FHI-aims: Full-Potential, All-Electron Electronic Structure Theory with Numeric Atom-Centered Basis Functions
Methods and code development · Fritz-Haber-Institut der Max-Planck-Gesellschaft · Theory Department

Welcome to the FHI-aims club!

This is the download and community site for the FHI-aims code, developed at the Fritz Haber Institute, Berlin.

FHI-aims is an efficient computer program package to predict the properties of condensed matter (molecules, clusters, solids, liquids, ...), based on a first-principles description of the electronic structure. The primary production method is density functional theory (DFT), an efficient and accurate method to obtain quantum-mechanical ground state total energies.

The FHI-aims club is open to all registered users of groups with an FHI-aims license; please see the publicly accessible FHI-aims web site for licensing details. As a new user in one of those groups, please register by following the links on the left. If you are already a registered user, you should simply log in to access all features of this site.