Re: [QE-users] Fortran runtime error: Disk quota exceeded

2022-02-26 Thread Paolo Giannozzi
On Sat, Feb 26, 2022 at 5:59 PM Microsoft.com team 
wrote:

I just would like to know after increasing my quota may I restart my
> computations from the last point
>

if your code crashed because the disk quota was exceeded, it is VERY
unlikely that you can restart it

Paolo




>
> On 26 Feb 2022 at 15:23, Lorenzo Paulatto  wrote:
>
> Dear Tarek,
> This is not a quantum espresso error.
> Ask your system administrators to increase your disk quota, or if there is
> a larger disk that you can use for storing temporary data.
> Hth
> --
> Lorenzo Paulatto
>
> On Sat, Feb 26, 2022, 03:21 Tarek Hammad  wrote:
>
>> Dear QE team and users
>>
>> I run an THERMO_PW code to obtain the elastic constants for a complex
>> system (40 atoms). After long time of running, namely, near the end of
>> calculations the code was terminated and I have got this message in slurm
>> file:
>>
>>
>> --
>>
>> Job 163403 is running on comp087
>> sh: gnuplot: command not found
>> At line 186 of file io_base.f90 (unit = 4, file =
>> './/g15/zn3p2.save/wfc59.dat')
>> *Fortran runtime error: Disk quota exceeded*
>>
>> Error termination. Backtrace:
>>
>> Could not print backtrace: DWARF underflow in .debug_info at 866585
>> #0  0x2b72596b2dba
>> #1  0x2b72596b3875
>> #2  0x2b72596b3ffa
>> #3  0x2b72598abf67
>> #4  0x2b72598ac090
>> #5  0x2b72598ac9e8
>> #6  0xb68498
>> #7  0x966dda
>> #8  0x9617c0
>> #9  0x446820
>> #10  0x47efba
>> #11  0x416f26
>> #12  0x4045ca
>> #13  0x2b7259c68554
>> #14  0x404619
>> #15  0x
>> --
>> Primary job  terminated normally, but 1 process returned
>> a non-zero exit code. Per user-direction, the job has been aborted.
>> --
>> --
>> mpirun detected that one or more processes exited with non-zero status,
>> thus causing
>> the job to be terminated. The first process to do so was:
>>
>>   Process name: [[60482,1],0]
>>   Exit code:2
>>
>>
>> --
>>
>> Please, I would not like to restart from the beginning?
>>
>> I need your advise please.
>>
>> Thanks a lot for your help.
>>
>> Dr. Tarek Hammad.
>> ___
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>> users mailing list users@lists.quantum-espresso.org
>> https://lists.quantum-espresso.org/mailman/listinfo/users
>
>
> ___
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users@lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
>
>
> ___
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users@lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users



-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
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Re: [QE-users] Fortran runtime error: Disk quota exceeded

2022-02-26 Thread Microsoft.com team
 
 
 
  Dear Lorenzo
 
Thanks a lot for your help.
 
I just would like to know after increasing my quota may I restart my 
computations from the last point and how it can be done or should I restart 
from the beginning.
 
Thanks a lot once again for your efforts.  
 
Tarek Hammad.  
 

 

 

 
 
 
 
 
>  
> On 26 Feb 2022 at 15:23, Lorenzo Paulattowrote:
>  
>
>  
>  
> Dear Tarek,
>  
> This is not a quantum espresso error.
>  Ask your system administrators to increase your disk quota, or if there is a 
> larger disk that you can use for storing temporary data.
>  Hth
>  
> --
>  Lorenzo Paulatto  
>  
>  
> On Sat, Feb 26, 2022, 03:21 Tarek Hammadwrote:
>  
> >  
> >  
> >
> > Dear QE team and users
> >
> >
> >  
> >
> > I run an THERMO_PW code to obtain the elastic constants for a complex 
> > system (40 atoms). After long time of running, namely, near the end of 
> > calculations the code was terminated and I have got this message in slurm 
> > file:
> >
> >  
> >
> >  
> > --
> >  
> >
> >  
> >
> > Job 163403 is running on comp087
> >  sh: gnuplot: command not found
> >  At line 186 of file io_base.f90 (unit = 4, file = 
> > './/g15/zn3p2.save/wfc59.dat')
> >   Fortran runtime error: Disk quota exceeded
> >
> >  Error termination. Backtrace:
> >  
> >  Could not print backtrace: DWARF underflow in .debug_info at 866585
> >  #00x2b72596b2dba
> >  #10x2b72596b3875
> >  #20x2b72596b3ffa
> >  #30x2b72598abf67
> >  #40x2b72598ac090
> >  #50x2b72598ac9e8
> >  #60xb68498
> >  #70x966dda
> >  #80x9617c0
> >  #90x446820
> >  #100x47efba
> >  #110x416f26
> >  #120x4045ca
> >  #130x2b7259c68554
> >  #140x404619
> >  #150x
> >  --
> >  Primary jobterminated normally, but 1 process returned
> >  a non-zero exit code. Per user-direction, the job has been aborted.
> >  --
> >  --
> >  mpirun detected that one or more processes exited with non-zero status, 
> > thus causing
> >  the job to be terminated. The first process to do so was:
> >  
> >  Process name: [[60482,1],0]
> >  Exit code:2
> >
> >  
> >
> >  
> > --
> >
> >  
> >
> > Please, I would not like to restart from the beginning?
> >
> >  
> >
> > I need your advise please.
> >
> >  
> >
> > Thanks a lot for your help.
> >
> >  
> >
> > Dr. Tarek Hammad.
> >
> >
> >  
> >  ___
> >  Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> >  users mailing list  users@lists.quantum-espresso.org
> >   https://lists.quantum-espresso.org/mailman/listinfo/users
>  
>  ___ 
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu) 
> users mailing list users@lists.quantum-espresso.org  
> https://lists.quantum-espresso.org/mailman/listinfo/users  
>
 ___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users

