Improved uniform error bounds on time-splitting methods for the long-time dynamics of the Dirac equation with small potentials

We establish improved uniform error bounds on time-splitting methods for the longtime dynamics of the Dirac equation with small electromagnetic potentials characterized by a dimensionless parameter ε ∈ (0, 1] representing the amplitude of the potentials. We begin with a semi-discritization of the Dirac equation in time by a time-splitting method, and then followed by a full-discretization in space by the Fourier pseudospectral method. Employing the unitary flow property of the second-order time-splitting method for the Dirac equation, we prove uniform error bounds at C(t)τ and C(t)(h + τ) for the semi-discretization and full-discretization, respectively, for any time t ∈ [0, Tε] with Tε = T/ε for T > 0, which are uniformly for ε ∈ (0, 1], where τ is the time step, h is the mesh size, m ≥ 2 depends on the regularity of the solution, and C(t) = C0 + C1εt ≤ C0 + C1T grows at most linearly with respect to t with C0 ≥ 0 and C1 > 0 two constants independent of t, h, τ and ε. Then by adopting the regularity compensation oscillation (RCO) technique which controls the high frequency modes by the regularity of the solution and low frequency modes by phase cancellation and energy method, we establish improved uniform error bounds at O(ετ) and O(h+ετ) for the semi-discretization and full-discretization, respectively, up to the long-time Tε. Numerical results are reported to confirm our error bounds and to demonstrate that they are sharp. Comparisons on the accuracy of different time discretizations for the Dirac equation are also provided.

[1]  S. Blundell,et al.  The Dirac Equation , 2014 .

[2]  P. Dirac The quantum theory of the electron , 1928 .

[3]  Guillaume Dujardin,et al.  Long time behavior of splitting methods applied to the linear Schrödinger equation , 2007 .

[4]  W. Bao,et al.  Error estimates of numerical methods for the nonlinear Dirac equation in the nonrelativistic limit regime , 2015, 1511.01192.

[5]  Ludwig Gauckler,et al.  Splitting Integrators for Nonlinear Schrödinger Equations Over Long Times , 2010, Found. Comput. Math..

[6]  E. Hairer,et al.  Geometric Numerical Integration: Structure Preserving Algorithms for Ordinary Differential Equations , 2004 .

[7]  Leonard Gross,et al.  The cauchy problem for the coupled maxwell and dirac equations , 2010 .

[8]  Yue Feng,et al.  Uniform error bounds of exponential wave integrator methods for the long-time dynamics of the Dirac equation with small potentials , 2021, Applied Numerical Mathematics.

[9]  Maria J. Esteban,et al.  Existence and multiplicity of solutions for linear and nonlinear Dirac problems , 1997 .

[10]  Dong Liang,et al.  Energy-Conserved Splitting Finite-Difference Time-Domain Methods for Maxwell's Equations in Three Dimensions , 2010, SIAM J. Numer. Anal..

[11]  André D. Bandrauk,et al.  Numerical solution of the time-dependent Dirac equation in coordinate space without fermion-doubling , 2011, Comput. Phys. Commun..

[12]  Weizhu Bao,et al.  Super-resolution of time-splitting methods for the Dirac equation in the nonrelativistic regime , 2018, Math. Comput..

[13]  Guido R. Mocken,et al.  Quantum dynamics of relativistic electrons , 2004 .

[14]  W. Bao,et al.  MATHEMATICAL THEORY AND NUMERICAL METHODS FOR , 2012 .

[15]  Guillaume Dujardin,et al.  Normal form and long time analysis of splitting schemes for the linear Schrödinger equation with small potential , 2007, Numerische Mathematik.

[16]  Xiaowei Jia,et al.  Numerical Methods and Comparison for the Dirac Equation in the Nonrelativistic Limit Regime , 2015, J. Sci. Comput..

[17]  W. Bao,et al.  Improved uniform error bounds for the time-splitting methods for the long-time dynamics of the Schrödinger/nonlinear Schrödinger equation , 2021, ArXiv.

[18]  Laurent Gosse,et al.  A well-balanced and asymptotic-preserving scheme for the one-dimensional linear Dirac equation , 2015 .

[19]  Jia Yin,et al.  Error Bounds of the Finite Difference Time Domain Methods for the Dirac Equation in the Semiclassical Regime , 2019, Journal of Scientific Computing.

[20]  Weizhu Bao,et al.  Improved uniform error bounds on time-splitting methods for long-time dynamics of the nonlinear Klein-Gordon equation with weak nonlinearity , 2021, SIAM J. Numer. Anal..

[21]  Christian Lubich,et al.  On splitting methods for Schrödinger-Poisson and cubic nonlinear Schrödinger equations , 2008, Math. Comput..

[22]  Dong Liang,et al.  Energy-conserved splitting FDTD methods for Maxwell’s equations , 2007, Numerische Mathematik.

[23]  Bernd Thaller,et al.  A rigorous approach to relativistic corrections of bound state energies for spin-1/2 particles , 1984 .

[24]  Jie Shen,et al.  Spectral and Pseudospectral Approximations Using Hermite Functions: Application to the Dirac Equation , 2003, Adv. Comput. Math..

[25]  H. Trotter On the product of semi-groups of operators , 1959 .

[26]  Rainer Grobe,et al.  Numerical approach to solve the time-dependent Dirac equation , 1999 .

[27]  Weizhu Bao,et al.  Uniform error bounds of time-splitting methods for the nonlinear Dirac equation in the nonrelativistic limit regime , 2019, ArXiv.

[28]  G. Quispel,et al.  Splitting methods , 2002, Acta Numerica.

[29]  W. Bao,et al.  A fourth-order compact time-splitting Fourier pseudospectral method for the Dirac equation , 2017, Research in the Mathematical Sciences.

[30]  Jia Yin,et al.  A fourth-order compact time-splitting method for the Dirac equation with time-dependent potentials , 2021, J. Comput. Phys..

[31]  G. Strang On the Construction and Comparison of Difference Schemes , 1968 .