[wien] third question

[Jorissen Kevin]

-c is for complex case :
when the system has no inversion symmetry,we need to use complex calculations, i.e. complex hamiltonian etc.
As this makes the program a lot heavier, we have separate real and complex versions.
 
Kevin.
PS lapw1c is the same as lapw1 -c

________________________________

Van: wien-admin at zeus.theochem.tuwien.ac.at namens Hamid Alaa
Verzonden: ma 20/09/2004 13:35
Aan: wien at zeus.theochem.tuwien.ac.at
Onderwerp: [wien] third question



Dear Wien2K users

  My third question is what is the difference between LAPW1 and LAPW1 -c?. 

With my thanks 

Alaa S Hamid

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