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Pseudopotential File

Test files

C.blyp-mt.UPF
 
Pseudopotential type: NORMCONS
Method: Martins-Troullier
Functional type: Becke-Lee-Yang-Parr (BLYP) exch-corr 
scalar relativistic

Origin: Original QE PP library 
Author: P. Giannozzi  ,
Generated by ld1 code (trou)
More Information: C.blyp-mt.txt
Uploaded by Erica Vidal
Classification controlled by Paolo Giannozzi
    C.blyp-van_ak.UPF
     
    Pseudopotential type: ULTRASOFT
    Method: Vanderbilt ultrasoft
    Functional type: Becke-Lee-Yang-Parr (BLYP) exch-corr 
    scalar relativistic
    
    Origin: Original QE PP library 
    Generated by Vanderbilt code version 7.3.4
    More Information: C.blyp-van_ak.txt
    Uploaded by Erica Vidal
    Classification controlled by Paolo Giannozzi
      C.bp-van_ak.UPF
       
      Pseudopotential type: ULTRASOFT
      Method: Vanderbilt ultrasoft
      Functional type: BP
      scalar relativistic
      
      Origin: Original QE PP library 
      Generated by Vanderbilt code version 7.3.4
      More Information: C.bp-van_ak.txt
      Uploaded by Erica Vidal
      Classification controlled by Paolo Giannozzi
        C.pbe-mt_gipaw.UPF
         
        Pseudopotential type: NORMCONS
        Method: Martins-Troullier
        Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
        Is Gipaw
        scalar relativistic
        
        Origin: Original QE PP library 
        Author: Matteo Calandra
        Generated by "atomic" code by A. Dal Corso (QE distribution)
        More Information: C.pbe-mt_gipaw.txt
        Uploaded by Erica Vidal
        Classification controlled by Paolo Giannozzi
          C.pbe-rrkjus.UPF
           
          Pseudopotential type: ULTRASOFT
          Method: Rappe Rabe Kaxiras Joannopoulos
          Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
          scalar relativistic
          
          Origin: Original QE PP library 
          Author: Andrea Dal Corso
          Generated by Andrea Dal Corso code (rrkj3)
          Uploaded by Erica Vidal
          Classification controlled by Paolo Giannozzi
          C.pbe-van_ak.UPF
           
          Pseudopotential type: ULTRASOFT
          Method: Vanderbilt ultrasoft
          Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
          scalar relativistic
          
          Origin: Original QE PP library 
          Generated by Vanderbilt code version 7.3.4
          More Information: C.pbe-van_ak.txt
          Uploaded by Erica Vidal
          Classification controlled by Paolo Giannozzi
            C.pbe-van_bm.UPF
             
            Pseudopotential type: ULTRASOFT
            Method: Vanderbilt ultrasoft
            Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
            scalar relativistic
            
            Origin: Original QE PP library 
            Author: Bernd Meyer
            Generated by Vanderbilt code version 7.3.4
            More Information: C.pbe-van_bm.txt
            Uploaded by Erica Vidal
            Classification controlled by Paolo Giannozzi
              C.pw91-van_ak.UPF
               
              Pseudopotential type: ULTRASOFT
              Method: Vanderbilt ultrasoft
              Functional type: Perdew-Wang 91 gradient-corrected functional 
              scalar relativistic
              
              Origin: Original QE PP library 
              Generated by Vanderbilt code version 7.3.4
              More Information: C.pw91-van_ak.txt
              Uploaded by Erica Vidal
              Classification controlled by Paolo Giannozzi
                C.pz-kjpaw.UPF
                 
                Pseudopotential type: PAW
                Method: Projector Augmented-Wave (Kresse-Joubert paper)
                Functional type: Perdew-Zunger (LDA) exch-corr
                scalar relativistic
                
                Origin: Original QE PP library 
                Author: "Lorenzo Paulatto" /paulatto@sissa.it/
                Generated by "atomic" code by A. Dal Corso (QE distribution)
                Uploaded by Erica Vidal
                Classification controlled by Paolo Giannozzi
                  C.pz-rrkjus.UPF
                   
