[Wien] EECE/HYBR question

John Appleton banger_deep at yahoo.com
Sat Jul 19 15:14:02 CEST 2008


  Dear users, 
  Can anyone refer me to a paper that discusses or give me simple 
  physical arguments on why EECE/HYBR increase the total energies 
  compared to pure DFT and also why increasing the amount of HF 
  exchange tend to increase the localization of d/f states.
  Thanks
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