[Wien] FINDLOC issue with latest version of Wien2k with fortran v.15

Dr. K. C. Bhamu kcbhamu85 at gmail.com
Wed Feb 16 05:00:17 CET 2022


Dear Prof. Peter,
I have tried to install oneapi but getting another error of SQL:
bash ./l_HPCKit_p_2022.1.2.117_offline.sh  -s -a --silent --eula accept
Checking system requirements...
Done.
Wait while the installer is preparing...
Done.
Launching the installer...
Installer failed with the error Sqlite SQL execution failed.
#----

and I do not see any compilers in oneapi directory.

#---
>From SQL installation procedure, I see it needs a root access:
https://phoenixnap.com/kb/sql-server-linux


Any help will be appreciated.

Regards
Bhamu





On Mon, Feb 7, 2022 at 4:13 PM Peter Blaha <pblaha at theochem.tuwien.ac.at>
wrote:

> You probably can install it. root is not required. Try it.
> Am 07.02.2022 um 11:31 schrieb Dr. K. C. Bhamu:
>
> Thanks Prof. Peter.
>
> But unfortunately I can not install this version in cluster. Admistrative
> staff also denied as they are moved on GPU so not helping for CPU
> calculations.
>
>
> Regards
> Bhamu
>
> On Mon, Feb 7, 2022, 7:27 PM Peter Blaha <pblaha at theochem.tuwien.ac.at>
> wrote:
>
>> It does not work with an old compiler.
>>
>> The intel compiler is now free.
>> Am 07.02.2022 um 11:02 schrieb Dr. K. C. Bhamu:
>>
>> A gentle reminder for the help.
>>
>>
>> Regards
>> Bhamu
>>
>> On Fri, Feb 4, 2022 at 8:10 AM Dr. K. C. Bhamu <kcbhamu85 at gmail.com>
>> wrote:
>>
>>> Dear Experts,
>>> I am facing an issue [1] with a recent version of Wien2k installation
>>> with Fortran v.15 "composer_xe_2015.2.164".
>>> Earlier reported issue was resolved by upgrading the Fortran version.
>>> But for me, I have no choice of updating the intel compilers.
>>>
>>> Could someone please help me to resolve this issue?
>>>
>>> [1].
>>> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21006.html
>>>
>>> Please let me know what else information you need.
>>>
>>> Regards
>>> Bhamu
>>>
>>
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>> --
>> -----------------------------------------------------------------------
>> Peter Blaha,  Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
>> Phone: +43-158801165300
>> Email: peter.blaha at tuwien.ac.at
>> WWW:   http://www.imc.tuwien.ac.at      WIEN2k: http://www.wien2k.at
>> -------------------------------------------------------------------------
>>
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>
> _______________________________________________
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> SEARCH the MAILING-LIST at:  http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
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> --
> -----------------------------------------------------------------------
> Peter Blaha,  Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
> Phone: +43-158801165300
> Email: peter.blaha at tuwien.ac.at
> WWW:   http://www.imc.tuwien.ac.at      WIEN2k: http://www.wien2k.at
> -------------------------------------------------------------------------
>
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