lyb9812
Results
2
comments of
lyb9812
The content of output file for out_wfc_lcao=1 are coefficients of wave functions. To print wave functions in real space , you need to set out_wfc_r=1 and calculation = ienvelope.
> 1. I also did not set the restart with `init_wfc` turned on before, but the last step before the restart and the first step after the restart had inconsistent...