« previous next »
Pages: [1]   Go Down

Author Topic: DFT+U and vDW  (Read 3740 times)

0 Members and 1 Guest are viewing this topic.

Offline Roc

  • QuantumATK Guru
  • ****
  • Posts: 104
  • Reputation: 0
    • View Profile
DFT+U and vDW
« on: August 25, 2018, 06:17 »
Dear Sir,

I want to use  the Hubbard U and DFT-D2  to do a test. However, I can not use the two parameters at the same time (VNL version 2017.2).   What is the matter?    How to solve it? 

Thank you so much.
Logged

Offline Petr Khomyakov

  • QuantumATK Staff
  • Supreme QuantumATK Wizard
  • *****
  • Posts: 1290
  • Country: dk
  • Reputation: 25
    • View Profile
Re: DFT+U and vDW
« Reply #1 on: August 30, 2018, 09:30 »
It means that it is not implemented.
Logged
Pages: [1]   Go Up
« previous next »