On optimizing Jacobi-Davidson method for calculating eigenvalues in low dimensional structures using eight band k model

DOI10.1016/J.JCP.2013.04.003MaRDI QIDQ465559zbMATH OpenOpenAlexFDO

Authors Janusz Andrzejewski

Publication date 23 October 2014

Published in Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.jcp.2013.04.003

zbMATH Keywords

eight band \(\mathbf{k}\cdot\mathbf{p}\) modelelectronic structureJacobi-Davidson methodlow dimensional structurespreconditioning

Mathematics Subject Classification ID

Selfadjoint operator theory in quantum theory, including spectral analysis (81Q10) Quantum dots, waveguides, ratchets, etc. (81Q37)

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Cites work

• A Jacobi–Davidson Iteration Method for Linear Eigenvalue Problems
• A Krylov--Schur algorithm for large eigenproblems
• Anasazi software for the numerical solution of large-scale eigenvalue problems
• Bi-CGSTAB: A Fast and Smoothly Converging Variant of Bi-CG for the Solution of Nonsymmetric Linear Systems
• Combination of Jacobi–Davidson and conjugate gradients for the partial symmetric eigenproblem
• Computing several eigenpairs of Hermitian problems by conjugate gradient iterations
• GMRES: A Generalized Minimal Residual Algorithm for Solving Nonsymmetric Linear Systems
• scientific article; zbMATH DE number 961607 (Why is no real title available?)
• ILUT: A dual threshold incomplete LU factorization
• Jacobi-Davidson type methods for generalized eigenproblems and polynomial eigenproblems
• JADAMILU: a software code for computing selected eigenvalues of large sparse symmetric matrices
• Motion of Electrons and Holes in Perturbed Periodic Fields
• Numerical methods for electronic structure calculations of materials
• Numerical methods for large eigenvalue problems
• Numerical methods for large eigenvalue problems
• Parallel iterative methods for sparse linear systems
• Preconditioning techniques for large linear systems: A survey
• PRIMME: preconditioned iterative multimethod eigensolver -- methods and software description
• Reorthogonalization and Stable Algorithms for Updating the Gram-Schmidt QR Factorization
• Robust preconditioning of large, sparse, symmetric eigenvalue problems
• Studies on Jacobi–Davidson, Rayleigh quotient iteration, inverse iteration generalized Davidson and Newton updates
• Templates for the Solution of Algebraic Eigenvalue Problems
• The Davidson Method
• The iterative calculation of a few of the lowest eigenvalues and corresponding eigenvectors of large real-symmetric matrices

Cited in

(2)

• Increasing the performance of the Jacobi-Davidson method by blocking
• State-of-the-art eigensolvers for electronic structure calculations of large scale nano-systems

Describes a project that uses

Uses Software

• PRIMME
• Anasazi
• JDQZ
• JADAMILU
• JDQR
• ILUT
• JDCG

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