[Wien] nn.def failed

[Laurence Marks]

What you sent describes the issue:

/home/naincy/WIEN2k_21.1/nn: Command not found

That means you did not compile it correctly. Go back and check for errors
during the compilation when you did siteconfig. For instance, go to
/home/Nancy/WIEN_21.1, do ./siteconfig and recompile just nn (for instance).

Look at the errors.

--
Professor Laurence Marks
Department of Materials Science and Engineering, Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and to think what nobody
else has thought" Albert Szent-Györgyi

On Wed, Jan 4, 2023, 04:44 naincy Pandit <naincypandit42 at gmail.com> wrote:

> Dear Prof. Blaha sir and Wien2k users,
>
>
>  i am working with Wien2k_21.1 version with Ubuntu 22.04 with oneAPI installed recently after installation i m geeting this type of error
>
>  stop error
>
> error: command   /home/naincy/WIEN2k_21.1/nn nn.def   failed
> 0.000u 0.000s 0:00.00 0.0%	0+0k 0+0io 0pf+0w
> /home/naincy/WIEN2k_21.1/nn: Command not found.
>  next is nn
> file    BaZrS3.struct_setrmt   generated
> atom  Z   RMT-max   RMT
> Use of uninitialized value $rmt[3] in sprintf at /home/naincy/WIEN2k_21.1/setrmt_lapw line 249,  line 41.
> Use of uninitialized value $rmt[2] in sprintf at /home/naincy/WIEN2k_21.1/setrmt_lapw line 249,  line 32.
> Use of uninitialized value $rmt[1] in sprintf at /home/naincy/WIEN2k_21.1/setrmt_lapw line 249,  line 19.
> Use of uninitialized value $rmt[0] in sprintf at /home/naincy/WIEN2k_21.1/setrmt_lapw line 249,  line 10.
> readline() on closed filehandle NN at /home/naincy/WIEN2k_21.1/setrmt_lapw line 163.
> readline() on closed filehandle NN at /home/naincy/WIEN2k_21.1/setrmt_lapw line 152.
> error: command   /home/naincy/WIEN2k_21.1/nn nn.def   failed
> 0.000u 0.000s 0:00.00 0.0%	0+0k 0+0io 0pf+0w
> /home/naincy/WIEN2k_21.1/nn: Command not found.
>
> i tried to solve my problem using this link
>
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg07912.html
>
> also tried this https://www.youtube.com/watch?v=nify81ZbzkU
>
> but it didnot worked.
>
>
> please guide me and give your valueable response.
>
>
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