Ewald sum: Difference between revisions
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== | ==Particle mesh== | ||
*[http://dx.doi.org/10.1063/1.464397 Tom Darden, Darrin York, and Lee Pedersen "Particle mesh Ewald: An N·log(N) method for Ewald sums in large systems", Journal of Chemical Physics '''98''' pp. 10089-10092 (1993)] | *[http://dx.doi.org/10.1063/1.464397 Tom Darden, Darrin York, and Lee Pedersen "Particle mesh Ewald: An N·log(N) method for Ewald sums in large systems", Journal of Chemical Physics '''98''' pp. 10089-10092 (1993)] | ||
====Smooth particle mesh==== | |||
*[http://dx.doi.org/10.1063/1.470117 Ulrich Essmann, Lalith Perera, Max L. Berkowitz, Tom Darden, Hsing Lee, and Lee G. Pedersen "A smooth particle mesh Ewald method", Journal of Chemical Physics '''103''' pp. 8577-8593 (1995)] | *[http://dx.doi.org/10.1063/1.470117 Ulrich Essmann, Lalith Perera, Max L. Berkowitz, Tom Darden, Hsing Lee, and Lee G. Pedersen "A smooth particle mesh Ewald method", Journal of Chemical Physics '''103''' pp. 8577-8593 (1995)] | ||
==Related pages== | ==Related pages== | ||
Revision as of 15:08, 15 January 2008
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Particle mesh
Smooth particle mesh
Related pages
References
- Paul Ewald "Die Berechnung Optischer und Electrostatischer Gitterpotentiale", Annalen der Physik 64 pp. 253-287 (1921)
- S. W. de Leeuw, J. W. Perram and E. R. Smith "Simulation of Electrostatic Systems in Periodic Boundary Conditions. I. Lattice Sums and Dielectric Constants", Proceedings of the Royal Society of London. Series A, Mathematical and Physical Sciences 373 pp. 27-56 (1980)
- S. W. de Leeuw, J. W. Perram and E. R. Smith "Simulation of Electrostatic Systems in Periodic Boundary Conditions. II. Equivalence of Boundary Conditions", Proceedings of the Royal Society of London. Series A, Mathematical and Physical Sciences 373 pp. 57-66 (1980)
- W. Smith; D. Fincham "The Ewald Sum in Truncated Octahedral and Rhombic Dodecahedral Boundary Conditions", Molecular Simulation 10 pp. 67-71 (1993)
- Paul E. Smith and B. Montgomery Pettitt "Efficient Ewald electrostatic calculations for large systems", Computer Physics Communications 91 pp. 339-344 (1995)
- Christopher J. Fennell and J. Daniel Gezelter "Is the Ewald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics", Journal of Chemical Physics 124 234104 (2006)