help: two questions to Mr.Matthias Krack and Mr Jeremy Rabone

mohamed khuili khuili... at gmail.com
Fri Apr 11 14:11:49 CEST 2014


Dear Mr Matthias Krack, and Mr Jeremy Rabone
I read your article several times, "A procedure for bypassing metastable 
states in local BASIS DFT + U calculations set and Its Application to 
uranium dioxide surfaces" 
I study a zinc oxide and I ask you to explain to me two things: 
-F-occupation smearing and U-ramping (FOUR): (how to do the same)
- How to access this link from your arcicle "people.web.psi.ch / krack / 
potentials.html" 
My greetings
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