MaterialsAtlas Software and Tool

Elk

all-electronlapwmagnetismspectroscopysoftware-toolsmaterials-science-software

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Open-source FP-LAPW electronic-structure code for periodic systems, magnetism, spin-orbit coupling, optics, spectroscopy, and excited-state property calculations.

Citation: Elk. Materials science software/tool. https://elk.sourceforge.io/

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

LicenseGPL

Contributorselk.sourceforge.io