Dear Prof. Blaha and dear WIEN users,<br />
<br />
I have a few questions regarding the ‘Sum of Eigenvalues’ parameter given the scf output of the WIEN2K program. I will be highly obliged to get the reply to these questions.<br />
1. This ‘sum of eigenvalues’ implies sum over what part of bandstructure; the one given in klist or over some other part of bandstructure also or over the entire bandstructure (and if so which is that?).<br />
2. What is the zero point with respect to which this sum is defined?<br />
3. Presumably it also is in Rydbergs.<br />
I thank you a lot for your attention and time to go through this mail and for kindly providing me the reply.<br />
<br />
Thanking You,<br />
Yours Sincerely,<br />
Jyoti<br />
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