                  Pseudopotential type: ULTRASOFT
                  Method: Rappe Rabe Kaxiras Joannopoulos
                  Functional type: Perdew-Zunger (LDA) exch-corr
                  scalar relativistic
                  
                  Origin: Original QE PP library 
                  Author: Andrea Dal Corso
                  Generated by Andrea Dal Corso code (rrkj3)
                  Uploaded by Erica Vidal
                  Classification controlled by Paolo Giannozzi
                  C.pz-van_ak.UPF
                   
                  Pseudopotential type: ULTRASOFT
                  Method: Vanderbilt ultrasoft
                  Functional type: Perdew-Zunger (LDA) exch-corr
                  scalar relativistic
                  
                  Origin: Original QE PP library 
                  Generated by Vanderbilt code version 7.3.4
                  More Information: C.pz-van_ak.txt
                  Uploaded by Erica Vidal
                  Classification controlled by Paolo Giannozzi
                    C.pz-vbc.UPF
                     
                    Pseudopotential type: NORMCONS
                    Method: Von Barth-Car (direct fit)
                    Functional type: Perdew-Zunger (LDA) exch-corr
                    scalar relativistic
                    
                    Origin: Original QE PP library 
                    Author: P. Giannozzi
                    Generated by ld1 code
                    More Information: C.pz-vbc.txt
                    Uploaded by Erica Vidal
                    Classification controlled by Paolo Giannozzi
                      C.rel-pz-rrkjus.UPF
                       
                      Pseudopotential type: ULTRASOFT
                      Method: Rappe Rabe Kaxiras Joannopoulos
                      Functional type: Perdew-Zunger (LDA) exch-corr
                      scalar relativistic
                      
                      Origin: Original QE PP library 
                      Generated by "atomic" code by A. Dal Corso (QE distribution)
                      Uploaded by Erica Vidal
                      Classification controlled by Paolo Giannozzi
                        C.star1s-blyp-mt.UPF
                         
                        Pseudopotential type: NORMCONS
                        Method: Martins-Troullier
                        Functional type: Becke-Lee-Yang-Parr (BLYP) exch-corr 
                        scalar relativistic
                        
                        Origin: Original QE PP library 
                        Author: G. Mattioli
                        Generated by "atomic" code by A. Dal Corso (QE distribution)
                        Uploaded by Erica Vidal
                        Classification controlled by Paolo Giannozzi
                          C.star1s-pbe-mt_gipaw.UPF
                           
                          Pseudopotential type: NORMCONS
                          Method: Martins-Troullier
                          Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
                          Is Gipaw
                          scalar relativistic
                          
                          Origin: Original QE PP library 
                          Generated by "atomic" code by A. Dal Corso (QE distribution)
                          More Information: C.star1s-pbe-mt_gipaw.txt
                          Uploaded by Erica Vidal
                          Classification controlled by Paolo Giannozzi
                            C.star1s-pbe-rrkjus.UPF
                             
                            Pseudopotential type: ULTRASOFT
                            Method: Rappe Rabe Kaxiras Joannopoulos
                            Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
                            scalar relativistic
                            
                            Origin: Original QE PP library 
                            Author: Paolo Giannozzi
                            Generated by "atomic" code by A. Dal Corso (QE distribution)
                            Uploaded by Erica Vidal
                            Classification controlled by Paolo Giannozzi
                              C.tpss-mt.UPF
                               
                              Pseudopotential type: NORMCONS
                              Method: Martins-Troullier
                              Functional type: Tao-Perdew-Staroverov-Scuseria (TPSS) meta-GGA
                              scalar relativistic
                              
                              Origin: Original QE PP library 
                              Author: Xiaofei Wang/Carlo Sbraccia
                              Generated by modified version of ld1 code for metaGGA
                              Uploaded by Erica Vidal
                              Classification controlled by Paolo Giannozzi