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Publications of the SimLab Quantum Materials

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Non-linear Least-Squares Optimization of Rational Filters for the Solution of Interior Hermitian Eigenvalue Problems
Frontiers in applied mathematics and statistics 5, 5 () [10.3389/fams.2019.00005] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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ChASE: Chebyshev Accelerated Subspace iteration Eigensolver for sequences of Hermitian eigenvalue problems
ACM transactions on mathematical software 45(2), 21 () [10.1145/3313828] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Accelerating the computation of FLAPW methods on heterogeneous architectures
Concurrency and computation 30(24), e4905 - () [10.1002/cpe.4905] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Perfect Detection of Spikes in the Linear Sub-threshold Dynamics of Point Neurons
Frontiers in neuroinformatics 11, 75 () [10.3389/fninf.2017.00075] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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The Jülich Supercomputing Centre Launches the New SimLab Quantum Materials
Innovatives Supercomputing in Deutschland 15(1), 17-19 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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High-Performance Scientific Computing - First JARA-HPC Symposium 2016
1st JARA-HPC Symposium, JHPCS'16, AachenAachen, Germany, 4 Oct 2016 - 5 Oct 20162016-10-042016-10-05 Cham : Springer International Publishing, Lecture Notes in Computer Science 10164, () BibTeX | EndNote: XML, Text | RIS

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High-performance generation of the Hamiltonian and Overlap matrices in FLAPW methods
Computer physics communications 211, 61-72 () [10.1016/j.cpc.2016.10.003]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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High-performance functional Renormalization Group calculations for interacting fermions
Computer physics communications 213, 100-110 () [10.1016/j.cpc.2016.12.013] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Hybrid CPU-GPU generation of the Hamiltonian and Overlap matrices in FLAPW methods
JARA High-Performance Computing Symposium, JHPCS, AachenAachen, Germany, 4 Oct 2016 - 5 Oct 20162016-10-042016-10-05 Springer-Verlag, Lecture Notes in Computer Science 10164, 200-211 () [10.1007/978-3-319-53862-4_17] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Parallel adaptive integration in high-performance functional Renormalization Group computations
JARA High-Performance Computing Symposium, JHPCS, AachenAachen, Germany, 4 Oct 2016 - 5 Oct 20162016-10-042016-10-05 Springer-Verlag, Lecture Notes in Computer Science 10164, 170-184 () [10.1007/978-3-319-53862-4_15] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Methodology for determining the electronic thermal conductivity of metals via direct nonequilibrium ab initio molecular dynamics
Physical review / B 94(7), 075149 () [10.1103/PhysRevB.94.075149] OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Efficient estimation of eigenvalue counts in an interval
Numerical linear algebra with applications 23(4), 674-692 () [10.1002/nla.2048] BibTeX | EndNote: XML, Text | RIS

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An optimized and scalable eigensolver for sequences of eigenvalue problems
Concurrency and computation 27(4), 905–922 () [10.1002/cpe.3394]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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A Parallel and Scalable Iterative Solver for Sequences of Dense Eigenproblems Arising in FLAPW
Parallel Processing and Applied Mathematics
The 10th International Conference on Parallel Processing and Applied Mathematics, PPAM 2013, WarsawWarsaw, Poland, 8 Sep 2013 - 11 Sep 20132013-09-082013-09-11
Berlin, Heidelberg : Springer Berlin Heidelberg, Lecture Notes in Computer Science 8385, 395 - 406 () [10.1007/978-3-642-55195-6_37]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Opening Workshop of the Simulation Laboratory "Ab Initio"
Innovatives Supercomputing in Deutschland 12(1), 100-101 () OpenAccess  Download fulltext Files  Download fulltextFulltext Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Numerical methods for the eigenvalue problem in electronic structure computations
45th IFF Spring School 2014 "Computing Solids – Models, ab-initio methods and supercomputing", ed. S. Blügel, N. Helbig, V. Meden, D. Wortmann Juelich : Forschungszentrum Juelich GmbH, Schriften des Forschungszentrums Jülich Reihe Schlüsseltechnologien / Key Technologies 74, D3.1 - D3.28 () OpenAccess  Download fulltext Files  Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Towards an efficient use of the BLAS library for multilinear tensor contractions
Applied mathematics and computation 235, 454 - 468 () [10.1016/j.amc.2014.02.051]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Block iterative eigensolvers for sequences of correlated eigenvalue problems
Computer physics communications 184(11), 2478 - 2488 () [10.1016/j.cpc.2013.06.017] OpenAccess  Download fulltext Files  Download fulltextFulltext by arXiv.org Download fulltextFulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

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Dissecting the FEAST algorithm for generalized eigenproblems
Journal of computational and applied mathematics 244, 1 - 9 () [10.1016/j.cam.2012.11.014]  Download fulltext Files BibTeX | EndNote: XML, Text | RIS


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