Author Topic: Grain Boundary Scattering doping problem  (Read 7538 times)

0 Members and 1 Guest are viewing this topic.

Offline Anders Blom

  • QuantumATK Staff
  • Supreme QuantumATK Wizard
  • *****
  • Posts: 5583
  • Country: dk
  • Reputation: 100
    • View Profile
    • QuantumATK at Synopsys
Re: Grain Boundary Scattering doping problem
« Reply #15 on: October 17, 2024, 08:23 »
The total energy is only used to compute the formation energy of the grain boundary. If you don't need that, you can of course skip it.

Not sure why the Sigma3 gives a finite transmission, but as you noted, it will generally not be the case.