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The nonlocal Cahn-Hilliard (NCH) equation with nonlocal diffusion operator is more suitable for the simulation of microstructure phase transition than the local Cahn-Hilliard (LCH) equation. In this paper, based on the exponential semi-implicit scalar auxiliary variable (ESI-SAV) method, the highly effcient and accurate schemes in time with unconditional energy stability for solving the NCH equation are proposed. On the one hand, we have demostrated the unconditional energy stability for the NCH equation with its high-order semi-discrete schemes carefully and rigorously. On the other hand, in order to reduce the calculation and storage cost in numerical simulation, we use the fast solver based on FFT and FCG for spatial discretization. Some numerical simulations involving the Gaussian kernel are presented and show the stability, accuracy, efficiency and unconditional energy stability of the proposed schemes.

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Recent advancements in evaluating matrix-exponential functions have opened the doors to the practical use of exponential time-integration methods in numerical weather prediction (NWP). The success of exponential methods in shallow water simulations has led to the question of whether they can be beneficial in a 3D atmospheric model. In this paper, we take the first step forward by evaluating the behavior of exponential time-integration methods in the Navy's compressible deep-atmosphere nonhydrostatic global model (NEPTUNE-Navy Environmental Prediction sysTem Utilizing a Nonhydrostatic Engine). Simulations are conducted on a set of idealized test cases designed to assess key features of a nonhydrostatic model and demonstrate that exponential integrators capture the desired large and small-scale traits, yielding results comparable to those found in the literature. We propose a new upper boundary absorbing layer independent of reference state and shown to be effective in both idealized and real-data simulations. A real-data forecast using an exponential method with full physics is presented, providing a positive outlook for using exponential integrators for NWP.

Anomalous diffusion in the presence or absence of an external force field is often modelled in terms of the fractional evolution equations, which can involve the hyper-singular source term. For this case, conventional time stepping methods may exhibit a severe order reduction. Although a second-order numerical algorithm is provided for the subdiffusion model with a simple hyper-singular source term $t^{\mu}$, $-2<\mu<-1$ in [arXiv:2207.08447], the convergence analysis remain to be proved. To fill in these gaps, we present a simple and robust smoothing method for the hyper-singular source term, where the Hadamard finite-part integral is introduced. This method is based on the smoothing/ID$m$-BDF$k$ method proposed by the authors [Shi and Chen, SIAM J. Numer. Anal., to appear] for subdiffusion equation with a weakly singular source term. We prove that the $k$th-order convergence rate can be restored for the diffusion-wave case $\gamma \in (1,2)$ and sketch the proof for the subdiffusion case $\gamma \in (0,1)$, even if the source term is hyper-singular and the initial data is not compatible. Numerical experiments are provided to confirm the theoretical results.

A generalization of the Newton-based matrix splitting iteration method (GNMS) for solving the generalized absolute value equations (GAVEs) is proposed. Under mild conditions, the GNMS method converges to the unique solution of the GAVEs. Moreover, we can obtain a few weaker convergence conditions for some existing methods. Numerical results verify the effectiveness of the proposed method.

In highly diffusion regimes when the mean free path $\varepsilon$ tends to zero, the radiative transfer equation has an asymptotic behavior which is governed by a diffusion equation and the corresponding boundary condition. Generally, a numerical scheme for solving this problem has the truncation error containing an $\varepsilon^{-1}$ contribution, that leads to a nonuniform convergence for small $\varepsilon$. Such phenomenons require high resolutions of discretizations, which degrades the performance of the numerical scheme in the diffusion limit. In this paper, we first provide a--priori estimates for the scaled spherical harmonic ($P_N$) radiative transfer equation. Then we present an error analysis for the spherical harmonic discontinuous Galerkin (DG) method of the scaled radiative transfer equation showing that, under some mild assumptions, its solutions converge uniformly in $\varepsilon$ to the solution of the scaled radiative transfer equation. We further present an optimal convergence result for the DG method with the upwind flux on Cartesian grids. Error estimates of $\left(1+\mathcal{O}(\varepsilon)\right)h^{k+1}$ (where $h$ is the maximum element length) are obtained when tensor product polynomials of degree at most $k$ are used.

