Dear Alejandro,
attached the r_setup file.
martin
ndb.elph_gkkp database error
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Re: ndb.elph_gkkp database error
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Martin Spenke, PhD Student
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany
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Re: ndb.elph_gkkp database error
Dear Martin,
yes, you can do in two ways. Either you put s.db files at the setup or you put them later. I have checked the setup and they seems very similar... Maybe is the yambo version. Can you install the latest yambo stable version?
Alejandro.
yes, you can do in two ways. Either you put s.db files at the setup or you put them later. I have checked the setup and they seems very similar... Maybe is the yambo version. Can you install the latest yambo stable version?
Alejandro.
Alejandro Molina-Sánchez
Institute of Materials Science (ICMUV)
University of Valencia, Spain
Institute of Materials Science (ICMUV)
University of Valencia, Spain
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Re: ndb.elph_gkkp database error
Dear Alejandro,
Last night i also checked it with yambo 3.4.2 rev.5108, but got exactly the same error.
Any way yambo 3.4.2 is for me out, because it is coupled to netcdf library imposing some hard limits on the generated files (but this is another issue i raised in my other posts).
Regarding basis vectors in dyn files, it seems to be a problem of the new QE version, as in QE_5.3.0 i did not need to edit those lines and was able to successfully proceed further.
Martin
Last night i also checked it with yambo 3.4.2 rev.5108, but got exactly the same error.
Any way yambo 3.4.2 is for me out, because it is coupled to netcdf library imposing some hard limits on the generated files (but this is another issue i raised in my other posts).
Regarding basis vectors in dyn files, it seems to be a problem of the new QE version, as in QE_5.3.0 i did not need to edit those lines and was able to successfully proceed further.
Martin
Martin Spenke, PhD Student
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany
-
- Posts: 149
- Joined: Tue Apr 08, 2014 6:05 am
Re: ndb.elph_gkkp database error
Dear Alejandro,
I solved the problem by simply switching from O3 to O2 optimization while compiling the code,
and was able to successfully generate the gkkp databases.
Many thanks for your kind helps.
Best wishes
Martin
I solved the problem by simply switching from O3 to O2 optimization while compiling the code,
and was able to successfully generate the gkkp databases.
Many thanks for your kind helps.
Best wishes
Martin
Martin Spenke, PhD Student
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany
Theoretisch-Physikalisches Institut
Universität Hamburg, Germany