[Wien] how to tell w2web that it is a SOC calculation?

pluto pluto at physics.ucdavis.edu
Mon Oct 14 14:57:15 CEST 2024


Dear All,

When SOC calculation is performed using command line then w2web does not 
know that it was a SOC calculation.

This makes the w2web band structure plotting tool inconvenient (one 
needs to use the command line for the sequence of lapw1 -band, lapwso, 
lapw2 -band...).

Is there a way to fix this?

Best,
Lukasz


More information about the Wien mailing list