from:"Surykant Mishra"

Re: [Pw_forum] problem

2015-07-13 Thread Surykant Mishra

ok i am trying  thank you


Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore

On Mon, Jul 13, 2015 at 3:31 PM, Bramha Pandey <pandey.bra...@gmail.com>
wrote:

> Hi, Firstly you see the results folder. There will be xxx.scf.out file.
> open and see what is printed in xx.scf.out file.
> Then accordingly you have to act.
>
>
>
> --
> Regards
> Dr. Bramha P Pandey
> Asstt. Prof. ECE Deptt.
> GLA University, Mathura (U.P)
> India-281406.
>
> On Mon, Jul 13, 2015 at 3:20 PM, Surykant Mishra <phd1401251...@iiti.ac.in
> > wrote:
>
>> Sir
>> I am runnig example01 in examples in PW folder in Espresso folder
>>
>> Thanks & regards
>> Suryakant Mishra
>> Indian Institute of Technology Indore
>>
>> On Mon, Jul 13, 2015 at 1:02 PM, Bramha Pandey <pandey.bra...@gmail.com>
>> wrote:
>>
>>> Dear suryakant
>>> No one can help, until and unless you provide your input file  and
>>> output file or example name which you are running.
>>> On 13-Jul-2015 12:19 PM, "Surykant Mishra" <phd1401251...@iiti.ac.in>
>>> wrote:
>>>
>>>> Can any budy resolve my problem
>>>>
>>>>
>>>> This example shows how to use pw.x to calculate the total energy and
>>>> the band structure of four simple systems: Si, Al, Cu, Ni.
>>>>
>>>>   executables directory: /home/stm/espresso-5.2.0/bin
>>>>   pseudo directory:  /home/stm/espresso-5.2.0/pseudo
>>>>   temporary directory:   /home/stm/espresso-5.2.0/tempdir
>>>>   checking that needed directories and files exist... done
>>>>
>>>>   running pw.x as:   /home/stm/espresso-5.2.0/bin/pw.x  -nk 1 -nd 1 -nb
>>>> 1 -nt 1
>>>>
>>>>   running the scf calculation for Si...Segmentation fault (core dumped)
>>>> Error condition encountered during test: exit status = 139
>>>> Aborting
>>>> stm@stm:~/espresso-5.2.0/PW/examples/example01$
>>>>
>>>> Thanks in advance
>>>>
>>>>
>>>>
>>>> Thanks & regards
>>>> Suryakant Mishra
>>>> Indian Institute of Technology Indore
>>>>
>>>> ___
>>>> Pw_forum mailing list
>>>> Pw_forum@pwscf.org
>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>>
>>>
>>> ___
>>> Pw_forum mailing list
>>> Pw_forum@pwscf.org
>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>
>>
>>
>> ___
>> Pw_forum mailing list
>> Pw_forum@pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
> ___
> Pw_forum mailing list
> Pw_forum@pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] problem

2015-07-13 Thread Surykant Mishra

Sir
I am runnig example01 in examples in PW folder in Espresso folder

Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore

On Mon, Jul 13, 2015 at 1:02 PM, Bramha Pandey <pandey.bra...@gmail.com>
wrote:

> Dear suryakant
> No one can help, until and unless you provide your input file  and output
> file or example name which you are running.
> On 13-Jul-2015 12:19 PM, "Surykant Mishra" <phd1401251...@iiti.ac.in>
> wrote:
>
>> Can any budy resolve my problem
>>
>>
>> This example shows how to use pw.x to calculate the total energy and
>> the band structure of four simple systems: Si, Al, Cu, Ni.
>>
>>   executables directory: /home/stm/espresso-5.2.0/bin
>>   pseudo directory:  /home/stm/espresso-5.2.0/pseudo
>>   temporary directory:   /home/stm/espresso-5.2.0/tempdir
>>   checking that needed directories and files exist... done
>>
>>   running pw.x as:   /home/stm/espresso-5.2.0/bin/pw.x  -nk 1 -nd 1 -nb 1
>> -nt 1
>>
>>   running the scf calculation for Si...Segmentation fault (core dumped)
>> Error condition encountered during test: exit status = 139
>> Aborting
>> stm@stm:~/espresso-5.2.0/PW/examples/example01$
>>
>> Thanks in advance
>>
>>
>>
>> Thanks & regards
>> Suryakant Mishra
>> Indian Institute of Technology Indore
>>
>> ___
>> Pw_forum mailing list
>> Pw_forum@pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
> ___
> Pw_forum mailing list
> Pw_forum@pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

[Pw_forum] problem

2015-07-13 Thread Surykant Mishra

Can any budy resolve my problem


This example shows how to use pw.x to calculate the total energy and
the band structure of four simple systems: Si, Al, Cu, Ni.

  executables directory: /home/stm/espresso-5.2.0/bin
  pseudo directory:  /home/stm/espresso-5.2.0/pseudo
  temporary directory:   /home/stm/espresso-5.2.0/tempdir
  checking that needed directories and files exist... done

  running pw.x as:   /home/stm/espresso-5.2.0/bin/pw.x  -nk 1 -nd 1 -nb 1
-nt 1

  running the scf calculation for Si...Segmentation fault (core dumped)
Error condition encountered during test: exit status = 139
Aborting
stm@stm:~/espresso-5.2.0/PW/examples/example01$

Thanks in advance



Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] (no subject)

