Author Topic: Local density of states for a metal-organic interface  (Read 5550 times)

0 Members and 1 Guest are viewing this topic.

Offline kstokbro

  • Supreme QuantumATK Wizard
  • *****
  • Posts: 392
  • Reputation: 13
    • View Profile
    • QuantumWise
Local density of states for a metal-organic interface
« on: February 1, 2013, 13:23 »
I am currently studying a metal-organic interface between Au(111) and a pentacene crystal. The plots below show the electronic structure at the interface. The LDOS  shows the DOS as function of z in the energy range [-2,2] eV. You can clearly see the 5 gold layers, and the 4 molecular states of the pentacene layers. Note the band bending in the pentacene crystal.
« Last Edit: February 1, 2013, 20:56 by kstokbro »

Offline marmotte

  • Heavy QuantumATK user
  • ***
  • Posts: 63
  • Country: sa
  • Reputation: 0
    • View Profile
Re: Local density of states for a metal-organic interface
« Reply #1 on: February 10, 2013, 12:10 »
Dear Kurt, Is it possible to have an iron instead of metal ? I'm looking for understanding the  magnetic-organic interface for spintronic application.