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3.16 what='mur_lc_ph'

This option is similar to what='scf_ph' but the phonon calculation is made at the geometry that minimizes the energy (or the enthalpy at finite pressure). See what='scf_ph' and what='mur_ lc' for a list of the variables that control these options. An example for this option can be found in example07.
Number of tasks for this option: Maximum between the number of tasks needed by the what='mur_lc' option and the number of tasks of the phonon code (see above the option what='scf_ph').


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Next: 3.17 what='mur_lc_disp' Up: 3. Input variables Previous: 3.15 what='mur_lc_dos'   Contents
2024-09-24