Dear Users,
some of you may have experienced few problems running TranSiesta calculation on FERMI with the siesta package.
A new module is now avaible for siesta/transiesta, you can load it with the command:
module load siesta/3.1-TS
(module help siesta/3.1-TS for a job script example)
We strongly recommend you to use this module for TranSiesta calculations.
The previous module, siesta/3,1, is still available for standard siesta calculation, ù
but we removed the bugged transiesta executable.
Best Regards,
HPC-CINECA user support
.