[Wien] case.almblm along used-defined quantization axis

Dear All, I am again coming back to the Ylm band characters etc... This command x lapw2 -up -so -alm -qtl -band produces case.almblm file. I am guessing that here the quantization axis (i.e. the direction of pz and dz2, the z-axis) is oriented along the axis defined by the

Re: [Wien] DOS is coming as 0 in .txt filles

The problem is solved. On Sat, 18 Mar 2023 at 14:45, shamik chakrabarti wrote: > Dear Wien2k users, > >For certain compounds, when I simulate DOS, it is > appearing in w2web properly, *however when I am collecting data in .txt > format to plot it in origin, the dos is

[Wien] DOS is coming as 0 in .txt filles

Dear Wien2k users, For certain compounds, when I simulate DOS, it is appearing in w2web properly, *however when I am collecting data in .txt format to plot it in origin, the dos is showing value 0 for all the columns.* Kindly suggest the remedy. Looking forward to hearing