Dear Professor Blaha and Wien users,
I am interested in states in conduction bands, but I am not interested to
get a Fermi energy (and I have no Fermi error in the ground state run).
I occupy some conduction states (removing some from valence bands) with
some electrons by changing the weight
: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
FERMI - Error
the file uplapw2.error contains :
Error in LAPW2
'FERMI' - EFERMI OUT OF ENERGY RANGE
'FERMI' - STOP IN EFI
'FERMI' - ENERGY OF LOWER BOUND
)
0 number of atoms for which RLO is added
1 -4.23 .0001 atom number,e-lo,de (case.in1), repeat NX times
2 1 2number of atoms for which SO is switch off;
atoms
Then the following:
LAPW0 END
LAPW1 END
LAPWSO END
FERMI - Error
> s
Dear Wien2k Tran Sir and others,
Do we need to put -hf switch with "x lapw2" when calculating the optical and
doss properties from YS-PBE0?Without -hf I got optical and DOSs without any
error but when I use -hf with lapw2 I am getting an error:
LAPW1 END
LAPW1 END
LAPW1 END
FER
Dear WIEN2k authors users,
Calculating DOS after bandstructure gives FERMI-ERROR. In UG it is
given that we have to recalculate case.vector file using tetrahedral
k-mesh to calculate DOS after bandstructure. Hence, it is requested
to explain how to do the above step.
Thanking you,
Yours
for WIEN2k users
Subject: Re: [Wien] Fermi - Error in Band structure calculation
You missed a step, see below:
Fhokrul Islam schrieb:
Hi Prof Blaha and Wien2k users,
I am trying to calculate the spin polarized band structure of a
semiconducting supercell with a transition metal impurity
Dear Peter:
I want to learn how to calculate 4f electron, I do it as FAQ showed:
Open core treatment of 4f(5f) electron? but there is something error after I
modified the case.inc case.in1 case.in2:
first, it shows SELECT error, so I using small mixer parameter;
but it shows Fermi error now
Dear Wien2k Users,
I am working on alloys under pressure study during run SCF following error
occur. what should I do?
FORTRAN STOP FERMI - Error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
Professor Blaha and Wien users,
I am interested in states in conduction bands, but I am not interested
to get a Fermi energy (and I have no Fermi error in the ground state run).
I occupy some conduction states (removing some from valence bands) with
some electrons by changing the weight files. If
:
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
Fermi - Error
The dnlapw2.error file reads:
'LAPW2' can't open unit: 30
LAPW2' - filename: Mn110.energysodn_9
I have used the following steps to calculate the band structure as instructed
in the user manual:
(the calculation
To: A Mailing list for WIEN2k users
Subject: Re: [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error
If your fermi energy is really that high, you may have to increase
EMAX in case.in1 (last line), otherwise you do not have enough
eigenvalues to fill in all your electrons.
Ghosh
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
FERMI - Error
the file uplapw2.error contains :
Error in LAPW2
'FERMI' -EFERMI OUT OF ENERGY RANGE
'FERMI' - STOP INEFI
'FERMI' - ENERGY OF LOWER BOUND : -0.91514
'FERMI' - NUMBER
There is usually a more detailed message for 'FERMI - Error' in one of
the *lapw2.error files:
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg02361.html
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg08805.html
You checked all error files in the case
number of atoms for which SO is switch
off; atoms
Then the following:
LAPW0 END
LAPW1 END
LAPWSO END
FERMI - Error
stop error
When RLO is added, the job runs without any hitch.
Please, I need your kind assistance to overcome this challenge.
Chukwuemeka Okoye
*scf1*: No such file or directory
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
The same calculation runs without any problem for a single core. I
will really appreciate if someone can help me resolve this issue.
with best regards
Saqib
en I use -hf with
lapw2 I am getting an error:
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
LEGAL END TETRA
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
OPTIC END
OPTIC END
OPTIC END
JOINT DOS END
However, properties respective files are generated.
Also, I used a 2x2x2 mesh (with 4x4x4 mesh
I want to learn how to calculate 4f electron, I do it as FAQ showed:
Open core treatment of 4f(5f) electron?? but there is something error after
I modified the case.inc case.in1 case.in2:
first, it shows SELECT error, so I using small mixer parameter;
but it shows Fermi error now
Dear Wien2k Users,
I am calculating the ENE of a metastable phase. My approach is the following
1. Calculate ENE without spin orbit
2. Calculate ENE with spin orbit
2. Volume optimization of the structure
For 1, I had to choose global energy parameter as 1.70 as the Fermi energy
was
: Command not found.
