[SIESTA-L] Transiesta error: No electrode found in compilation of .fdf file for scattering region

 I am using siesta version (siesta-4.1-b2) for running transport calculations using TranSIESTA. I ran ../Examples/TranSiesta/Elec using transiesta and it worked fine. Then, I copied *.TSHS file in the directory ../Examples/TranSiesta/Scat. But the compilation of Run.fdf in

Re: [SIESTA-L] Fragmented Core Charges

Have you tried with the larger mesh-cutoff? The one you have attached in the forum have a smaller mesh than the one you supply here. 2017-01-12 15:46 GMT+01:00 Seyed Mohammad Tabatabaei : > Can this core charge fragmentation issue be attributed to some parts of > the SIESTA