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Introduction to SIESTA

J. Miguel Alonso-Pruneda, Instituto de Ciencia de Materiales - C.S.I.C., UIUC; pruneda --> icmab.es

Hands-on introduction to the local orbital pseudopotential code SIESTA for electronic structure calculations and ab initio molecular dynamics simulations of molecules and solids. Overview of the concepts behind the method, its main characteristics and some of its capabilities.

Lectures

Computer Lab

Or you can download them separately:

References

Lecture details:

Introduction to the SIESTA method | PDF (884 Kb) | PPT (423Kb)
Pseudopotential and basis generation | PDF (2.9 MB) | PPT (1.2MB)
How to run SIESTA | PDF (2.15MB) | PPT (1.48MB)
Sistematics | PDF (515 Kb) | PPT (224Kb)