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3.14 what='mur_lc_bands'

With this option the code computes the band structure at the geometry that minimizes the energy (or the enthalpy at finite pressure). See what='scf_bands' and what='mur_lc' for a list of the variables that control these two options. An example for this option can be found in example06.
Number of tasks for this option: see what='mur_lc' and what='scf_bands'.



2024-09-24