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Scalability of the Poisson solvers - TDDFT.org

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Survey<br />

<strong>Poisson</strong> solver, Blue Gene/P<br />

Execution-times for <strong>the</strong> calculation <strong>of</strong> <strong>the</strong> Hartree potential created by a<br />

Gaussian charge distribution on a Blue Gene/P machine as a function <strong>of</strong><br />

six different <strong>Poisson</strong> <strong>solvers</strong> and <strong>of</strong> <strong>the</strong> involved number <strong>of</strong> MPI<br />

processes.<br />

1000<br />

t (s)<br />

100<br />

10<br />

1<br />

0.1<br />

0.01<br />

1 4 16 64 256 4096<br />

MPI proc.<br />

PFFT<br />

Serial FFT<br />

ISF<br />

CG corrected<br />

Multigrid<br />

FMM<br />

J. Alberdi-Rodriguez (UPV/EHU) <strong>Poisson</strong> solver in Octopus October 23 25 / 33

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