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Pseudopotential File

Test files

 
Pseudopotential type: PAW
Method: Projector Augmented-Wave (original Bloechl recipe)
Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
Semi-core state in valence
Nonlinear core correction
scalar relativistic

Origin: Original QE PP library 
Generated by 
More Information: Mg.pbe-nsp-bpaw.txt
Uploaded by Erica Vidal
Classification controlled by Paolo Giannozzi

• Mg.pbe-nsp-bpaw.pdf

 
Pseudopotential type: ULTRASOFT
Method: Vanderbilt ultrasoft
Functional type: Perdew-Wang 91 gradient-corrected functional 
Semi-core state in valence
Nonlinear core correction
scalar relativistic

Origin: Original QE PP library 
Generated by Vanderbilt code version 7.0.0
More Information: Mg.pw91-np-van.txt
Uploaded by Erica Vidal
Classification controlled by Paolo Giannozzi

 
Pseudopotential type: NORMCONS
Method: Bachelet-Hamann-Schlueter and derived
Functional type: Perdew-Zunger (LDA) exch-corr
scalar relativistic

Origin: Original QE PP library 
Author: BHS
Generated by BHS code
Uploaded by Erica Vidal
Classification controlled by Paolo Giannozzi

 
Pseudopotential type: NORMCONS
Method: Von Barth-Car (direct fit)
Functional type: Perdew-Zunger (LDA) exch-corr
Nonlinear core correction
scalar relativistic

Origin: Original QE PP library 
Author: Stefano de Gironcoli
Generated by ld1 code
More Information: Mg.pz-n-vbc.txt
Uploaded by Erica Vidal
Classification controlled by Paolo Giannozzi