Hi
During calculation of band gap (DOS) of a semiconductor i am not getting correct value of band gap using HSE06 functional with screeing parameter 0.2.
Is it correct to use different screening parameter as for example 1.0 or 1.5 for HSE06 calculation to get the correct band gap?
Regards
K Srinivasu
HSE06 exchange screening parameter
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srinubarc
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HSE06 exchange screening parameter
Last edited by srinubarc on Wed May 15, 2013 6:30 am, edited 1 time in total.
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support_vasp
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Re: HSE06 exchange screening parameter
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