Hi everyone, I seem to have a very strange problem with parallel SIESTA. The make goes okay, but the program does not read the input .fdf file. In fact, all it does is output the out.fdf file that says:
fdf-debug 0 # Default value SystemName # Default value SystemLabel siesta # Default value WriteXML T # Default value alloc_report_level 0 # Default value xc.functional LDA # Default value xc.authors PZ # Default value user-basis F # Default value user-basis-netcdf F # Default value PAO.BasisSize standard # Default value PAO.BasisType split # Default value Number_of_species 0 # Default value So it's all default values, which means that the input file has been completely ignored. Have any of you had the same problem? Could there be some important details that I missed during the compilation? The system is an Itanium2 cluster, and the serial version of SIESTA works on it with no problems at all. Thanks everyone!
