[Wien] reg: DOS at fermi level

Dear Prof. Blaha and wien users I have a small doubt on DOS at Fermi level. I want the value of N(E_F) for my compound. According to my idea, we will get this value form case.dos1ev file. But the total DOS in this file is DOS due to the atoms and also due to interstitial region. So how can I

[Wien] REG: including 4f state in calculation

Dear Prof. Blaha and Wien2k users, I have done some calculation for La containing compounds with out including 4f state. Now I want to do the same with including 4f state in the calculation. So how can I include the 4f state, such that it will consider in the calculation. And from which file

[Wien] Reg:band structure with spin orbit coupling

Dear users I have doubt regarding spin orbit coupling. I tried to plot the band structure with spin orbit coupling. But i got some error as mentioned below, when i am running the x spaghetti -so. forrtl: severe (64): input conversion error, unit 30, file case.irrepso The crystal structure is

[Wien] Reg: orbital magnetic moment

Dear User I am using WIEN2k and I got some error. I am trying to calculate the orbital magnetic moment and for that I am using the command to run the calculation with Spin orbit coupling like runsp_lapw -so -dm But after executing this command I am getting the error

[Wien] Wien2k compilation with fortran-compiler

Dear Users I am using Wien2k_10.0. I compiled this in my machines ubuntu 9.04 using gfortran compiler. After compilation I am not getting error in compile.msg. But when i am running 'x tetra' for DOS i am getting following error Segmentation fault 0.090u 0.000s 0:00.09 100.0%0+0k 0+0io

[Wien] Wien2k compilation with gfortran compiler

Dear Users I am using Wien2k_10.0. I compiled this in my machines ubuntu 9.04 using gfortran compiler. After compilation I am not getting error in compile.msg. But when i am running 'x tetra' for DOS i am getting following error Segmentation fault 0.090u 0.000s 0:00.09 100.0%0+0k

[Wien] Wien2k

To The Users I am using Wien2k_10.0. I compiled this in my machines ubuntu 9.04 using gfortran compiler. After compilation I am not getting error in compile.msg. But when i am running 'x tetra' for DOS i am getting following error Segmentation fault 0.090u 0.000s 0:00.09 100.0%0+0k 0+0io