Longrange Interactions

From ICPWiki
Jump to: navigation, search

Overview

Type
Lecture
Lecturer
JP Dr. Axel Arnold
Course language
English
Time and Room
August 2-25, Monday and Wednesday, 11:00 - 12:30, V27.03, Pfaffenwaldring 27

Topics

  • boundary conditions and conditional convergence of the Coulomb sum
  • Ewald method
  • mesh-accelerated Ewald methods (P$^3$M, SPME)
  • Tree codes/ fast multipole methods
  • Maggs' method (MEMD)
  • MMM, MMM2D, MMM1D
  • Electrostatic Layer Correction (ELC)

Prerequisites

Knowledge of basic numerical techniques and computer simulations.

Material

A. Arnold and C. Holm. Simulating Charged Systems with ESPResSo. In Lecture Notes in Physics, 703, 2006.

A. Arnold and C. Holm. Efficient methods to compute long range interactions for soft matter systems. In C. Holm and K. Kremer, Advanced Computer Simulation Approaches for Soft Matter Sciences II, Springer, 59-109, 2005.

Script

Script