LAPW0 END
LAPW1 END
FERMI - Error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
(standard_in) 1: syntax error
Dear wien 2k users ,
i want to calculate partial charges in DOS. but when i click in DOS on x lapw2
-qtl -c -p with option calculate partial charges it gives this error.
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI - Error
0.084u 0.124s 0:00.32 62.5% 0+0k 0
Dear wien 2k users ,
i am doing non spin polarized calculation and i want to calculate partial
charges in DOS. but when i click in DOS on x lapw2 -qtl -c -p with option
calculate partial charges it gives this error.
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI
(standard_in) 1: syntax error
FERMI - Error
LAPW1 END
LAPW1 END
LAPW0 END
in cycle 8ETEST: .12554520 CTEST: .0760248
MIXER END
CORE END
True Regards
M. Sajjad
___
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http
structure electron charge density with
spin orbit coupling(SOC) for ScN compound in RS structure without
errors.When I calculate the DOS with SOC, I got the following:
FERMI - Error
0.045u 0.002s 0:00.04 100.0%0+0k 0+40io 0pf+0w
How can I fix it ?
Thanks a lot for your help.
Mohammed
Hello again
When trying to execute a simple example, I found that the problem is at the
level of execution of LAPW2 program:
regabdou@algerien1970-Dell:~/WIEN2k/TiC-sp$ runsp_lapw
hup: Command not found.
STOP LAPW0 END
STOP LAPW1 END
STOP LAPW1 END
STOP FERMI - Error
and the error message
Search the archive:
http://www.mail-archive.com/search?q=%22FERMI+-+Error%22l=wien@zeus.theochem.tuwien.ac.at
On 3/8/2015 1:53 AM, Qasim Mahmood wrote:
Dear Wien2k Users,
I am working on alloys under pressure study during run SCF following
error occur. what should I do?
FORTRAN STOP FERMI
Dear all,
While doing *DOS* calculation in *spin-orbit coupling *case, I encounter
with an error with message
running LAPW2 in parallel mode
*calculating QTL's from parallel vectors*
*FERMI - Error*
0.201u 0.051s 0:00.39 64.1% 0+0k 0+8io 0pf+0w
I ran all the command prompt systematically
LAPW2 in parallel mode
*calculating QTL's from parallel vectors*
*FERMI - Error*
0.201u 0.051s 0:00.39 64.1%0+0k 0+8io 0pf+0w
I ran all the command prompt systematically but for
*x lapw2 -p -up -so -qtl * case I am face the above error.
Is there any mistake that I am making or am I missing
at the lapw2 step, and I
got the following error:
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp1': No such file or directory
The following is the .machine file:
granularity:1
1:node91
1:node91
etra.def failed" error only):
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
forrtl: severe (24): end-of-file during read, unit 4, file
/home/chin/wien_data/must/test.qtl
Image PC Routine Line
is created, and I can use "spaghetti" and "plot bandstructure" to plot
the "fat bands" in w2web and everything looks fine.
Can I ignore the error?
bash-5.1$ x qtl -up -so
FERMI - Error
0.015u 0.003s 0:00.01 100.0%0+0k 0+552io 0pf+0w
QTL END
28.708u 0.507s 0:08.
interaction but for spin-orbit it gives me the following error:
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
Fermi - Error
The dnlapw2.error file reads:
'LAPW2' can't open unit: 30
LAPW2' - filename: Mn110.energysodn_9
I have used the following steps to calculate
...@zeus.theochem.tuwien.ac.at
[mailto:wien-bounces at zeus.theochem.tuwien.ac.at] On Behalf Of Peter Blaha
Sent: Thursday, March 04, 2010 12:09 PM
To: A Mailing list for WIEN2k users
Subject: Re: [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error
If your fermi energy is really that high, you may
0..........000
'FERMI' - NOS **
Kind Regards
On Wed, Apr 16, 2014 at 1:21 AM, Gavin Abo gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI - Error' in one of the
*lapw2.error files:
http://www.mail
1 -4.23 .0001 atom number,e-lo,de (case.in1), repeat NX times
>> 2 1 2number of atoms for which SO is switch
>> off; atoms
>> Then the following:
>>
>> LAPW0 END
>> LAPW1 END
>> LAPWSO END
>> FERMI - Error
>
2 I am getting an error:
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
LEGAL END TETRA
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
OPTIC END
OPTIC END
OPTIC END
JOINT DOS END
However, properties respective files are generated.
