QuantumATK Forum
Welcome,
Guest
. Please
login
or
register
.
Did you miss your
activation email
?
1 Hour
1 Day
1 Week
1 Month
Forever
Login with username, password and session length
News:
QuantumATK W-2024.09 version released on Sep 9, 2024
Home
Help
Search
Login
Register
QuantumATK Forum
»
QuantumATK
»
General Questions and Answers
»
SGGA+U and Van der Waals correction
« previous
next »
Print
Pages: [
1
]
Go Down
Author
Topic: SGGA+U and Van der Waals correction (Read 3265 times)
0 Members and 1 Guest are viewing this topic.
fly
Regular QuantumATK user
Posts: 20
Reputation: 0
SGGA+U and Van der Waals correction
«
on:
September 26, 2018, 12:47 »
Hi
I'm working on the band structures of bilayer CrI3 using QuantumATK 2016. After I Choose SGGA+U, why is Van der Waals
correction automatically closed? Can SGGA+U and Van der Waals correction be set at the same time?
Logged
Ulrik G. Vej-Hansen
QuantumATK Staff
Supreme QuantumATK Wizard
Posts: 426
Country:
Reputation: 8
Re: SGGA+U and Van der Waals correction
«
Reply #1 on:
September 26, 2018, 21:52 »
No, that combination is currently not implemented in QuantumATK.
Logged
Print
Pages: [
1
]
Go Up
« previous
next »
QuantumATK Forum
»
QuantumATK
»
General Questions and Answers
»
SGGA+U and Van der Waals correction