QUIMICA FISICA
Fachbereich
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Max Planck Institute for Astrophysics
Garching bei München, AlemaniaPublikationen in Zusammenarbeit mit Forschern von Max Planck Institute for Astrophysics (3)
1998
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In-place self-sorting fast Fourier transform algorithm with local memory references
Computer Physics Communications, Vol. 108, Núm. 1, pp. 1-8
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Variational plane-wave calculations in adaptive coordinates
Physical Review B - Condensed Matter and Materials Physics, Vol. 58, Núm. 3, pp. 1230-1235
1997
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Fast evaluation of the Coulomb energy for electron densities
Journal of Chemical Physics, Vol. 107, Núm. 4, pp. 1218-1226