Siesterers,

I'm running simulations using pseudopotentials generated using PBEsol
scheme, generated by the version of ATOM that comes bundled with
SIESTA 3.0 b.

Using this version of siesta, I noticed in the .OUT file:

xc_check: Exchange-correlation functional:
xc_check: GGA Perdew, Burke & Ernzerhof 1996
xc_check: WARNING: Pseudopotential generated with GGA PBEsol functional

Is this telling me that 3.0 b can work with PBEsol?

With thanks

Ian Shuttleworth

Responder a