text Available In this paper, the lattice-Boltzmann method is developed to investigate the behavior of isothermal two-phase fluid flow in porous media. The method is based on the Shan–Chen multiphase model of nonideal fluids that allow coexistence of two phases of a single substance. We reproduce some different idealized situations (phase separation, surface tension, contact angle, pipe flow, and fluid droplet motion, et al in which the results are already known from theory or laboratory measurements and show the validity of the implementation for the physical two-phase flow in porous media. Application of the method to fluid intrusion in porous media is discussed and shows the effect of wettability on the fluid flow. The capability of reproducing critical flooding phenomena under strong wettability conditions is also proved.
Lattice Boltzmann Simulation of Multiple Bubbles Motion under Gravity
Directory of Open Access Journals (Sweden)
Deming Nie
2015-01-01
Full Text Available The motion of multiple bubbles under gravity in two dimensions is numerically studied through the lattice Boltzmann method for the Eotvos number ranging from 1 to 12. Two kinds of initial arrangement are taken into account: vertical and horizontal arrangement. In both cases the effects of Eotvos number on the bubble coalescence and rising velocity are investigated. For the vertical arrangement, it has been found that the coalescence pattern is similar. The first coalescence always takes place between the two uppermost bubbles. And the last coalescence always takes place between the coalesced bubble and the bottommost bubble. For four bubbles in a horizontal arrangement, the outermost bubbles travel into the wake of the middle bubbles in all cases, which allows the bubbles to coalesce. The coalescence pattern is more complex for the case of eight bubbles, which strongly depends on the Eotvos number.
Yu, Huidan; Chen, Xi; Wang, Zhiqiang; Deep, Debanjan; Lima, Everton; Zhao, Ye; Teague, Shawn D
2014-06-01
In this paper, we develop a mass-conserved volumetric lattice Boltzmann method (MCVLBM) for numerically solving fluid dynamics with willfully moving arbitrary boundaries. In MCVLBM, fluid particles are uniformly distributed in lattice cells and the lattice Boltzmann equations deal with the time evolution of the particle distribution function. By introducing a volumetric parameter P(x,y,z,t) defined as the occupation of solid volume in the cell, we distinguish three types of lattice cells in the simulation domain: solid cell (pure solid occupation, P=1), fluid cell (pure fluid occupation, P=0), and boundary cell (partial solid and partial fluid, 0moving boundary and the flow; (2) streaming accompanying a volumetric bounce-back procedure in boundary cells; and (3) boundary-induced volumetric fluid migration moving the residual fluid particles into the flow domain when the boundary swipes over a boundary cell toward a solid cell. The MCVLBM strictly satisfies mass conservation and can handle irregular boundary orientation and motion with respect to the mesh. Validation studies are carried out in four cases. The first is to simulate fluid dynamics in syringes focusing on how MCVLBM captures the underlying physics of flow driven by a willfully moving piston. The second and third cases are two-dimensional (2D) peristaltic flow and three-dimensional (3D) pipe flow, respectively. In each case, we compare the MCVLBM simulation result with the analytical solution and achieve quantitatively good agreements. The fourth case is to simulate blood flow in human aortic arteries with a very complicated irregular boundary. We study steady flow in two dimensions and unsteady flow via the pulsation of the cardiac cycle in three dimensions. In the 2D case, both vector (velocity) and scalar (pressure) fields are compared to computation results from a well-established Navier-Stokes solver and reasonably good agreements are obtained. In the 3D case, the unsteady flow pattern and wall
Lattice Boltzmann Simulation of Multiphase Transport in Nanostructured PEM Fuel Cells
Stiles, Christopher D.
As the fossil fuel crisis becomes more critical, it is imperative to develop renewable sources of power generation. Polymer electrolyte membrane (PEM) fuel cells are considered a viable option. However, the cost of the platinum catalyst has hindered their commercialization. PEM fuel cells with platinum loading of >0.4 mg cm2 are common. Efforts towards further reducing this loading are currently underway utilizing nanostructured electrodes. A consequence of increased platinum utilization per unit area and thinner nanostructured electrodes is flooding, which is detrimental to fuel cell performance. Flooding causes a two-fold impact on cell performance: a drop in cell voltage and a rise in parasitic pumping power to overcome the increased pressure drop, which together result in a significant reduction in system efficiency. Proper water management is therefore crucial for optimum performance of the fuel cell and also for enhancing membrane durability. The goal of this thesis is to simulate the multiphase fluid transport in the nanostructured PEMFC of H2O in air with realistic density ratios. In order to pursue this goal, the ability of the pseudopotential based multiphase lattice Boltzmann method to realistically model the coexistence of the gas and liquid phases of H2O at low temperatures is explored. This method is expanded to include a gas mixture of O2 and N 2 into the multiphase H2O systems. Beginning with the examination of the phase transition region described by the current implementation of the multiphase pseudopotential lattice Boltzmann model. Following this, a modified form of the pressure term with the use of a scalar multiplier kappa for the Peng-Robinson equation of state is thoroughly investigated. This method proves to be very effective at enabling numerically stable simulations at low temperatures with large density ratios. It is found that for decreasing values of kappa, this model leads to an increase in multiphase interface thickness and a
Contact angles in the pseudopotential lattice Boltzmann modeling of wetting.