Also, I used a 2x2x2 mesh (with 4x4x4 mesh one one scf cycle w
84D-04
2.277512135430 0.18778395329644D-03
2.281816619070 0.18308654544186D-03
2. I carry out a self-consistent calculation with the above fixed
weight but with a lower charge convergence criterion -cc, with two choices.
(a) If I directly run with case.inm (first line),
MSR1 0.000 YES
Wien gives FERM
0..........000
'FERMI' - NOS **
Kind Regards
On Wed, Apr 16, 2014 at 1:21 AM, Gavin Abo gs...@crimson.ua.edu
mailto:gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI - Error' in
one of the *lapw2.error files
After following the references now getting the following error
> stop error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
InBi.scf1_1: No such file or directory.
[1] + D
If your fermi energy is really that high, you may have to increase
EMAX in case.in1 (last line), otherwise you do not have enough
eigenvalues to fill in all your electrons.
Ghosh SUDDHASATTWA schrieb:
Dear Wien2k Users,
I am calculating the ENE of a metastable phase. My approach is the
Hello Dear
This is the output in terminal after lapw2
raja at ubuntu://home/raja/work/Cu$ x lapw2 -c -p
running LAPW2 in parallel mode
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
** LAPW2 crashed!
0.0u 0.0s 0:00.11 45.4% 0+0k 96+184io 9pf+0w
error: command /home/raja
bandstructure gives FERMI-ERROR. In UG it is
given that we have to recalculate case.vector file using tetrahedral
k-mesh to calculate DOS after bandstructure. Hence, it is requested
to explain how to do the above step.
Thanking you,
Yours sincerely,
Saurabh Samant
bulk.scf1dn_1: No such file or directory.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
stop error
Thank you.
___
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING
,
I am doing mBJ calculations for spinpolarized system.I got the
following error after 12 cycles in the last step(runsp_lapw -i 160):
in cycle 12ETEST: .01090522 CTEST: .0915287
LAPW0 END
LAPW0 END
LAPW1 END
LAPW1 END
FERMI - Error
stop error
After searching
sg11340.html
> ]?
>
>
> On 9/28/2015 8:01 AM, Paresh Chandra Rout wrote:
>
> Dear all,
> While doing *DOS* calculation in *spin-orbit coupling *case, I encounter
> with an error with message
> running LAPW2 in parallel mode
> *calculating QTL's from parallel vectors*
> *FERMI - Er
: *scf1dn*: No such file or directory
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
> stop error
Please note that the code compiled correctly; the details of the OPTIONS
file are shown below.
current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback
-ass
wienncm to run some noncollinear-magnetism
calculations. I have compiled the code without any error report, and
the code runs well in serial mode. But if I run the same calculation
in parallel mode, the calculation is always aborted at the lapw2
step, and I got the following error:
FERMI - Error
.
After running a job in parallel scf GOT THE FOLLOWING ERROR
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
InBi.scf1_1: No such file or directory.
[1] + Done ( ( $remote
t stopped due to an error.
test.scf1_1: No such file or directory.
grep: *scf1*: No such file or directory
FERMI - Error
When I loaded openmpi and ifort as well as icc in the script this error
appeared:
>SLURM_NTASKS_PER_NODE: Undefined variable.
Every time after that the
>SLURM_
0 60
Hello 2439 2 1198992928 60
FERMI - Error
where an error is raised on l. 511, or like this:
Hello 2434 2 54 60
Hello 2435 2 54 60
Hello 2436 2 56
...@crimson.ua.edu
mailto:gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI - Error'
in one of the *lapw2.error files:
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg02361.html
http://www.mail-archive.com/wien
m YS-PBE0?
>Without -hf I got optical and DOSs without any error but when I use -hf with
>lapw2 I am getting an error:
>
> LAPW1 END
> LAPW1 END
> LAPW1 END
>FERMI - Error
> LEGAL END TETRA
> LAPW1 END
> LAPW1 END
> LAPW1 END
>FERMI - Error
> OPTIC END
> OPTIC END
on x lapw2 -qtl -c -p
with option calculate partial charges it gives this error.
