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@INPROCEEDINGS{Berljafa:154999,
author = {Berljafa, Mario and Di Napoli, Edoardo},
title = {{A} {P}arallel and {S}calable {I}terative {S}olver for
{S}equences of {D}ense {E}igenproblems {A}rising in {FLAPW}},
volume = {8385},
address = {Berlin, Heidelberg},
publisher = {Springer Berlin Heidelberg},
reportid = {FZJ-2014-04195},
isbn = {978-3-642-55194-9 (print)},
series = {Lecture Notes in Computer Science},
pages = {395 - 406},
year = {2014},
comment = {Parallel Processing and Applied Mathematics},
booktitle = {Parallel Processing and Applied
Mathematics},
abstract = {In one of the most important methods in Density Functional
Theory – the Full-Potential Linearized Augmented Plane
Wave (FLAPW) method – dense generalized eigenproblems are
organized in long sequences. Moreover each eigenproblem is
strongly correlated to the next one in the sequence. We
propose a novel approach which exploits such correlation
through the use of an eigensolver based on subspace
iteration and accelerated with Chebyshev polynomials. The
resulting solver, parallelized using the Elemental library
framework, achieves excellent scalability and is competitive
with current dense parallel eigensolvers.},
month = {Sep},
date = {2013-09-08},
organization = {The 10th International Conference on
Parallel Processing and Applied
Mathematics, Warsaw (Poland), 8 Sep
2013 - 11 Sep 2013},
cin = {JSC},
ddc = {004},
cid = {I:(DE-Juel1)JSC-20090406},
pnm = {411 - Computational Science and Mathematical Methods
(POF2-411) / Simulation and Data Laboratory Quantum
Materials (SDLQM) (SDLQM)},
pid = {G:(DE-HGF)POF2-411 / G:(DE-Juel1)SDLQM},
typ = {PUB:(DE-HGF)8 / PUB:(DE-HGF)7},
UT = {WOS:000347415600037},
doi = {10.1007/978-3-642-55195-6_37},
url = {https://juser.fz-juelich.de/record/154999},
}