Li, Qing; Luo, K H; Kang, Q J; Chen, Q
2014-11-01
In this paper we investigate the implementation of contact angles in the pseudopotential lattice Boltzmann modeling of wetting at a large density ratio ρ_{L}/ρ_{V}=500. The pseudopotential lattice Boltzmann model [X. Shan and H. Chen, Phys. Rev. E 49, 2941 (1994)10.1103/PhysRevE.49.2941] is a popular mesoscopic model for simulating multiphase flows and interfacial dynamics. In this model the contact angle is usually realized by a fluid-solid interaction. Two widely used fluid-solid interactions, the density-based interaction and the pseudopotential-based interaction, as well as a modified pseudopotential-based interaction formulated in the present paper are numerically investigated and compared in terms of the achievable contact angles, the maximum and the minimum densities, and the spurious currents. It is found that the pseudopotential-based interaction works well for simulating small static (liquid) contact angles θstatic contact angles close to 180^{∘}. Meanwhile, it is found that the proposed modified pseudopotential-based interaction performs better in light of the maximum and the minimum densities and is overall more suitable for simulating large contact angles θ>90^{∘} as compared with the two other types of fluid-solid interactions. Furthermore, the spurious currents are found to be enlarged when the fluid-solid interaction force is introduced. Increasing the kinematic viscosity ratio between the vapor and liquid phases is shown to be capable of reducing the spurious currents caused by the fluid-solid interactions.
A Boltzmann machine for the organization of intelligent machines
Moed, Michael C.; Saridis, George N.
1989-01-01
In the present technological society, there is a major need to build machines that would execute intelligent tasks operating in uncertain environments with minimum interaction with a human operator. Although some designers have built smart robots, utilizing heuristic ideas, there is no systematic approach to design such machines in an engineering manner. Recently, cross-disciplinary research from the fields of computers, systems AI and information theory has served to set the foundations of the emerging area of the design of intelligent machines. Since 1977 Saridis has been developing an approach, defined as Hierarchical Intelligent Control, designed to organize, coordinate and execute anthropomorphic tasks by a machine with minimum interaction with a human operator. This approach utilizes analytical (probabilistic) models to describe and control the various functions of the intelligent machine structured by the intuitively defined principle of Increasing Precision with Decreasing Intelligence (IPDI) (Saridis 1979). This principle, even though resembles the managerial structure of organizational systems (Levis 1988), has been derived on an analytic basis by Saridis (1988). The purpose is to derive analytically a Boltzmann machine suitable for optimal connection of nodes in a neural net (Fahlman, Hinton, Sejnowski, 1985). Then this machine will serve to search for the optimal design of the organization level of an intelligent machine. In order to accomplish this, some mathematical theory of the intelligent machines will be first outlined. Then some definitions of the variables associated with the principle, like machine intelligence, machine knowledge, and precision will be made (Saridis, Valavanis 1988). Then a procedure to establish the Boltzmann machine on an analytic basis will be presented and illustrated by an example in designing the organization level of an Intelligent Machine. A new search technique, the Modified Genetic Algorithm, is presented and proved
Directory of Open Access Journals (Sweden)
Lloyd K. Williams
1987-01-01
Full Text Available In this paper we find closed form solutions of some Riccati equations. Attention is restricted to the scalar as opposed to the matrix case. However, the ones considered have important applications to mathematics and the sciences, mostly in the form of the linear second-order ordinary differential equations which are solved herewith.
Sharma, P; Mišković, Z L
2015-10-07
We present a model describing the electrostatic interactions across a structure that consists of a single layer of graphene with large area, lying above an oxide substrate of finite thickness, with its surface exposed to a thick layer of liquid electrolyte containing salt ions. Our goal is to analyze the co-operative screening of the potential fluctuation in a doped graphene due to randomness in the positions of fixed charged impurities in the oxide by the charge carriers in graphene and by the mobile ions in the diffuse layer of the electrolyte. In order to account for a possibly large potential drop in the diffuse later that may arise in an electrolytically gated graphene, we use a partially linearized Poisson-Boltzmann (PB) model of the electrolyte, in which we solve a fully nonlinear PB equation for the surface average of the potential in one dimension, whereas the lateral fluctuations of the potential in graphene are tackled by linearizing the PB equation about the average potential. In this way, we are able to describe the regime of equilibrium doping of graphene to large densities for arbitrary values of the ion concentration without restrictions to the potential drop in the electrolyte. We evaluate the electrostatic Green's function for the partially linearized PB model, which is used to express the screening contributions of the graphene layer and the nearby electrolyte by means of an effective dielectric function. We find that, while the screened potential of a single charged impurity at large in-graphene distances exhibits a strong dependence on the ion concentration in the electrolyte and on the doping density in graphene, in the case of a spatially correlated two-dimensional ensemble of impurities, this dependence is largely suppressed in the autocovariance of the fluctuating potential.
Prentis, Jeffrey J.
1996-05-01
One of the most challenging goals of a physics teacher is to help students see that the equations of physics are connected to each other, and that they logically unfold from a small number of basic ideas. Derivations contain the vital information on this connective structure. In a traditional physics course, there are many problem-solving exercises, but few, if any, derivation exercises. Creating an equation poem is an exercise to help students see the unity of the equations of physics, rather than their diversity. An equation poem is a highly refined and eloquent set of symbolic statements that captures the essence of the derivation of an equation. Such a poetic derivation is uncluttered by the extraneous details that tend to distract a student from understanding the essential physics of the long, formal derivation.