Re: [QE-users] QE6.8 installation failure on Mac Big Sur

2022-02-26 Thread Eduardo Menendez
In fact, I had  to change both config.guess and config.sub

cp install/config.guess  external/devxlib/config/config.guess
cp install/config.sub  external/devxlib/config/config.sub

That was for version 7.0. Please, update it for version 7.1

Cheers

Eduardo Menendez Proupin
--
I assume that you know enough never to evaluate a polynomial this way:
p=c(0)+c(1)*x+c(2)*x**2+c(3)*x**3+c(4)*x**4
NR, Sect. 5.3 Polynomials and Rational Functions

("config.guess", not "config.sub")

On Wed, Dec 1, 2021 at 2:14 PM Paolo Giannozzi 
wrote:

> Replace the "config.sub" in devxlib with a newer one, or with the one in
> the install/ subdirectory of QE
>
> Paolo
>
> On Tue, Nov 30, 2021 at 11:29 PM Yifan Zhou via users <
> users@lists.quantum-espresso.org> wrote:
>
>> Dear all,
>>
>> I was trying to install QE6.8 to my Mac computer, with M1 processors. It
>> showed me following error when I use "make pw" command":
>>
>> checking build system type... Invalid configuration
>> `aarch64-apple-darwin20.6.0': machine `aarch64-apple' not recognized
>>
>> configure: error: /bin/sh ./config/config.sub aarch64-apple-darwin20.6.0
>> failed
>>
>> if test -d src/ ; then \
>>
>> ( cd src/ ; make ) ; fi
>>
>> make[3]: *** No rule to make target `device_auxfunc_mod.o', needed by
>> `deviceXlib_mod.o'.  Stop.
>>
>> make[2]: *** [libsrc] Error 2
>>
>> make[1]: *** [libcuda_devxlib] Error 2
>>
>> make: *** [libcuda] Error 2
>>
>>
>> If you have any advice on this please let me know, I really appreciate it.
>>
>>
>> Thanks in advance.
>>
>>
>> Yifan Zhou, Student @ University of California, San Diego
___
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Re: [QE-users] Fortran runtime error: Disk quota exceeded

2022-02-26 Thread Lorenzo Paulatto
Dear Tarek,
This is not a quantum espresso error.
Ask your system administrators to increase your disk quota, or if there is
a larger disk that you can use for storing temporary data.
Hth
-- 
Lorenzo Paulatto

On Sat, Feb 26, 2022, 03:21 Tarek Hammad  wrote:

> Dear QE team and users
>
> I run an THERMO_PW code to obtain the elastic constants for a complex
> system (40 atoms). After long time of running, namely, near the end of
> calculations the code was terminated and I have got this message in slurm
> file:
>
>
> --
>
> Job 163403 is running on comp087
> sh: gnuplot: command not found
> At line 186 of file io_base.f90 (unit = 4, file =
> './/g15/zn3p2.save/wfc59.dat')
> *Fortran runtime error: Disk quota exceeded*
>
> Error termination. Backtrace:
>
> Could not print backtrace: DWARF underflow in .debug_info at 866585
> #0  0x2b72596b2dba
> #1  0x2b72596b3875
> #2  0x2b72596b3ffa
> #3  0x2b72598abf67
> #4  0x2b72598ac090
> #5  0x2b72598ac9e8
> #6  0xb68498
> #7  0x966dda
> #8  0x9617c0
> #9  0x446820
> #10  0x47efba
> #11  0x416f26
> #12  0x4045ca
> #13  0x2b7259c68554
> #14  0x404619
> #15  0x
> --
> Primary job  terminated normally, but 1 process returned
> a non-zero exit code. Per user-direction, the job has been aborted.
> --
> --
> mpirun detected that one or more processes exited with non-zero status,
> thus causing
> the job to be terminated. The first process to do so was:
>
>   Process name: [[60482,1],0]
>   Exit code:2
>
>
> --
>
> Please, I would not like to restart from the beginning?
>
> I need your advise please.
>
> Thanks a lot for your help.
>
> Dr. Tarek Hammad.
> ___
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users@lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users