[Pw_forum] hse performance

[kazempoor at ph.iut.ac.ir]

Dear All 
I am working with the hybrid functional specially HSE which is 
implemented in espresso . As many researches show, the band gap is 
well reproduced by HSE for many semiconductors in good agreement with 
experimental gap. But as I know the overall electronic structure 
behavior like the coupling between localized and itinerant and the 
band ordering remain unclear. Can anyone introduce me suitable papers 
which compare the band structure of solids obtained by HSE and the 
results of experiments like ARPES and so one. 

With the Bests 


Ali Kazempour 
Physics Department, Isfahn University of Technology 

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