An NFFT based approach to the efficient computation of dipole-dipole interactions under different periodic boundary conditions
We present an efficient method to compute the electrostatic fields, torques and forces in dipolar systems, which is based on the fast Fourier transform for nonequispaced data (NFFT). We consider 3d-periodic, 2d-periodic, 1d-periodic as well as 0d-periodic (open) boundary conditions. The method is ba...
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| Format: | Others |
| Language: | English |
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Universitätsbibliothek Chemnitz
2015
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| Online Access: | http://nbn-resolving.de/urn:nbn:de:bsz:ch1-qucosa-171040 http://nbn-resolving.de/urn:nbn:de:bsz:ch1-qucosa-171040 http://www.qucosa.de/fileadmin/data/qucosa/documents/17104/Preprint_2015_07.pdf http://www.qucosa.de/fileadmin/data/qucosa/documents/17104/signatur.txt.asc |