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Pseudopotential File

Test files

Mg.blyp-hgh.UPF
 
Pseudopotential type: NORMCONS
Method: Goedecker-Hartwigsen-Hutter-Teter 
Functional type: Becke-Lee-Yang-Parr (BLYP) exch-corr 
non relativistic

Origin: Hartwigsen-Goedeker-Hutter PP 
Author: Goedecker/Hartwigsen/Hutter/Teter
Generated in analytical, separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
Uploaded by marsamos
Classification unverified  
    Mg.blyp-sp-hgh.UPF
     
    Pseudopotential type: NORMCONS
    Method: Goedecker-Hartwigsen-Hutter-Teter 
    Functional type: Becke-Lee-Yang-Parr (BLYP) exch-corr 
    Semi-core state in valence
    non relativistic
    
    Origin: Hartwigsen-Goedeker-Hutter PP 
    Author: Goedecker/Hartwigsen/Hutter/Teter
    Generated in analytical, separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
    Uploaded by marsamos
    Classification unverified  
      Mg.pbe-hgh.UPF
       
      Pseudopotential type: NORMCONS
      Method: Goedecker-Hartwigsen-Hutter-Teter 
      Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
      scalar relativistic
      
      Origin: Hartwigsen-Goedeker-Hutter PP 
      Generated in analytical separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
      Uploaded by qewpadmin
      Classification unverified  
        Mg.pbe-sp-hgh.UPF
         
        Pseudopotential type: NORMCONS
        Method: Goedecker-Hartwigsen-Hutter-Teter 
        Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
        Semi-core state in valence
        scalar relativistic
        
        Origin: Hartwigsen-Goedeker-Hutter PP 
        Author: Goedecker/Hartwigsen/Hutter/Teter
        Generated in analytical separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
        Uploaded by qewpadmin
        Classification unverified  
          Mg.pz-hgh.UPF
           
          Pseudopotential type: NORMCONS
          Method: Goedecker-Hartwigsen-Hutter-Teter 
          Functional type: Perdew-Zunger (LDA) exch-corr
          non relativistic
          
          Origin: Hartwigsen-Goedeker-Hutter PP 
          Author: Goedecker/Hartwigsen/Hutter/Teter
          Generated in analytical, separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
          Uploaded by marsamos
          Classification unverified  
            Mg.pz-sp-hgh.UPF
             
            Pseudopotential type: NORMCONS
            Method: Goedecker-Hartwigsen-Hutter-Teter 
            Functional type: Perdew-Zunger (LDA) exch-corr
            Semi-core state in valence
            non relativistic
            
            Origin: Hartwigsen-Goedeker-Hutter PP 
            Author: Goedecker/Hartwigsen/Hutter/Teter
            Generated in analytical, separable form. Converted from CPMD format using cpmd2upf v.5.0.1.
            Uploaded by marsamos
            Classification unverified