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI - Error
0.084u 0.124s 0:00.32 62.5% 0+0k 0+0io 0pf+0w
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1
1.4 with MPD, Ifort 11.1
with MKL and FFTW,
BLAS,BLACS,Lapack and Scalapack libraries.
The Zumbi node is the main node.
The error exit is:
[admin at zumbi gaas]$ run_lapw -p
LAPW0 END
gaas.scf1_1: FNosuch file or directory
FERMI - Error
cp: impossible to get state of .in.tmp: Nosuch file
encounter with an error with message
running LAPW2 in parallel mode
*calculating QTL's from parallel vectors*
*FERMI - Error*
0.201u 0.051s 0:00.39 64.1%0+0k 0+8io 0pf+0w
I ran all the command prompt systematically but for
*x lapw2 -p -up -so -qtl * case I am face the
ine but my MPI jobs always crash in the
first SCF cycle. I get the following message in the log file:
LAPW0 END
PuO2_bulk.scf1up_1: No such file or directory.
grep: *scf1up*: No such file or directory
PuO2_bulk.scf1dn_1: No such file or directory.
grep: *scf1dn*: No such file or directory
FERMI
-11-20: Name or service not known
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
[kcbhamu@gu CuGaO2_993]$
I guess that it is cluster issue but when I saw the node in question, it
looks fine.
Could you please suggest
.
Also in STDOUT , I see the following particular errors. (
...
bash: lapw1: command not found...
.
FERMI - Error
grep: *scf1dn*: No such file or directory
0.381u 0.507s 1:12.66 1.2% 0+0k 128+1736io 1pf+0w
Test-TiC
left, they will be distributed to the residual-machine_name.
#
1:vlsi1
1:vlsi2
1:vlsi3
1:vlsi4
granularity:1
extrafine:1
#
and getting the following error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or di
/users/mollabashi/v19.2/lapw0_mpi
But the error is still exists:
bash: lapw0: command not found
When I used your script in (faq page), one time the .machines file was
generated.
But it stopped due to an error.
test.scf1_1: No such file or directory.
grep: *scf1*: No such file or directory
FERMI -
s the same error.
It seems this error message does not affect anything. The case.qtl file
is created, and I can use "spaghetti" and "plot bandstructure" to plot
the "fat bands" in w2web and everything looks fine.
Can I ignore the error?
bash-5.1$ x qtl -up -so
F
calculate partial charges it gives this error.
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI - Error
0.084u 0.124s 0:00.32 62.5% 0+0k 0+0io 0pf+0w
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
(standard_in) 1: parse error
users ,
i am doing non spin polarized calculation and i want to calculate
partial charges in DOS. but when i click in DOS on x lapw2 -qtl -c -p
with option calculate partial charges it gives this error.
running LAPW2 in parallel mode
calculating QTL's from parallel vectors
FERMI - Error
sys0m0.038s
test.scf1_1: No such file or directory.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp1': No such file or directory
Similar error was occurred when I used mpiexec in the parallel options without
at /work/WIEN2k_12/bashtime2csh.pl_lapw line 42.
bash: lapw1: command not found
bash: fixerror_lapw: command not found
bulk.scf1dn_1: No such file or directory.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
stop error
Thank you
gt;> Dear all,
>>> While doing *DOS* calculation in *spin-orbit coupling *case, I
>>> encounter with an error with message
>>> running LAPW2 in parallel mode
>>> *calculating QTL's from parallel vectors*
>>> *FERMI - Error*
>&g
: command not found
*** *similar more lines**
bash: 0: command not found
bash: 0: command not found
bash: 0: command not found
gga.scf1_1: No such file or directory.
