[Wien] Tmaker: command not found

[Peter Blaha]

You should not run:

$WIENROOT/x $WIENROOT/SRC_cif2struct

but simply:    x cif2struct
or:            makestruct

If this does not work, ost likely, $WIENROOT is not in your path.

what do you get with:

which x   ???

Probably you have to run   $WIENROOT/userconfig_lapw
and then logout/login again.

If you do have  $WIENROOT in your path, then probably WIEN2k was not 
properly installed (compiled) and all the Fortran executables are missing.

ls -als $WIENROOT/nn

On 2/20/19 1:21 AM, Peipei Hao wrote:
> Hi,
> 
> -I was running WIEN2k_18.2 in a logging in node of school cluster, with 
> the ifort compiler offered under the intel MPI frame.
> 
> -I was trying to construct my master input file: case.struct with 
> cif2struct/makestruct and to initialize a SCF calculation
> 
> -I could only find a file named "SRC_cif2struct" and so I ran 
> "$WIENROOT/x $WIENROOT/SRC_cif2struct " under the sub-directory where my 
> cif file lies, but only got an empty file named: case.struct;
> 
> -Then I tried to construct the struct file with "makestruct" by running 
> "$WIENROOT/makestruct" under the sub-directory, and typing all the 
> structure info required, then if said "Tmaker: command not found" following
> "Now, 'datastruct' file is ready.
> We Run 'Tmaker' for making WIEN2k struct file."
> After that, again I got an empty file named: init.struct.
> 
> -I was doubting whether this problem was caused by an inconsistency 
> between the naming of the related programs under the dir:$WIENROOT and 
> the codes in those executable files, since there is only a directory 
> called "SRC_Tmaker" rather than "Tmaker", which is similar to the case 
> of the "SRC_cif2struct" files. Or is that possibly caused by some error 
> I made in the original configuration?
> 
> -Also, when I tried to run "init_lapw" with one of those example files, 
> similar errors happend with the notification: "$WIENROOT/nn: Command not 
> found."
> 
> Thanks,
> Peipei
> 
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-- 

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WIEN2k: http://www.wien2k.at
WWW:   http://www.imc.tuwien.ac.at/TC_Blaha
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