In .bashrc, the "export WIENROOT=/home/username/WIEN2k" line can be
replaced by:
export WIENROOT=/home/username/WIENNCM
The "/home/username/WIENNCM" would have to be changed if you installed
WIENncm in a different directory on your system. Also, remember to
restart the computer (or close and open a new terminal) after saving the
changes to .bashrc so that the changes go into affect.
On 11/18/2023 1:29 PM, Safikul Islam wrote:
Dear Sir,
I am trying to do a testrun for the example febcc but
getting the following errors. The compilation was okay. After the
compilation I have done ./userconfig_lapw. But it is adding the paths
for WIEN2k in bashrc file. Sir there is no userconfig_lapw in WEINncm
directory. Then how will I add the executables of the WIENncm in the
bashrc file?
..................................................................................................................................
Errror
(base) [19ph92r03@login06 febcc]$ runncm
runncm with /scratch/19ph92r03/safikul/WIENNCM/WIENNCM
in cycle 1 ETEST: 0 CTEST: 0
/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw0: Command not found.
/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw1c: Command not found.
/scratch/19ph92r03/safikul/WIENNCM/WIENNCM/lapw2c: Command not found.
CORE - Error
...................................................................................................................................
Sir I eanestly request you to please help me to sort out
this issue.
Kind Regards,
Safikul Islam
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