[Wien] automatic summing of DOS in RENDOS?

Peter Blaha peter.blaha at tuwien.ac.at
Thu May 7 21:12:52 CEST 2026


Sorry, these "sum-DOSes" are not implemented with the renormalized DOS. 
You have to do it by hand.

Peter Blaha

Am 07.05.2026 um 16:26 schrieb Straus, Daniel B:
> Hi,
> 
> Is there a flag I can use when running rendos that will account for the 
> sums I specify at the end of the case.int file and redo the sum with 
> renormalized DOS? When I run dosplot2 -ren when I want to plot a sum of 
> partial DOS, I get the error “ERROR: case.dosrnsumev not found!” If not, 
> I can do it by hand.
> 
> Daniel Straus
> 
> Assistant Professor
> 
> Department of Chemistry
> 
> Tulane University
> 
> 5088 Percival Stern Hall
> 
> 6400 Freret Street
> 
> New Orleans, LA 70118
> 
> (504) 862-3585
> 
> http://straus.tulane.edu/ <http://straus.tulane.edu/>
> 
> 
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Peter Blaha,  Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Email: peter.blaha at tuwien.ac.at
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