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QE Maillist
QE Maillist
6:30 AM
users: [QE-users] problem in parallel exexution of example07 of HP
posted on May 19, 2023

2023/05/19 -- Mpayami via users

 
 
5 hours later…
EspressoFinder
EspressoFinder
11:01 AM
0
Q: Modelling 2D semiconductor heterostructures including one magnetic layer with QE

franzI want to compute the electronic structure of a heterostructure composed of two 2D monolayers. I am stacking a TMD monolayer on top of a magnetic 2D monolayer. Both of them are semiconductors. Do I need to include smearing when I compute the electronic structure or not?

quantum-espresso electronic-structure magnetism 2d-lattice heterostructures
 
 
3 hours later…
QE Maillist
QE Maillist
2:30 PM
users: [QE-users] QE 6.5 versus QE 7.2
posted on May 19, 2023

2023/05/19 -- Giovanni Cantele

 
QE Maillist
QE Maillist
2:55 PM
users: Re: [QE-users] QE 6.5 versus QE 7.2
posted on May 19, 2023

2023/05/19 -- Paolo Giannozzi

 

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