Difference between revisions of "Simulation Techniques for Soft Matter Sciences (SS 2007)/Ewald summation"

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=== Description ===
 
=== Description ===
 +
 
  The present tutorial is intended to solidify your knowledge  about long-range
 
  The present tutorial is intended to solidify your knowledge  about long-range
 
interactions. Several aspects and concepts are reviewed: direct sum, Ewald sum,
 
interactions. Several aspects and concepts are reviewed: direct sum, Ewald sum,

Revision as of 22:41, 20 June 2007

Overview

This tutorial covers

  • How to do the direct summation correctly
  • Comparison to Ewald sum
  • Parameter choice for Ewald sum
  • Short introduction to the use of P3M in Espresso

Content

Description

The present tutorial is intended to solidify your knowledge  about long-range

interactions. Several aspects and concepts are reviewed: direct sum, Ewald sum, dipolar contribution, and how to use the P3M with Espresso.

Resources

Here you can download everything and don't have to work anymore ....