[Wien] Electron density

Leonardo Pisani pisani at itp.uni-frankfurt.de
Thu Nov 4 09:52:05 CET 2004


Dear Wien Users,

when calculating electron density, after having set the lower energy cut-off 
for defining the range of occupied states,  one can choose two ways: 1)using
option  TETRA  or 2)  using option ALL with  eval = 0. They should give the 
same result.
Is that correct?

Thanks in advance,
Best Regards, 
Leonardo Pisani.




More information about the Wien mailing list