Pseudo search results

Pseudopotential File

Test files

Ga.blyp-d-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  
    Ga.pbe-d-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  
      Ga.pbe-d-mt_fhi.UPF
       
      Pseudopotential type: NORMCONS
      Method: Martins-Troullier
      Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
      Semi-core state in valence
      non relativistic
      
      Origin: FHI PP from Abinit web site 
      Author: unknown  
        Generated using FHI98PP- converted with fhi2upf.x v.5.0.2
      Input File: Ga.pbe-d-mt_fhi.txt
      Uploaded by Layla Martin-Samos
      Classification unverified  
        Ga.pbe-dn-kjpaw_psl.0.2.UPF
         
        Pseudopotential type: PAW
        Method: Projector Augmented-Wave (Kresse-Joubert paper)
        Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
        Semi-core state in valence
        Nonlinear core correction
        scalar relativistic
        
        Origin: PS Library
        Author: Andrea Dal Corso
        Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
        Uploaded by Erica Vidal
        Classification controlled by Andrea Dal Corso
          Ga.pbe-dn-rrkjus_psl.0.2.UPF
           
          Pseudopotential type: ULTRASOFT
          Method: Rappe Rabe Kaxiras Joannopoulos
          Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
          Semi-core state in valence
          Nonlinear core correction
          scalar relativistic
          
          Origin: PS Library
          Author: Andrea Dal Corso
          Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
          Uploaded by Erica Vidal
          Classification controlled by Andrea Dal Corso
            Ga.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 
            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  
              Ga.pbe-mt_fhi.UPF
               
              Pseudopotential type: NORMCONS
              Method: Martins-Troullier
              Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
              non relativistic
              
              Origin: FHI PP from Abinit web site 
              Author: unknown  
                Generated using FHI98PP- converted with fhi2upf.x v.5.0.2
              Input File: Ga.pbe-mt_fhi.txt
              Uploaded by Layla Martin-Samos
              Classification unverified  
                Ga.pbe-n-van.UPF
                 
                Pseudopotential type: ULTRASOFT
                Method: Vanderbilt ultrasoft
                Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
                Nonlinear core correction
                scalar relativistic
                
                Origin: Original QE PP library 
                Generated by Vanderbilt code version 7.3.5
                More Information: Ga.pbe-n-van.txt
                Uploaded by Erica Vidal
                Classification controlled by Paolo Giannozzi
                  Ga.pbesol-dn-kjpaw_psl.0.2.UPF
                   
                  Pseudopotential type: PAW
                  Method: Projector Augmented-Wave (Kresse-Joubert paper)
                  Functional type: PBESOL
                  Semi-core state in valence
                  Nonlinear core correction
                  scalar relativistic
                  
                  Origin: PS Library
                  Author: Andrea Dal Corso
                  Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                  Uploaded by Erica Vidal
                  Classification controlled by Andrea Dal Corso
                    Ga.pbesol-dn-rrkjus_psl.0.2.UPF
                     
                    Pseudopotential type: ULTRASOFT
                    Method: Rappe Rabe Kaxiras Joannopoulos
                    Functional type: PBESOL
                    Semi-core state in valence
                    Nonlinear core correction
                    scalar relativistic
                    
                    Origin: PS Library
                    Author: Andrea Dal Corso
                    Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                    Uploaded by Erica Vidal
                    Classification controlled by Andrea Dal Corso
                      Ga.pw-d-mt_fhi.UPF
                       
                      Pseudopotential type: NORMCONS
                      Method: Martins-Troullier
                      Functional type: Perdew-Wang LDA
                      Semi-core state in valence
                      non relativistic
                      
                      Origin: FHI PP from Abinit web site 
                      Author: unknown  
                        Generated using FHI98PP- converted with fhi2upf.x v.5.0.1
                      Input File: Ga.pw-d-mt_fhi.txt
                      Uploaded by Layla Martin-Samos
                      Classification unverified  
                        Ga.pw-mt_fhi.UPF
                         
                        Pseudopotential type: NORMCONS
                        Method: Martins-Troullier
                        Functional type: Perdew-Wang LDA
                        non relativistic
                        
                        Origin: FHI PP from Abinit web site 
                        Author: unknown  
                          Generated using FHI98PP- converted with fhi2upf.x v.5.0.1
                        Input File: Ga.pw-mt_fhi.txt
                        Uploaded by Layla Martin-Samos
                        Classification unverified  
                          Ga.pw91-n-van.UPF
                           
                          Pseudopotential type: ULTRASOFT
                          Method: Vanderbilt ultrasoft
                          Functional type: Perdew-Wang 91 gradient-corrected functional 
                          Nonlinear core correction
                          scalar relativistic
                          
