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Parallel fast Fourier transforms for electronic structure calculations

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Publication:1581151
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DOI10.1016/S0010-4655(00)00049-7zbMath0963.65151OpenAlexW2078469984WikidataQ60264790 ScholiaQ60264790MaRDI QIDQ1581151

Peter D. Haynes, Michel Côté

Publication date: 14 September 2000

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/s0010-4655(00)00049-7


zbMATH Keywords

fast Fourier transformparallel computingelectronic structure calculationsnew data distribution


Mathematics Subject Classification ID

Other elementary particle theory in quantum theory (81V25) Numerical methods for discrete and fast Fourier transforms (65T50) Parallel numerical computation (65Y05)


Related Items (5)

Parallel implementation of the projector augmented plane wave method for charged systems ⋮ A decomposition method with minimum communication amount for parallelization of multi-dimensional FFTs ⋮ Parallel methods for high-dimensional quantum dynamics ⋮ Parallel 3-dim fast Fourier transforms with load balancing of the plane waves ⋮ Performance of the 3D FFT on the 6D network torus QCDOC parallel supercomputer




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