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Multi-Level Ewald: A hybrid multigrid / Fast Fourier Transform approach to the electrostatic particle—mesh problem

We present a new method for decomposing the one convolution required by standard Particle-Particle Particle-Mesh (P(3)M) electrostatic methods into a series of convolutions over slab-shaped subregions of the original simulation cell. Most of the convolutions derive data from separate regions of the...

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Autors principals: Cerutti, David S., Case, David A.
Format: Artigo
Idioma:Inglês
Publicat: 2010
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3202610/
https://ncbi.nlm.nih.gov/pubmed/22039358
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