Yambo Community Forum

Hi,

i'm bulding yambo-3.2.3-rev.11/etsf_io-1.0.3 on CentOS 5 with:
1) gfortran43
2) x86_64, Intel Nehalem
First, the --with-etsf=<path> configure flag is not flexible enough;
i need to patch the configure with:
sed -i "s<with_etsf/lib/libetsf_io<with_etsf/lib64/libetsf_io<g" config/configure.ac
sed -i "s<with_etsf/include/intel<with_etsf/include<g" config/configure.ac
but still there is an error:
>>>[Linking e2y]<<<
make[1]: Entering directory `/scratch/rpmbuild/yambo-3.2.3-rev.11/interfaces/e2y'
etsf_data.F e2y_i.F e2y_db1.f90:380.17:

default_Tel = temperature_ ! type conversion
1
Error: Symbol 'default_tel' at (1) has no IMPLICIT type
make[1]: *** [e2y_db1.o] Error 1
make[1]: Leaving directory `/scratch/rpmbuild/yambo-3.2.3-rev.11/interfaces/e2y'
make: *** [interfaces] Error 2

Best regards,

Marcin

Hi Marcin,
As you can guess, the e2y interface has not been used so much, so a few bugs have crept in during development.
In the next repository release these issues will be fixed.
In the meantime you can just replace "default_Tel" with "input_GS_Tel" on line 444 of interfaces/e2y/e2y_db1.F.

Thanks for your interest in e2y...can I ask why you are using it?
Regards
Conor

Hi,

thanks, after the change it compiles.
We are trying to generate etsf files using our code https://wiki.fysik.dtu.dk/gpaw and pass them to yambo.

Marcin

Hi Marcin! We have also another member of the board (Thomas Olsen) that already contacted us to interface yambo with GPAW. We have opened a dedicated section of the forum for this purpose. I invite you to write any GPAW specific question there so that we can all help you. Nice to have you on-board!

The sub-forum is here. I will shortly give you access to it.

Andrea

P.S.: Please edit your signature with your full name and affiliation. It is a simple rule we kindly ask to all members. THX.

Just in case someone else browses this forum: I have fixed the bug in e2y_db1.F and also changed configure to accept --with-etsf-io-lib and --with-etsf-io-include flags. The changes will appear in the next commit to the repository.