ChemistryAtlas App · QM and Computational Chemistry

Phonon Post-processing

Parse phonopy/QE phonon outputs, flag imaginary modes, plot phonon band/DOS/thermal curves, and export mode data.

StatusAvailable

CategoryQM and Computational Chemistry

App slugdft-phonon-postprocessing

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About this app

Parse phonopy/QE phonon outputs, flag imaginary modes, plot phonon band/DOS/thermal curves, and export mode data.

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