Yambo built was fine but it gives error when running

Having trouble compiling the Yambo source? Using an unusual architecture? Problems with the "configure" script? This is the place to look.

Moderators: Daniele Varsano, andrea.ferretti, andrea marini, Conor Hogan, myrta gruning

Forum rules
If you have trouble compiling Yambo, please make sure to list:
(1) the compiler (vendor and release: e.g. intel 10.1)
(2) the architecture (e.g. 64-bit IBM SP5)
(3) if the problems occur compiling in serial/in parallel
(4) the version of Yambo (revision number/major release version)
(5) the relevant compiler error message

Re: Yambo built was fine but it gives error when running

Postby amirmehdi89 » Thu Apr 19, 2018 3:36 pm

This cluster that I'm going to compile yambo on has its own hdf5 and netcdf modules (and so many other modules). Which other modules should I be concerned to load to compile?
Amir M. Mofrad
University of Missouri-Columbia
Chemical Engineering Department
Posts: 12
Joined: Wed Apr 04, 2018 12:15 am

Re: Yambo built was fine but it gives error when running

Postby Daniele Varsano » Mon Apr 23, 2018 5:21 pm

Dear Amir,
In order to avoid possible mismatch with the compiled library you can avoid to specify the path of the libraries. Yambo will download and compile the needed libraries. I think this is the safer solution to arrive to a working compilation. Next you can try to compile against the libraries present in your cluster.
Of course you will need to load the compilers module and mpi environment if needed.
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
User avatar
Daniele Varsano
Posts: 2052
Joined: Tue Mar 17, 2009 2:23 pm


Return to Compilation

Who is online

Users browsing this forum: No registered users and 1 guest