grep: *scf1*: No such file or directory
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
same calculation in
> parallel mode, the calculation is always aborted at the lapw2 step, and I
> got the following error:
>
> FERMI - Error
> cp: cannot stat `.in.tmp': No such file or directory
> rm: cannot remove `.in.tmp': No such file or directory
> rm: cannot
states). But since wien2k is restricted to one local
basis for each atom, I can not increase anymore. As a result, WIEN2k gave me
FERMI - Error. The program stops at LAPW2, with uplapw2.error as
Error in LAPW2
'FERMI' - EFERMI OUT OF ENERGY RANGE
'FERMI' - STOP IN EFI
'FERMI' - ENERGY OF LOWER BOUND
And there is also a std.err file which gives a message as
LAPWSO END
LAPWSO END
LAPWSO END
LAPWSO END
LAPWSO END
LAPWSO END
LAPWSO END
LAPWSO END
cat: case.normsoup_21: No such file or directory
cat: case.normsodn_21: No such file or directory
FERMI - Error
Paresh Chandra Rout
Postdoctoral
**
Kind Regards
On Wed, Apr 16, 2014 at 1:21 AM, Gavin Abo gs...@crimson.ua.edu
mailto:gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI - Error'
in one of the *lapw2.error files
mailto:gs...@crimson.ua.edu
mailto:gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI
- Error'
in one of the *lapw2.error files:
http://www.mail-archive.com/__wien
...@crimson.ua.edu
mailto:gs...@crimson.ua.edu
mailto:gs...@crimson.ua.edu wrote:
There is usually a more detailed message for 'FERMI
- Error'
in one of the *lapw2.error files:
http://www.mail-archive.com
he optical and
doss properties from YS-PBE0?
Without -hf I got optical and DOSs without any error but when I use -hf with
lapw2 I am getting an error:
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
LEGAL END TETRA
LAPW1 END
LAPW1 END
LAPW1 END
FERMI - Error
OPTIC END
OPTIC END
OPTIC END
JOI
;
>On Friday 2018-02-16 14:31, chin Sabsu wrote:
>
>>Date: Fri, 16 Feb 2018 14:31:16
>>From: chin Sabsu <chinsa...@yahoo.in>
>>Reply-To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at>
>>To: A. Mailing List for WIEN2k Users <wien@zeus.theo
Fermi error
message when I work on the ground state calculation or fewer states occupied in
conduction bands. 3d-lo is not needed in the beginning. It is when I have more
states occupied in the conduction band range, where this error message appears.
Here is my
case.weightdn
1st k point
Respected Sir, As per Your suggestion I have done the single process with
one iteration successfully encountered no issue in all the nodes. However
in parallel running facing the same error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
the nodes.
However in parallel running facing the same error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
Parallel.scf1_1: No such file or directory.
bash: fixerror_lapw: command not found
ba
iteration successfully encountered no issue in all the nodes.
> > However in parallel running facing the same error
> >
> > grep: *scf1*: No such file or directory
> > cp: cannot stat '.in.tmp': No such file or directory
> > FERMI - Error
> > grep: *scf1
w2k_dispatch_signal(): received: Terminated
bi.scf1_1: No such file or directory.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp1': No such file or directory
ng particular errors. (
...
bash: lapw1: command not found
...
.
FERMI - Error
grep: *scf1dn*: No such file or directory
0.381u 0.507s 1:12.66 1.2%0+0k 128+1736io 1pf+0w
Test-TiC-VOl-parallel.scf1dn_1: No su
e. But if I run the same
calculation in parallel mode, the calculation is always aborted
at the lapw2 step, and I got the following error:
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp': No such file or directory
rm: cannot remove
gt;>
>> Dear Wien2k/Wienncm users and developers,
>>
>> I am learning to use wienncm to run some noncollinear-magnetism
>> calculations. I have compiled the code without any error report, and the
>> code runs well in serial mode. But if I run the same calculat
wing error
> stop error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
InBi.scf1_1: No such file or directory.
[1] + Done ( ( $remote $machine[$p] "cd
$PWD;$t $t
ual-machine_name.
#
1:vlsi1
1:vlsi2
1:vlsi3
1:vlsi4
granularity:1
extrafine:1
#
and getting the following error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
Parallel.scf1_1: No such file or
N2K/lapwsocpara /home/username/WIEN2K/lapwso_mpi
/home/username/WIEN2K/lapwsopara /home/username/WIEN2K/lapwsopara_lapw
However getting the same error
> stop error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep:
gt; > echo $WIENROOT
> > which lapw0
> > which lapw0_mpi
> >
> > The following paths were printed:
> >
> > /home/users/mollabashi/v19.2
> >
> > /home/users/mollabashi/v19.2/lapw0
> >
> > /home/users/mollabas
ot;cd
$PWD;$set_OMP_NUM_THREADS;$t $taskset0 $exe ${def}_$loop.def ;fixerror_lapw
${def}_$loop"; rm -f .lock_$lockfile[$p] ) >& .stdo
ut1_$loop; if ( -f .stdout1_$loop ) bashtime2csh.pl_lapw .stdout1_$loop >
.temp1_$loop; grep \% .temp1_$loop >> .time1_$loop; grep -v \% .tem
.
