Re: [Wien] dstart error in wien2k ver21_1

2021-09-09 Thread Ashwani Kumar 
Hi,
   Problem resolved.
There was configuration issues. Thanks Dr. L. Marks

Thanks,
A. kumar

On Thu, Sep 2, 2021 at 10:24 PM Laurence Marks 
wrote:

> Please read!
>
> The message says that you cannot ssh to the same machine. This is a setup
> issue. Without more information (.machines file) nobody can help; they
> probably cannot help with the information as this is 99% probability an
> issue of your OS setup, not Wien2k.
>
> _
> Professor Laurence Marks
> "Research is to see what everybody else has seen, and to think what nobody
> else has thought", Albert Szent-Györgyi
> www.numis.northwestern.edu
>
> On Thu, Sep 2, 2021, 11:47 Ashwani Kumar  wrote:
>
>> Hello everyone,
>> Recently, I have upgraded wien2k version (from ver19 to ver21) and OS
>> ( ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in
>> thread
>> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
>> 
>> i am getting the error during initialization of the calculation for
>> dstart.
>>  " next is dstart
>> >   dstart  -p > & .mist (17:12:16)
>>  stop error"
>>
>> An empty "dstart.error" file is generated.
>>
>> When dstart program is called individually with and without -p switch,
>> these are results.
>> ser@user:~/WIEN2k/STO$ x dstart -p
>> starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
>>  .machine0 : 1 processors
>> running dstart remotely on localhost
>> ssh: connect to host localhost port 22: Connection refused
>> 0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
>> error: command   /apps/code/wien2k/dstartpara dstart.def   failed
>> user@user:~/WIEN2k/STO$ x dstart
>> STOP DSTART ENDS
>> 1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w
>>
>>  dstart without -p executes successfully. With -p switch, def failed.
>> Please help how to solve this.
>>
>> Regards,
>> A. kumar
>> ___
>> Wien mailing list
>> Wien@zeus.theochem.tuwien.ac.at
>>
>> https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZudlbzXqhg$
>> SEARCH the MAILING-LIST at:
>> https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZufaZM3A-A$
>>
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Re: [Wien] dstart error in wien2k ver21_1

2021-09-02 Thread Laurence Marks 
For dstart -p you must have an entry in the .machines file, please read the
UG.

On Thu, Sep 2, 2021 at 12:30 PM Ashwani Kumar  wrote:

> Ok, i will check the setup. Thanks.
> Settings in *.machine file is
> 1: localhost
> 1:localhost
> granularity:1
> extrafine:1
>
> System: intel xeon W processor, 12 cores (single processor), 64 gb ram.
>
> Regards,
> A. kumar
>
>
> On Thu, Sep 2, 2021 at 10:24 PM Laurence Marks 
> wrote:
>
>> Please read!
>>
>> The message says that you cannot ssh to the same machine. This is a setup
>> issue. Without more information (.machines file) nobody can help; they
>> probably cannot help with the information as this is 99% probability an
>> issue of your OS setup, not Wien2k.
>>
>> _
>> Professor Laurence Marks
>> "Research is to see what everybody else has seen, and to think what
>> nobody else has thought", Albert Szent-Györgyi
>> www.numis.northwestern.edu
>>
>> On Thu, Sep 2, 2021, 11:47 Ashwani Kumar  wrote:
>>
>>> Hello everyone,
>>> Recently, I have upgraded wien2k version (from ver19 to ver21) and
>>> OS ( ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described
>>> in thread
>>>
>>> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
>>> 
>>> i am getting the error during initialization of the calculation for
>>> dstart.
>>>  " next is dstart
>>> >   dstart  -p > & .mist (17:12:16)
>>>  stop error"
>>>
>>> An empty "dstart.error" file is generated.
>>>
>>> When dstart program is called individually with and without -p switch,
>>> these are results.
>>> ser@user:~/WIEN2k/STO$ x dstart -p
>>> starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
>>>  .machine0 : 1 processors
>>> running dstart remotely on localhost
>>> ssh: connect to host localhost port 22: Connection refused
>>> 0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
>>> error: command   /apps/code/wien2k/dstartpara dstart.def   failed
>>> user@user:~/WIEN2k/STO$ x dstart
>>> STOP DSTART ENDS
>>> 1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w
>>>
>>>  dstart without -p executes successfully. With -p switch, def failed.
>>> Please help how to solve this.
>>>
>>> Regards,
>>> A. kumar
>>> ___
>>> Wien mailing list
>>> Wien@zeus.theochem.tuwien.ac.at
>>>
>>> https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZudlbzXqhg$
>>> SEARCH the MAILING-LIST at:
>>> https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZufaZM3A-A$
>>>
>> ___
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>> 
>> SEARCH the MAILING-LIST at:
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>> 
>>
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>


-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and to think what nobody
else has thought" Albert Szent-Györgyi
___
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Re: [Wien] dstart error in wien2k ver21_1

2021-09-02 Thread Ashwani Kumar 
Ok, i will check the setup. Thanks.
Settings in *.machine file is
1: localhost
1:localhost
granularity:1
extrafine:1

System: intel xeon W processor, 12 cores (single processor), 64 gb ram.

