Ewald Summation: Long-Range Interaction and Self-Interaction Correction

In course

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Description

This lecture covers the Ewald summation method for calculating long-range interactions in Fourier space, the self-interaction correction, and the short-range interaction in real space. It explains the role of the Ewald parameter in achieving good screening and numerical efficiency.

Instructor

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Official source

https://mediaspace.epfl.ch/media/0_d01uwgqk

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Ontological neighbourhood

Mathematics

Analysis: Numerical analysis

Information engineering

Signal processing: Fourier analysis

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