[Wien] lapw0 in mBJ

[Parker, David S.]

Has anyone else encountered a problem with lapw0 in running modified Becke Johnson potential calculations? I am looking at UO2, have run a regular GGA scf cycle, but after following carefully the procedure in the user's guide x lapw0 –grr runs properly in a couple seconds but the regular "x lapw0" just sits there, bot running even after a full minute. I attach case.in0 and case.in0_grr.  Thanks, David Parker

in0

TOT   28    (5:LDA, 13:PBE, 11:WC, 19:PBEsol, 28:mBJ, 29:revTPSS, 46:HTBS)
R2V      IFFT      (R2V)
  40  40  40    2.00  1    min IFFT-parameters, enhancement factor, iprint

in0_grr

TOT   50    (5:LDA, 13:PBE, 11:WC, 19:PBEsol, 28:mBJ, 29:revTPSS, 46:HTBS)
R2V      IFFT      (R2V)
  40  40  40    2.00  1    min IFFT-parameters, enhancement factor, iprint