[Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd

[Ghosh SUDDHASATTWA]

Dear Wien2k users, 

I want to know if the number in line in case. outputsgroup 

======No. of atoms in unit cell 

 

Or the number in the line in case.outputd 

NO. OF ATOMS IN UNIT CELL 

has to be used for the calculation of ENE in Ry/atom 

 

For example, in case of alpha-Pu, 

case.outputsgroup shows 16 

case.outputd shows 8 

 

Which one do I have to choose? 

 

 

 

 

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