[Wien] WIENncm installation error

[Gavin Abo]

Your bashrc block looks fine.  There is likely something else I'm not 
seeing.

In a terminal, enter the command: echo $WIENROOT

Does that output:

/scratch/19ph92r03/safikul/WIENNCM/WIENNCM

Previously, one of your errors was:

/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw0: Command not found.

Did you put your compiled lapw0 file in that directory?

Enter the terminal command: ls -la $WIENROOT | grep lapw0

Does the non-empty lapw0 file show up as being there as you would expect 
in the output?

On 11/18/2023 10:14 PM, Safikul Islam wrote:
> Dear Sir,
>
>                Even though I have added the path for WIENncm the error 
> persists. Here is my bashrc file. How will I add the path of  WEIN2k 
> and WIENncm simultaneously?
> ......................................................................................................................................
> # added by WIEN2k: BEGIN
> # --------------------------------------------------------
> alias lsi="ls -aslp *.in*"
> alias lso="ls -aslp *.output*"
> alias lsd="ls -aslp *.def"
> alias lsc="ls -aslp *.clm*"
> alias lss="ls -aslp *.scf* */*.scf"
> alias lse="ls -aslp *.error"
> alias LS="ls -aslp | grep /"
> alias pslapw="ps -ef |grep "lapw""
> alias cdw="cd /home/19ph92r03/WIEN2k"
> export OMP_NUM_THREADS=1
> #export LD_LIBRARY_PATH=.....
> export EDITOR="gedit"
> export SCRATCH=./
> #export WIENROOT=/scratch/19ph92r03/safikul/wien2k
> export WIENROOT=/scratch/19ph92r03/safikul/WIENNCM/WIENNCM
> export W2WEB_CASE_BASEDIR=/home/19ph92r03/WIEN2k
> export STRUCTEDIT_PATH=$WIENROOT/SRC_structeditor/bin
> export PDFREADER=acroread
> export 
> PATH=$WIENROOT:$STRUCTEDIT_PATH:$WIENROOT/SRC_IRelast/script-elastic:$PATH:.
> export OCTAVE_EXEC_PATH=${PATH}::
> export OCTAVE_PATH=${STRUCTEDIT_PATH}::
>
> export PATH=$PATH:$WIENROOT:.
> ulimit -s unlimited
> alias octave="octave -p $OCTAVE_PATH"
> # --- BERRYPI START ---
> export BERRYPI_PATH=$WIENROOT/SRC_BerryPI/BerryPI
> export BERRYPI_PYTHON=/usr/bin/python2.7
> alias berrypi="${BERRYPI_PYTHON} ${BERRYPI_PATH}/berrypi"
> # --- BERRYPI END ---
> # --------------------------------------------------------
> # added by WIEN2k: 
> END...........................................................................................................................................................
>
>
> with kind regards,
> Safikul Islam
>
>
>
>
>
>
>
>
> -- 
> *SAFIKUL ISLAM*
> [Ph.D Research Scholar]
> ---------------------------------------------------
> Department of Physics.
> Indian Institute of Technology,
> Kharagpur.
> West Bengal, India.
> _Pin Code_:- 721302.
> ---------------------------------------------------
> _Contact_:- 9832979985
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