Regards,
A. kumar


On Thu, Sep 2, 2021 at 10:24 PM Laurence Marks 
wrote:

> Please read!
>
> The message says that you cannot ssh to the same machine. This is a setup
> issue. Without more information (.machines file) nobody can help; they
> probably cannot help with the information as this is 99% probability an
> issue of your OS setup, not Wien2k.
>
> _
> Professor Laurence Marks
> "Research is to see what everybody else has seen, and to think what nobody
> else has thought", Albert Szent-Györgyi
> www.numis.northwestern.edu
>
> On Thu, Sep 2, 2021, 11:47 Ashwani Kumar  wrote:
>
>> Hello everyone,
>> Recently, I have upgraded wien2k version (from ver19 to ver21) and OS
>> ( ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in
>> thread
>> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
>> 
>> i am getting the error during initialization of the calculation for
>> dstart.
>>  " next is dstart
>> >   dstart  -p > & .mist (17:12:16)
>>  stop error"
>>
>> An empty "dstart.error" file is generated.
>>
>> When dstart program is called individually with and without -p switch,
>> these are results.
>> ser@user:~/WIEN2k/STO$ x dstart -p
>> starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
>>  .machine0 : 1 processors
>> running dstart remotely on localhost
>> ssh: connect to host localhost port 22: Connection refused
>> 0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
>> error: command   /apps/code/wien2k/dstartpara dstart.def   failed
>> user@user:~/WIEN2k/STO$ x dstart
>> STOP DSTART ENDS
>> 1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w
>>
>>  dstart without -p executes successfully. With -p switch, def failed.
>> Please help how to solve this.
>>
>> Regards,
>> A. kumar
>> ___
>> Wien mailing list
>> Wien@zeus.theochem.tuwien.ac.at
>>
>> https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZudlbzXqhg$
>> SEARCH the MAILING-LIST at:
>> https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZufaZM3A-A$
>>
> ___
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> Wien@zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at:
> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>
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Re: [Wien] dstart error in wien2k ver21_1

2021-09-02 Thread Laurence Marks 
Please read!

The message says that you cannot ssh to the same machine. This is a setup
issue. Without more information (.machines file) nobody can help; they
probably cannot help with the information as this is 99% probability an
issue of your OS setup, not Wien2k.

_
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Györgyi
www.numis.northwestern.edu

On Thu, Sep 2, 2021, 11:47 Ashwani Kumar  wrote:

> Hello everyone,
> Recently, I have upgraded wien2k version (from ver19 to ver21) and OS
> ( ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in
> thread
> https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
> 
> i am getting the error during initialization of the calculation for
> dstart.
>  " next is dstart
> >   dstart  -p > & .mist (17:12:16)
>  stop error"
>
> An empty "dstart.error" file is generated.
>
> When dstart program is called individually with and without -p switch,
> these are results.
> ser@user:~/WIEN2k/STO$ x dstart -p
> starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
>  .machine0 : 1 processors
> running dstart remotely on localhost
> ssh: connect to host localhost port 22: Connection refused
> 0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
> error: command   /apps/code/wien2k/dstartpara dstart.def   failed
> user@user:~/WIEN2k/STO$ x dstart
> STOP DSTART ENDS
> 1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w
>
>  dstart without -p executes successfully. With -p switch, def failed.
> Please help how to solve this.
>
> Regards,
> A. kumar
> ___
> Wien mailing list
> Wien@zeus.theochem.tuwien.ac.at
>
> https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZudlbzXqhg$
> SEARCH the MAILING-LIST at:
> https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D_wAO6wPa7cjHnAwiMWnH6C8wQztOBnMgSLEGImbk2SdDOcKg4gG8Q4VObCqZufaZM3A-A$
>
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[Wien] dstart error in wien2k ver21_1

2021-09-02 Thread Ashwani Kumar 
Hello everyone,
Recently, I have upgraded wien2k version (from ver19 to ver21) and OS (
ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in
thread
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
i am getting the error during initialization of the calculation for dstart.
 " next is dstart
>   dstart  -p > & .mist (17:12:16)
 stop error"

An empty "dstart.error" file is generated.

When dstart program is called individually with and without -p switch,
these are results.
ser@user:~/WIEN2k/STO$ x dstart -p
starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
 .machine0 : 1 processors
running dstart remotely on localhost
ssh: connect to host localhost port 22: Connection refused
0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
error: command   /apps/code/wien2k/dstartpara dstart.def   failed
user@user:~/WIEN2k/STO$ x dstart
STOP DSTART ENDS
1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w

 dstart without -p executes successfully. With -p switch, def failed.
Please help how to solve this.

Regards,
A. kumar
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