In Siesta 4.1 you can do projected transmissions, please see the tbtrans manual in section 4.6.2 (Projected transmissions).
Den fre. 21. feb. 2020 kl. 22.07 skrev Jingxian Yu < jingxian...@adelaide.edu.au>: > Dear colleagues, > > I have computed transmission coefficients for the junction device, however my > reviewer suggested to project the transmission function onto an eigenstate, > for example the HOMO state. > > I note that Drs Guangping Zhang and Carlo Motta posted similar questions here > more than 8 years ago. The only answer to these was contributed by Dr > Gabriele Penazzi, saying that there was no easy and quick way in Siesta. > > I believe such calculations are quite common and routine. Would you like to > share how you do this in Siesta, if you have figured out a way? Or if you > don’t do this in Siesta, would you please recommend the programs you use? > > Your suggestion will be sincerely appreciated. Best regards > > Jin > > > -- > SIESTA is supported by the Spanish Research Agency (AEI) and by the > European H2020 MaX Centre of Excellence (http://www.max-centre.eu/) > -- Kind regards Nick
-- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)