--
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp': No such file or directory
rm: cannot remove `.in.tmp1': No such file or directory
stop error
2. TiC.dayfile:
Calculating TiC in /home/yljia/wien2k
END
LAPW0 END
LAPW0 END
LAPW0 END
LAPW0 END
LAPW0 END
LAPW0 END
LAPW0 END
LAPW0 END
grep: .processes: No such file or directory
InPzb15InPwurt3-V2.scf1_1: No such file or directory.
grep: No match.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
stop error
-V2.scf1_1: No such file or directory.
grep: No match.
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
stop error
Final do job: Tue May 27 16:14:15 BRT 2014
-
OMP_NUM_THREADS = 12
loop"; rm
-f .lock_$lockfile[$p] ) >& .stdout1_$loop; if ( -f .stdout1_$loop )
bashtime2csh.pl_lapw .stdout1_$loop > .temp1_$loop; grep \% .temp1_$loop
>> .time1_$loop; grep -v \% .temp1_$loop | perl -e "print stderr " )
GaAs-Jan.scf1_1: No such file or directory.
0
compiled fftw with intel mpi and successfully compiled without any error.
After running a job in parallel scf GOT THE FOLLOWING ERROR
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
InBi.scf1_1
ame/WIEN2K/lapwsopara_lapw
However getting the same error
stop error
grep: *scf1*: No such file or directory
cp: cannot stat '.in.tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
Parallel.scf1_1: No such file or directory.
bash: fixerror_lap
tmp': No such file or directory
FERMI - Error
grep: *scf1*: No such file or directory
Parallel.scf1_1: No such file or directory.
bash: fixerror_lapw: command not found
bash: lapw1c: command not found
bash: fixerror_lapw: command not found
bash: lapw1c: command not found
bash: fixerror_lapw: command not found
b
labashi/v19.2
>
> /home/users/mollabashi/v19.2/lapw0
>
> /home/users/mollabashi/v19.2/lapw0_mpi
>
> But the error is still exists:
>
> bash: lapw0: command not found
>
> When I used your script in (faq page),
( ( $remote $machine[$p] "cd
$PWD;$set_OMP_NUM_THREADS;$t $taskset0 $exe ${def}_$loop.def
;fixerror_lapw ${def}_$loop"; rm -f .lock_$lockfile[$p] ) >& .stdo
ut1_$loop; if ( -f .stdout1_$loop ) bashtime2csh.pl_lapw
.stdout1_$loop > .temp1_$loop; grep \% .temp1_$loop
f}_$loop.def
;fixerror_lapw ${def}_$loop"; rm -f .lock_$lockfile[$p] ) >& .stdo
ut1_$loop; if ( -f .stdout1_$loop ) bashtime2csh.pl_lapw
.stdout1_$loop > .temp1_$loop; grep \% .temp1_$loop >> .time1_$loop;
grep -v \% .temp1_$loop | perl -e "print stderr " )
Dear Dr Peter
This is the error message
raja at ubuntu://home/raja/work/Cu$ x lapw2 -p
running LAPW2 in parallel mode
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
** LAPW2 crashed!
0.0u 0.0s 0:00.10 40.0% 0+0k 0+184io 0pf+0w
error: command /home/raja/wien2k/lapw2para
at ubuntu://home/raja/work/Cu$ x lapw2 -p
running LAPW2 in parallel mode
FERMI - Error
cp: cannot stat `.in.tmp': No such file or directory
** LAPW2 crashed!
0.0u 0.0s 0:00.10 40.0% 0+0k 0+184io 0pf+0w
error: command /home/raja/wien2k/lapw2para lapw2.def failed
raja at ubuntu://home/raja/work/Cu
are there eigenvalues printed ???
cat *.in2 how does this file look like ?
On 03/22/2013 08:43 AM, Mathrubutham Rajagopalan wrote:
Dear Dr Peter
This is the error message
raja at ubuntu://home/raja/work/Cu$ x lapw2 -p
running LAPW2 in parallel mode
FERMI - Error
cp: cannot stat `.in.tmp': No such file
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