Pseudo search results

Pseudopotential File

Test files

Mo.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: Mo.pbe-mt_fhi.txt
Uploaded by Layla Martin-Samos
Classification unverified  
    Mo.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  
      Mo.pbe-spn-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
        Mo.pbe-spn-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
          Mo.pbesol-spn-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
            Mo.pbesol-spn-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
              Mo.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: Mo.pw-mt_fhi.txt
              Uploaded by Layla Martin-Samos
              Classification unverified  
                Mo.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 7.0.0
                More Information: Mo.pw91-n-van.txt
                Uploaded by Erica Vidal
                Classification controlled by Paolo Giannozzi
                  Mo.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  
                    Mo.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  
                      Mo.pz-spn-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
                        Mo.pz-spn-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
                          Mo.rel-pbe-spn-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
                            Mo.rel-pbe-spn-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
                              Mo.rel-pbesol-spn-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
                                Mo.rel-pbesol-spn-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
                                  Mo.rel-pz-spn-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
                                    Mo.rel-pz-spn-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