Dear Wien2k experts, Greetings from my side,
Kindly help in my problem related to PDOS. Please see the attachment.
It is clear from the DOS figure that the N-total and Lu total do not add up
to the Lu-N total as they should. Instead it looks like the LuN is about 2x
higher than the Lu total +
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*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office)
FAX : +91-751-2442784
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the DOS of same we found DOS energy range
from -14 to 3 eV only. I am not getting dos above 3 eV. (In Band Structure
it shows bands are present upto 10 eV).
Kindly comment on my issue. I am waiting for your reply.
With Kind Regards and Thanks,
Sanjay.
*DO HELP WHO NEED HELP*
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*SANJAY KUMAR
Respected Prof. P Blaha Sir and All wien2k users,
Kindly give comment on my issues related to RMTs.
when I am trying to find out smallest RMTs for compound then I found RMT
of heavier atom is less then the lighter atom (Is it right or wrong). Can
we take same RMTs for both atoms. Kindly suggest
,
*DO HELP WHO NEED HELP*
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*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office)
FAX : +91-751-2442784
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in NaCl
phase of binary compound.Please comment on my issue.
Thanks and regards,
Sanjay
*DO HELP WHO NEED HELP*
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*
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office
some time for this. I am waiting for your reply.
Regards,
Sanjay
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*DO HELP WHO NEED HELP*
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*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office)
FAX : +91-751
Respected Prof. P. Blaha Sir and All wien2k users,
Wish you all a very happy new year 2013.
,
Sanjay
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*DO HELP WHO NEED HELP*
*
*
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office)
FAX : +91-751-2442784
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NEED HELP*
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*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781, (Office)
FAX : +91-751-2442784
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in case.intrans file can any one give detail
description. Which data should we take from case.intrans first iteration
data or last iteration.
Please help regarding this. I will be very grateful to you all.
Regards,
Sanjay
*DO HELP WHO NEED HELP*
*
*
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES
are not
equal. I am waiting for your kind response. I will be very grateful to
you.
Regards,
Sanjay
*DO HELP WHO NEED HELP*
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY, GWALIOR - 474 011
MADHYA PRADESH, INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781
to say one thing to all
wien2k users DO HELP WHO NEED HELP in any field not only in research.
Once again thank you so much to all wien2k users.
With kind Regards and Thanks,
*
*DO HELP WHO NEED HELP
*
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*SANJAY KUMAR SINGH *
SCHOOL OF STUDIES
: /opt/intel/composerxe-2011.3.174/mkl/lib/intel64: No such file: File
format not recognized
make[1]: *** [aimc] Error 1
make[1]: Leaving directory `/home/sanjay/WIEN2K/SRC_aim'
make: *** [complex] Error 2
Regards,
--
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
to give correct settings in .bashrc and settings in
compilations.
I am waiting for your kind response.
I will be very grateful to you all.
With Regards,
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR - 474 011 (M.P.),INDIA
Mobile : +91-9229979962
PHONE : +91-751
of ubuntu, IFC, MKL and
wien2k would be better.
Please give any information regarding this.
I shall always remain very grateful to you all.
With Regards,
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR - 474 011 (M.P.),INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781
Respected Gavin Abo,
Thank you so much for your kind and quick reply.
I am trying the same.
Regards
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR - 474 011 (M.P.),INDIA
Mobile : +91-9229979962
PHONE : +91-751-2442781 (Office)
FAX : +91-751-2442784
Respected Prof. R K Thapa Sir,
Greetings for new year and warm wishes on makar sakranti.
Sir, I will certainly inform you when I will get success in installing
Wien2k on UBUNTU 10.04 LTS 64 bit.
With Regards,
*SANJAY KUMAR SINGH*
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR - 474 011
object file: No such file or
directory
stop error
With regards
*SANJAY KUMAR SINGH*
JRF (DST), NEW DELHI
CONDENSED MATTER THEORY GROUP
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR - 474 011 (M.P.), INDIA
Mobile : +91-9200679799
PHONE : +91-751-2442777 (Office)
FAX : +91-751
Respected Sir,
I did ignoring pairHess error but. In next step there are error in
case.outputd. Again I proceed ignoring error.
In next step same error are occurred. in last when i run SCF the error
message is there is no case.ouputd file foe next step.
Sir, Please help me.
*SANJAY KUMAR SINGH
spin.
Can anyone help me, I will be very grateful to you all.
With kind regards and Thanks,
*SANJAY KUMAR SINGH*
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calculation of two different
compound on two different port then can it effect each other. Sir, I will be
very grateful to you
With kind Regards
And Thanks
SANJAY KUMAR SINGH
RESEARCH SCHOLAR
INDIA
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Respected Prof. P. Blaha Sir All Wien2k users,
I am facing some minor problem when I calculating elastic moduli.
The first problem is that bulk modulus is not coming as calculated in
volume optimization.
Sir may I request you to kindly give me any idea to get the approximate
value.How can I
SRC_structeditor/compile.msg:make[1]: *** [ncmsymmetry] Error 1
SRC_structeditor/compile.msg:make: *** [all] Error 2
SRC_structeditor/SRC_ncmsymmetry/compile.msg:make: *** [ncmsymmetry] Error 1
With Kind Regards
Thanks
--
SANJAY KUMAR SINGH
RESEARCH SCHOLAR
CONDENSED MATTER THEORY GROUP
SCHOOL
,
--
SANJAY KUMAR SINGH
RESEARCH SCHOLAR
CONDENSED MATTER THEORY GROUP
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR -474011 (M.P) INDIA
PHONE :0091-751-2442777 (OFFICE)
FAX :0091-751-2442784.
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is attached with this mail. I will be
grateful to you for sparing your valuable time for me.
looking forward to your answer very eagerly.
With kind Regards and thanks
--
SANJAY KUMAR SINGH
RESEARCH SCHOLAR
CONDENSED MATTER THEORY GROUP
SCHOOL OF STUDIES IN PHYSICS
JIWAJI UNIVERSITY
GWALIOR
.
Sir, I am not able to find the solution for the above problem.
Sir, may I requester you to kindly help me to get the X-ray spectra.I
will be grateful to you for sparing your valuable time for me.
looking forward to your answer very eagerly.
With kind Regards and thanks
SANJAY KUMAR SINGH
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