[Wien] final states and case.inc

[Michael Gurnett]

The file case.inc has the following entries for Si (2p states have been treated as core)

 4 0.00     NUMBER OF ORBITALS (EXCLUDING SPIN), SHIFT
1,-1,2               ( N,KAPPA,OCCUP)
2,-1,2               ( N,KAPPA,OCCUP)
2, 1,2               ( N,KAPPA,OCCUP)
2,-2,4               ( N,KAPPA,OCCUP)

Now I would like to remove half an electron from the Si 2p state. My question is does it make a diiference if I remove it from the second from last or the last row.


Thanks.........

Michael
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