[Wien] run_lapw

[Peter Blaha]

It is enough to replace the script.

This is a shell-script, no fortran program. Thus no recompilation.

Am 01.02.2023 um 14:00 schrieb pluto via Wien:
> Dear Prof. Blaha,
> 
> I understand it is enough to simply replace the existing run_lapw file?
> 
> Or does one need to recompile everything?
> 
> Best,
> Lukasz
> 
> 
> 
> On 2023-02-01 12:43, Peter Blaha wrote:
>> Only 23.
>>
>> Am 01.02.2023 um 12:09 schrieb Laurence Marks:
>>> Which version(s) of Wien2k does this effect?
>>>
>>> -- 
>>> Professor Laurence Marks
>>> Department of Materials Science and Engineering, Northwestern University
>>> www.numis.northwestern.edu <http://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, Feb 1, 2023, 02:31 Peter Blaha <peter.blaha at tuwien.ac.at 
>>> <mailto:peter.blaha at tuwien.ac.at>> wrote:
>>>
>>>     Dear wien2k users,
>>>
>>>     There is a small bug in  run_lapw for cases without inversion 
>>> symmetry.
>>>     Most likely not critical except when the default case.in1c file 
>>> would
>>>     produce a QTL-B error, which would not be fixed automatically.
>>>
>>>     A new version is attached and the web-version has been corrected
>>>     (release 1.2.23)
>>>
>>>     Regards
>>>     -- 
>>> --------------------------------------------------------------------------
>>>     Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>>>     Phone: +43-1-58801-165300
>>>     Email: peter.blaha at tuwien.ac.at <mailto:peter.blaha at tuwien.ac.at> 
>>>      WIEN2k: http://www.wien2k.at <http://www.wien2k.at>
>>>     WWW: http://www.imc.tuwien.ac.at <http://www.imc.tuwien.ac.at>
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>>>
>>>
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-- 
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300
Email: peter.blaha at tuwien.ac.at    WIEN2k: http://www.wien2k.at
WWW:   http://www.imc.tuwien.ac.at
-------------------------------------------------------------------------