[Wien] problem with output file of lstart (fwd)

Lyudmila Dobysheva lyu at otf.pti.udm.ru
Thu Nov 6 14:59:56 CET 2003


Hi, Natasha!

 TOTAL CORE-CHARGE:                  12.0006131112357
 TOTAL CORE-CHARGE INSIDE SPHERE:    11.9836417715081
 WARNING:   1.69713397276432D-002  CORE electrons leak out of
MT-sphere!!!!

Except of this leakage of the charge I didn't obtain anything bad after
lstart using your struct file. Try to delete the inst file and create it
again with the instgen command.

Best wishes
  Lyudmila Dobysheva 
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