                          Origin: Original QE PP library 
                          Generated by Vanderbilt code version 7.3.5
                          More Information: Ga.pw91-n-van.txt
                          Uploaded by Erica Vidal
                          Classification controlled by Paolo Giannozzi
                            Ga.pz-bhs.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: X. Gonze et al
                            Generated by 
                            More Information: Ga.pz-bhs.txt
                            Uploaded by Erica Vidal
                            Classification controlled by Paolo Giannozzi
                              Ga.pz-d-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  
                                Ga.pz-dn-kjpaw_psl.0.2.UPF
                                 
                                Pseudopotential type: PAW
                                Method: Projector Augmented-Wave (Kresse-Joubert paper)
                                Functional type: Perdew-Zunger (LDA) exch-corr
                                Semi-core state in valence
                                Nonlinear core correction
                                scalar relativistic
                                
                                Origin: PS Library
                                Author: Andrea Dal Corso
                                Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                Uploaded by Erica Vidal
                                Classification controlled by Andrea Dal Corso
                                  Ga.pz-dn-rrkjus_psl.0.2.UPF
                                   
                                  Pseudopotential type: ULTRASOFT
                                  Method: Rappe Rabe Kaxiras Joannopoulos
                                  Functional type: Perdew-Zunger (LDA) exch-corr
                                  Semi-core state in valence
                                  Nonlinear core correction
                                  scalar relativistic
                                  
                                  Origin: PS Library
                                  Author: Andrea Dal Corso
                                  Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                  Uploaded by Erica Vidal
                                  Classification controlled by Andrea Dal Corso
                                    Ga.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  
                                      Ga.rel-pbe-dn-kjpaw_psl.0.2.UPF
                                       
                                      Pseudopotential type: PAW
                                      Method: Projector Augmented-Wave (Kresse-Joubert paper)
                                      Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
                                      Semi-core state in valence
                                      Nonlinear core correction
                                      full relativistic
                                      
                                      Origin: PS Library
                                      Author: Andrea Dal Corso
                                      Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                      Uploaded by Erica Vidal
                                      Classification controlled by Andrea Dal Corso
                                        Ga.rel-pbe-dn-rrkjus_psl.0.2.UPF
                                         
                                        Pseudopotential type: ULTRASOFT
                                        Method: Rappe Rabe Kaxiras Joannopoulos
                                        Functional type: Perdew-Burke-Ernzerhof (PBE) exch-corr
                                        Semi-core state in valence
                                        Nonlinear core correction
                                        full relativistic
                                        
                                        Origin: PS Library
                                        Author: Andrea Dal Corso
                                        Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                        Uploaded by Erica Vidal
                                        Classification controlled by Andrea Dal Corso
                                          Ga.rel-pbesol-dn-kjpaw_psl.0.2.UPF
                                           
                                          Pseudopotential type: PAW
                                          Method: Projector Augmented-Wave (Kresse-Joubert paper)
                                          Functional type: PBESOL
                                          Semi-core state in valence
                                          Nonlinear core correction
                                          full relativistic
                                          
                                          Origin: PS Library
                                          Author: Andrea Dal Corso
                                          Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                          Uploaded by Erica Vidal
                                          Classification controlled by Andrea Dal Corso
                                            Ga.rel-pbesol-dn-rrkjus_psl.0.2.UPF
                                             
                                            Pseudopotential type: ULTRASOFT
                                            Method: Rappe Rabe Kaxiras Joannopoulos
                                            Functional type: PBESOL
                                            Semi-core state in valence
                                            Nonlinear core correction
                                            full relativistic
                                            
                                            Origin: PS Library
                                            Author: Andrea Dal Corso
                                            Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                            Uploaded by Erica Vidal
                                            Classification controlled by Andrea Dal Corso
                                              Ga.rel-pz-dn-kjpaw_psl.0.2.UPF
                                               
                                              Pseudopotential type: PAW
                                              Method: Projector Augmented-Wave (Kresse-Joubert paper)
                                              Functional type: Perdew-Zunger (LDA) exch-corr
                                              Semi-core state in valence
                                              Nonlinear core correction
                                              full relativistic
                                              
                                              Origin: PS Library
                                              Author: Andrea Dal Corso
                                              Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                              Uploaded by Erica Vidal
                                              Classification controlled by Andrea Dal Corso
                                                Ga.rel-pz-dn-rrkjus_psl.0.2.UPF
                                                 
                                                Pseudopotential type: ULTRASOFT
                                                Method: Rappe Rabe Kaxiras Joannopoulos
                                                Functional type: Perdew-Zunger (LDA) exch-corr
                                                Semi-core state in valence
                                                Nonlinear core correction
                                                full relativistic
                                                
                                                Origin: PS Library
                                                Author: Andrea Dal Corso
                                                Generated using atomic code by A. Dal Corso  v.5.0.2 svn rev. 9415
                                                Uploaded by Erica Vidal
                                                Classification controlled by Andrea Dal Corso