Greetings experts, I am working on a transition metal oxide nanosheet stacked with graphene.
It is a periodic slab structure in X and Y. I wish to know the quantities like conductivity or related charge transport properties. Can TranSIESTA be used for this purpose? I have never used TranSIESTA or any other NEGF softwares before. My structure include several corrections including Hubbard U, van der waals and dipole correction. Can someone guide me how to proceed with TranSIESTA? Thank you in advance for your help. Regards Yuvam Bhateja
-- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)