Grid-based dynamic electronic publication: A case study using combined experiment and simulation studies of crown ethers at the air/water interface.
Esther R Rousay, Hongchen Fu, Jamie M Robinson, Jeremy G Frey, Jonathan W Essex
School of Chemistry, University of Southampton,
Highfield, Southampton, SO17 1BJ, UK
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Particle Mesh Ewald

Short Description
This method of treating electrostatic interactions represents the charges in a simulation cell by using a grid of many points, each point carrying a charge based upon its position in the simulation cell. This grid is then replicated throughout the system. This means that bulk behaviour may be effectively modelled.

Long Description

This method of treating electrostatic interactions represents the charges in a simulation cell by using a grid of many points, each point carrying a charge based upon its position in the simulation cell. This grid is then replicated throughout the system. This means that bulk behaviour may be effectively modelled.


Pseudonyms
Particle Mesh Ewald,