Siesta Documentation

SIESTA is a program for efficient electronic structure calculations and ab initio molecular dynamics simulations of molecules and solids in the framework of Density-Functional Theory (DFT).

– Tutorials

Let us show you how to do things with SIESTA!

– User guide

Explore all the features of SIESTA.

– Installation.

Installing SIESTA is easier than you might think.

– Citing SIESTA.

Find the SIESTA papers you need!

– Video Lectures.

Learn the theory behind SIESTA.

– Chat with us!

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