Page 1 of 1

can DFT + U support with recent version of EPW(5.5) in the context of calculating mobility

Posted: Wed Aug 03, 2022 9:32 am
by souravrudra
Hello developers,
I want to know whether the recent version of EPW ( Version 5.5 within QE v 7.1 ) can support DFT + U in the context of calculation of mobility.

Thanks with regards
Sourav Rudra
PhD student
JNCASR, Bengaluru India

Re: can DFT + U support with recent version of EPW(5.5) in the context of calculating mobility

Posted: Wed Aug 03, 2022 1:32 pm
by hpaudya1
Hi Sourav,

EPW does not support the calculations with DFT + U.

Best,
Hari

Re: can DFT + U support with recent version of EPW(5.5) in the context of calculating mobility

Posted: Wed Aug 03, 2022 6:50 pm
by souravrudra
Thank you for the information.
Thanks with regards
Sourav Rudra
PhD student
JNCASR, Bengaluru, India