[Pw_forum] how to choose ecutwfc
stefano de gironcoli
degironc at sissa.it
Sun Jun 11 11:39:21 CEST 2017
hello Ali Mehdizadeh,
please sign with your affiliation.
converged values for ecutwfc and ecutrho do not depend on the
particle size.
they depend on the psudopotential used.
stefano
---
Stefano de Gironcoli - SISSA and DEMOCRITOS - Trieste
On 11/06/2017 11:18, ali mehdizadeh wrote:
> hello
> ecutwfc are dependent to the particle size for example the
> difference between quantum dots 3 nm and bulk or ecutwfc just
> dependent to pseudopotentials .
> thanks
>
>
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