[Wien] 'DIR WRONG' error in electron density plotting

[Gavin Abo]

That direction wrong error probably means their is a problem with your 
case.in5(c) file with either parameter npy not being greater than 1 or 
noorth1 (refer to section 8.14.3 Input for case.in5 in the WIEN2k 
usersguide).

On 3/6/2019 2:30 AM, Santanu Pathak wrote:
> I am calculating the electronic structure of oxide material. There's 
> no error in the scf run and DOS, band structure, optical properties 
> are being studied. But after following all the steps for Electron 
> Density plot, *a message 'DIR WRONG'* is coming in *x lapw5* as below.
>
> image.png
> Therefore electron density plot is not formed as shown below.
> image.png
>
> How can this problem be solved? Kindly let me know if any further 
> detail is needed about the scf run or structure for solving the 
> problem. Thank you.
> /
> /
> /Best Regards,
> /
> /
> Santanu Pathak/
> /Senior Research Fellow/
> /Variable Energy Cyclotron Centre/
> /1/AF Bidhan Nagar, Kolkata-700064, India
> /
> /Phone no.: 033-2318-4460 / ///09163419475//
> /
> /
>
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