High-performance generation of the Hamiltonian and Overlap matrices in FLAPW methods

Author:

Di Napoli EdoardoORCID,Peise Elmar,Hrywniak MarkusORCID,Bientinesi Paolo

Funder

Jülich Aachen Research Alliance-High Performance Computing

Deutsche Forschungsgemeinschaft (DFG)

Deutsche Telekom Stiftung

Publisher

Elsevier BV

Subject

General Physics and Astronomy,Hardware and Architecture

Reference23 articles.

1. Fleur: The Jülich FLAPW code family, Feb. 2016. URL http://www.flapw.de/pm/index.php?n=Main.AboutFleur

2. On the performance prediction of BLAS-based tensor contractions, high performance computing systems;Peise;Perform. Model. Benchmarking Simul.,2015

3. The wy representation for products of householder matrices;Bischof;SIAM J. Sci. Stat. Comput.,1987

4. Accumulating householder transformations, revisited;Joffrain;ACM Trans. Math. Software,2006

5. Parallelization of the FLAPW method;Canning;Comput. Phys. Comm.,2000

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