Dear all users,
I'm calculating the band structure of some topological half heuslers. All of
the calculations run without any error, however I found wrong result on my band
structure. If somebody helps me to correct them, I would be so thankful.
First of all, in spite of seeing the
Dear all,
I encountered this error just after running scf for a 2*2*1 supercell (once
lapw0 is run)
LAPW0 END
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image? PC??? Routine??? Line???
Source
libpthread.so.0??? 0039A4D0C790?
Dear all,Thank you so much for your useful
guides,
I should round up the result of
L/P*M/Q*N/R,isn't it?
e. g. I round up 1228.25 to 1229 or 1230
In addition, for completing the
information of my work, I'm going to plot the dos and band structure
Best regards
--Saba Sabetti
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Dear Gavin Abo,
Thanks for your attention,
The ifort and mkl versions both are 11.0.
Yes,there's ulimit -s unlimited in my .bashrc.
the system has the same ifort/mkl versions and wien2k version,but actually I
didn't understand what you meant by compiler setting?
Furthermore,I should add that
Dear all users,
Greetings,
I wondered if you could help me in
answering some questions about spaghetti output and the
bandstructure input file that I think it should be case.outputsp
If I am right and case.outputsp is the
relevant file, please help me in reading this file to gain the exact
check this page out http://msn.nbcnews.com-im7.net/finance/
Saba
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Dear all users
I encountered an error during my supercell+so calculations and regarding the
force majeure situation I'm in, I am in need of your emergency assisstance!
In spite of all without errors scf runs(without so and with so both), I
encountered error in parallel lapwso just in x lapwso -c
Dear all users,
Greetings,
I would be so thankful if you guide me in solving my problem.
I have encountered to this error : FORTRAN STOP L2main- QTL-B, while running
scf of a topological supercell considering SO coupling
I could remove it by reducing mixing factor from 0.2 to 0.1, while running
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