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Pseudopotentials for Copper

  1. BP MT NLCC

    Usage: LMAX=D LOC=S SKIP=P ECUT=70 Ry

    Author: Ballone 
  2. BLYP MT NLCC

    Usage: NLCC LMAX=D LOC=S ECUT=70 Ry

    References: [34]
    Author: Boero-Massobrio 

  3. PW91 MT NLCC

    Usage: NLCC LMAX=D LOC=S ECUT=70 Ry

    Author: Boero-Oda
  4. OLYP MT NLCC

    Usage: NLCC LMAX=D LOC=S ECUT=70 Ry

    Author: Boero 
  5. LDA MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Kohlmeyer
  6. PW91 MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Kohlmeyer
  7. BP MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Kohlmeyer
  8. PBE MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Kohlmeyer
  9. PBE MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry
    References: [51]
    Author: MPI-Polymerforschung

  10. revPBE MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Kohlmeyer
  11. BLYP MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    References: [43]
    Author: Kohlmeyer

  12. HCTH MT SEMI

    Usage: LMAX=D LOC=S ECUT=80 Ry

    References: [43]
    Author: Kohlmeyer 

  13. PBE GO

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Goedecker-Rousseau
  14. BLYP GO

    Usage: LMAX=D LOC=S ECUT=80 Ry

    Author: Goedecker-Rousseau
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