MaterialsAtlas Software and Tool

TDEP

finite-temperaturephononsforce-constantsmolecular-dynamicssoftware-toolsmaterials-science-software

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Temperature Dependent Effective Potential method implementation for extracting effective force constants and finite-temperature phonons from molecular dynamics or first-principles data.

Citation: TDEP. Materials science software/tool. https://github.com/tdep-developers/tdep

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

TypeSoftware and Tool

DomainTemperature-dependent phonons

LicenseOpen source

Contributorstdep-developers/tdep