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Author:

Wang, Min (Wang, Min.) (Scholars:王民) | Huang, Qiumei (Huang, Qiumei.) (Scholars:黄秋梅) | Wang, Cheng (Wang, Cheng.)

Indexed by:

EI Scopus SCIE

Abstract:

In this paper we propose and analyze a second order accurate (in time) numerical scheme for the square phase field crystal equation, a gradient flow modeling crystal dynamics at the atomic scale in space but on diffusive scales in time. Its primary difference with the standard phase field crystal model is an introduction of the 4-Laplacian term in the free energy potential, which in turn leads to a much higher degree of nonlinearity. To make the numerical scheme linear while preserving the nonlinear energy stability, we make use of the scalar auxiliary variable (SAV) approach, in which a second order backward differentiation formula is applied in the temporal stencil. Meanwhile, a direct application of the SAV method faces certain difficulties, due to the involvement of the 4-Laplacian term, combined with a derivation of the lower bound of the nonlinear energy functional. In the proposed numerical method, an appropriate decomposition for the physical energy functional is formulated, so that the nonlinear energy part has a well-established global lower bound, and the rest terms lead to constant-coefficient diffusion terms with positive eigenvalues. In turn, the numerical scheme could be very efficiently implemented by constant-coefficient Poisson-like type solvers (via FFT), and energy stability is established by introducing an auxiliary variable, and an optimal rate convergence analysis is provided for the proposed SAV method. A few numerical experiments are also presented, which confirm the efficiency and accuracy of the proposed scheme.

Keyword:

The Scalar auxiliary variable (SAV)method Energy stability Fourier pseudo-spectral approximation Second order BDF stencil Square phase field crystal equation Optimal rate convergence analysis

Author Community:

  • [ 1 ] [Wang, Min]Beijing Univ Technol, Fac Sci, Beijing 100124, Peoples R China
  • [ 2 ] [Huang, Qiumei]Beijing Univ Technol, Fac Sci, Beijing 100124, Peoples R China
  • [ 3 ] [Huang, Qiumei]Beijing Univ Technol, Beijing Inst Sci & Engn Comp, Beijing 100124, Peoples R China
  • [ 4 ] [Wang, Cheng]Univ Massachusetts, Dept Math, N Dartmouth, MA 02747 USA

Reprint Author's Address:

  • 黄秋梅

    [Huang, Qiumei]Beijing Univ Technol, Fac Sci, Beijing 100124, Peoples R China;;[Huang, Qiumei]Beijing Univ Technol, Beijing Inst Sci & Engn Comp, Beijing 100124, Peoples R China

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Source :

JOURNAL OF SCIENTIFIC COMPUTING

ISSN: 0885-7474

Year: 2021

Issue: 2

Volume: 88

2 . 5 0 0

JCR@2022

ESI Discipline: MATHEMATICS;

ESI HC Threshold:31

JCR Journal Grade:1

Cited Count:

WoS CC Cited Count: 88

SCOPUS Cited Count: 87

ESI Highly Cited Papers on the List: 15 Unfold All

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WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 12

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