| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5391960 | Chemical Physics Letters | 2006 | 6 Pages |
Abstract
Accurately representing electrostatic interactions in simulations is of crucial importance in simulations of systems that include charges. We reformulate Ewald summation by making a connection with the theory of nonuniform fast Fourier transforms. The result is a method that is accurate, fast, and simple to implement.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Fredrik Hedman, Aatto Laaksonen,