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Pseudopotentials
Posted: Fri Aug 05, 2022 5:22 pm
by kazeej
Hi
Does VASP accept Ultrasoft pseudopotentials?
Re: Pseudopotentials
Posted: Fri Aug 12, 2022 3:04 pm
by alexey.tal
Hi,
Technically one can download and use the ultrasoft pseudopotentials from the
VASP user portal. However, the support of these US-PP potential in the code is very limited and they can only be used with great caution. Furthermore, the PAW potentials are far superior and should be preferred (see
wiki).