MaterialsAtlas Software and Tool

FHI-aims

all-electrondfthybrid-functionalssurfacessoftware-toolsmaterials-science-software

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All-electron numeric atom-centered orbital code for molecules, surfaces, solids, hybrid functionals, many-body workflows, and accurate atomistic property calculations.

Citation: FHI-aims. Materials science software/tool. https://fhi-aims.org/

Acknowledgement: Curated by MaterialsAtlas Open Resources from official project pages, documentation, community usage, and common computational/experimental materials workflows.

TypeSoftware and Tool

DomainAll-electron DFT

LicenseAcademic/commercial license

Contributorsfhi-aims.org