This article investigates the weak approximation towards the invariant measure of semi-linear stochastic differential equations (SDEs) under non-globally Lipschitz coefficients. For this purpose, we propose a linear-theta-projected Euler (LTPE) scheme, which also admits an invariant measure, to handle the potential influence of the linear stiffness. Under certain assumptions, both the SDE and the corresponding LTPE method are shown to converge exponentially to the underlying invariant measures, respectively. Moreover, with time-independent regularity estimates for the corresponding Kolmogorov equation, the weak error between the numerical invariant measure and the original one can be guaranteed with convergence of order one. In terms of computational complexity, the proposed ergodicity preserving scheme with the nonlinearity explicitly treated has a significant advantage over the ergodicity preserving implicit Euler method in the literature. Numerical experiments are provided to verify our theoretical findings.

Transition amplitudes and transition probabilities are relevant to many areas of physics simulation, including the calculation of response properties and correlation functions. These quantities can also be related to solving linear systems of equations. Here we present three related algorithms for calculating transition probabilities. First, we extend a previously published short-depth algorithm, allowing for the two input states to be non-orthogonal. Building on this first procedure, we then derive a higher-depth algorithm based on Trotterization and Richardson extrapolation that requires fewer circuit evaluations. Third, we introduce a tunable algorithm that allows for trading off circuit depth and measurement complexity, yielding an algorithm that can be tailored to specific hardware characteristics. Finally, we implement proof-of-principle numerics for models in physics and chemistry and for a subroutine in variational quantum linear solving (VQLS). The primary benefits of our approaches are that (a) arbitrary non-orthogonal states may now be used with small increases in quantum resources, (b) we (like another recently proposed method) entirely avoid subroutines such as the Hadamard test that may require three-qubit gates to be decomposed, and (c) in some cases fewer quantum circuit evaluations are required as compared to the previous state-of-the-art in NISQ algorithms for transition probabilities.

Iterative refinement (IR) is a popular scheme for solving a linear system of equations based on gradually improving the accuracy of an initial approximation. Originally developed to improve upon the accuracy of Gaussian elimination, interest in IR has been revived because of its suitability for execution on fast low-precision hardware such as analog devices and graphics processing units. IR generally converges when the error associated with the solution method is small, but is known to diverge when this error is large. We propose and analyze a novel enhancement to the IR algorithm by adding a line search optimization step that guarantees the algorithm will not diverge. Numerical experiments verify our theoretical results and illustrate the effectiveness of our proposed scheme.

Invariant finite-difference schemes for the one-dimensional shallow water equations in the presence of a magnetic field for various bottom topographies are constructed. Based on the results of the group classification recently carried out by the authors, finite-difference analogues of the conservation laws of the original differential model are obtained. Some typical problems are considered numerically, for which a comparison is made between the cases of a magnetic field presence and when it is absent (the standard shallow water model). The invariance of difference schemes in Lagrangian coordinates and the energy preservation on the obtained numerical solutions are also discussed.

In this paper we introduce a multilevel Picard approximation algorithm for semilinear parabolic partial integro-differential equations (PIDEs). We prove that the numerical approximation scheme converges to the unique viscosity solution of the PIDE under consideration. To that end, we derive a Feynman-Kac representation for the unique viscosity solution of the semilinear PIDE, extending the classical Feynman-Kac representation for linear PIDEs. Furthermore, we show that the algorithm does not suffer from the curse of dimensionality, i.e. the computational complexity of the algorithm is bounded polynomially in the dimension $d$ and the reciprocal of the prescribed accuracy $\varepsilon$. We also provide a numerical example in up to 10'000 dimensions to demonstrate its applicability.

Partial differential equations (PDEs) are used to describe a variety of physical phenomena. Often these equations do not have analytical solutions and numerical approximations are used instead. One of the common methods to solve PDEs is the finite element method. Computing derivative information of the solution with respect to the input parameters is important in many tasks in scientific computing. We extend JAX automatic differentiation library with an interface to Firedrake finite element library. High-level symbolic representation of PDEs allows bypassing differentiating through low-level possibly many iterations of the underlying nonlinear solvers. Differentiating through Firedrake solvers is done using tangent-linear and adjoint equations. This enables the efficient composition of finite element solvers with arbitrary differentiable programs. The code is available at github.com/IvanYashchuk/jax-firedrake.

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