2015-07-09 Thread Surykant Mishra

while doing make all in espresso folder i am getting


make[6]: Leaving directory `/home/stm/espresso-5.2.0/PW/tools'
make[5]: Leaving directory `/home/stm/espresso-5.2.0/PW'
make[4]: Leaving directory `/home/stm/espresso-5.2.0'
make[3]: Leaving directory `/home/stm/espresso-5.2.0/XSpectra/src'
make[2]: Leaving directory `/home/stm/espresso-5.2.0/XSpectra'
touch make-xspectra
make[1]: Leaving directory `/home/stm/espresso-5.2.0/install'
stm@stm:~/espresso-5.2.0$

then what i have to do
i am a fresh learner so guide me if you can
Thanks in advance

Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore

On Thu, Jul 9, 2015 at 5:26 PM, Paolo Giannozzi <p.gianno...@gmail.com>
wrote:

> If you keep asking the same question without explaining what doesn't work:
> no, nobody can help you
>
> On Thu, Jul 9, 2015 at 1:54 PM, Surykant Mishra <phd1401251...@iiti.ac.in>
> wrote:
>
>> Can anybody help me for installation of 'Quantum Espresso 5.2'
>>
>>
>>
>>
>>
>> Thanks & regards
>> Suryakant Mishra
>> Indian Institute of Technology Indore
>>
>> ___
>> Pw_forum mailing list
>> Pw_forum@pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
>
> --
> Paolo Giannozzi, Dept. Chemistry,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
> ___
> Pw_forum mailing list
> Pw_forum@pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

[Pw_forum] (no subject)

2015-07-09 Thread Surykant Mishra

Can anybody help me for installation of 'Quantum Espresso 5.2'





Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] Error in routine d_matrix_so

2015-07-08 Thread Surykant Mishra

Hi Rajdeep,
can u help me for installation of "Quantum Espresso" Plz

Thanks & regards
Suryakant Mishra
Indian Institute of Technology Indore

On Thu, Jul 9, 2015 at 9:27 AM, Rajdeep Banerjee 
wrote:

> Dear all,
> I tried to run pdos calculation in my system with spin-orbit
> coupling, in espresso-5.1.1, 5.1.2 and 5.2.0 but got the same error, i.e.
>
> Calling projwave_nc 
>
>  %
> %
>  Error in routine d_matrix_so (5):
>  D_S (j=1/2) for this symmetry operation is not unitary
>
>  
> %%
>
>  stopping ..
>
> If anyone has any idea how to resolve the issue, please share. I have
> attached the input files so that one can reproduce the error.
>
> thanks and regards,
>
> --
> Rajdeep Banerjee
> PhD student
> JNCASR, Bangalore
> India
>
> ___
> Pw_forum mailing list
> Pw_forum@pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] problem

2015-07-08 Thread Surykant Mishra

while doing make all in espresso folder i am getting


make[6]: Leaving directory `/home/stm/espresso-5.2.0/PW/tools'
make[5]: Leaving directory `/home/stm/espresso-5.2.0/PW'
make[4]: Leaving directory `/home/stm/espresso-5.2.0'
make[3]: Leaving directory `/home/stm/espresso-5.2.0/XSpectra/src'
make[2]: Leaving directory `/home/stm/espresso-5.2.0/XSpectra'
touch make-xspectra
make[1]: Leaving directory `/home/stm/espresso-5.2.0/install'
stm@stm:~/espresso-5.2.0$

the what i have to do

Thanks 
Suryakant Mishra
Indian Institute of Technology Indore

On Wed, Jul 8, 2015 at 11:30 AM, Sanjeev Gupta <physics.skgu...@gmail.com>
wrote:

> what is "problem"?
>
> thanks
> sanjeev
>
> On Wed, Jul 8, 2015 at 11:18 AM, Surykant Mishra <phd1401251...@iiti.ac.in
> > wrote:
>
>> Sir,
>> I am a phd scholar from India, Sir i am getting problem while installing
>> "Quantum Espresso" so kindly help me for installation of the same..
>>
>> Thank You
>>
>> Suryakant Mishra
>> Indian Institute of Technology Indore
>>
>> On Wed, Jul 8, 2015 at 10:20 AM, Surykant Mishra <
>> phd1401251...@iiti.ac.in> wrote:
>>
>>> Sir,
>>> I am a phd scholar from India, Sir i am getting problem while installing
>>> "Quantum Espresso" so kindly help me for installation of the same..
>>>
>>> Thank You
>>> Suryakant Mishra
>>> Indian Institute of Technology Indore
>>>
>>
>>
>> ___
>> Pw_forum mailing list
>> Pw_forum@pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
>
> --
> With Best Regards,
>
> 
> Dr. Sanjeev Kumar Gupta
> Fulbright Post-Doctoral Scholar
> Dept. of Physics
> Michigan Technological University
> 1400 Townsend Drive, Houghton
> MI 49931, USA
> 
>
> ___
> Pw_forum mailing list
> Pw_forum@pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] problem

2015-07-07 Thread Surykant Mishra

Sir,
I am a phd scholar from India, Sir i am getting problem while installing
"Quantum Espresso" so kindly help me for installation of the same..

Thank You

Suryakant Mishra
Indian Institute of Technology Indore

On Wed, Jul 8, 2015 at 10:20 AM, Surykant Mishra <phd1401251...@iiti.ac.in>
wrote:

> Sir,
> I am a phd scholar from India, Sir i am getting problem while installing
> "Quantum Espresso" so kindly help me for installation of the same..
>
> Thank You
> Suryakant Mishra
> Indian Institute of Technology Indore
>
___
Pw_forum mailing list
Pw_forum@pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum

Re: [Pw_forum] problem

Re: [Pw_forum] problem

[Pw_forum] problem

Re: [Pw_forum] (no subject)

[Pw_forum] (no subject)

Re: [Pw_forum] Error in routine d_matrix_so

Re: [Pw_forum] problem

Re: [Pw_forum] problem

8 matches

Site Navigation

Mail list logo

Footer information