Author Topic: dos  (Read 2612 times)

0 Members and 1 Guest are viewing this topic.

Offline dwh

  • Heavy QuantumATK user
  • ***
  • Posts: 30
  • Country: cn
  • Reputation: 0
    • View Profile
dos
« on: December 14, 2012, 06:12 »
Hello everyone ,how can I plot the Gaussian and tetrahedron spectrum within pylab for specific atoms of the periodic bulk systems? In other words, I want to get very smooth curve of PDOS for periodic bulk systems?

Offline Nordland

  • QuantumATK Staff
  • Supreme QuantumATK Wizard
  • *****
  • Posts: 812
  • Reputation: 18
    • View Profile
Re: dos
« Reply #1 on: December 14, 2012, 10:02 »
Use more k-points or more broadings.