Ewald sum: Difference between revisions
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*[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)] | ||
*[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== | |||
*[[Reaction field]] | |||
==References== | ==References== | ||
#[http://dx.doi.org/10.1002/andp.19213690304 Paul Ewald "Die Berechnung Optischer und Electrostatischer Gitterpotentiale", Annalen der Physik '''64''' pp. 253-287 (1921)] | #[http://dx.doi.org/10.1002/andp.19213690304 Paul Ewald "Die Berechnung Optischer und Electrostatischer Gitterpotentiale", Annalen der Physik '''64''' pp. 253-287 (1921)] | ||
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Smooth particle mesh
- 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)
- 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
References
- Paul Ewald "Die Berechnung Optischer und Electrostatischer Gitterpotentiale", Annalen der Physik 64 pp. 253-287 (1921)
- 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)