Comment 3 for bug 1540922

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Fabiano Corsetti (f-corsetti) wrote :

Hi Alberto,

I'm not sure. The way I originally coded it, OMM.LongOutput = .false. prints a few lines of summary info for each k-point at every SCF iteration (while .true. prints a line for every iteration of the OMM algorithm). As Marcos found, the problem with this setup is that even .false. ends up printing a lot of information when you have many k-points.

Maybe it makes sense to apply the patch, so that users can choose between no information and full information. Then .false. basically gives you the same output as a standard diagonalization run.