An efficient algorithm for time propagation as applied to linearized augmented plane wave method

DOI10.1016/j.cpc.2016.09.001zbMath1375.81256OpenAlexW2519806966WikidataQ57604449 ScholiaQ57604449MaRDI QIDQ1682948

Peng Zhang

Publication date: 6 December 2017

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2016.09.001

zbMATH Keywords

time-dependent density functional theorylinearized augmented plane wavesspin-dynamicstime propagation algorithm

Mathematics Subject Classification ID

PDEs in connection with quantum mechanics (35Q40) Many-body theory; quantum Hall effect (81V70) Numerical solution of discretized equations for initial value and initial-boundary value problems involving PDEs (65M22)

Cites Work

• Solution of the Schrödinger equation by a spectral method
• The Chebyshev propagator for quantum systems
• On Krylov Subspace Approximations to the Matrix Exponential Operator
• Nineteen Dubious Ways to Compute the Exponential of a Matrix, Twenty-Five Years Later

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