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Professor Togo suggested that I use Alamode instead of phonopy for self-consistent phonon calculation of free energy at different volumes and then estimate the temperature for PbTe.
In the SrTiO3 example for self-consistent phonon calculation, C_v and Free energies are printed for different temperatures. Is it possible to also print the volume at those temperatures?
This discussion was converted from issue #313 on July 03, 2026 16:07.
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Dear Professor Tadano,
Professor Togo suggested that I use Alamode instead of phonopy for self-consistent phonon calculation of free energy at different volumes and then estimate the temperature for PbTe.
In the SrTiO3 example for self-consistent phonon calculation, C_v and Free energies are printed for different temperatures. Is it possible to also print the volume at those temperatures?
Thanks,
Vahid
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