Dears, I have problems in running transiesta where I find this sort of message:
Begin LEFT System Gamma: F Electrode Gamma: T ts_iohs: Non-TSgamma information not present ERROR STOP from Node: 0 BTW, the compilation of siesta itself seems to be working. I tried to find a suggestion on the archives but there was any. This error only occurs when I compiled transiesta in parallel using the flags (there are specifications set by the high performance computer center): .SUFFIXES: .SUFFIXES: .f .F .o .a .f90 .F90 SIESTA_ARCH=vuori-mpi-pgi FC=mpif90 FFLAGS=-fast FPPFLAGS= -DMPI -DFC_HAVE_ABORT -DCDF -DGRID_DP -DPHI_GRID_SP FFLAGS_DEBUG=-g -O0 In my own machine, I ran serial and it worked. I am trying to obtain the transmission of a simple carbon nanoribbon that I also attach the fdf file in this email. I am already thankful. best CGRocha
scat.fast.fdf
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elec.fast.fdf
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