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Pseudopotentials for Aluminium

  1. LDA SGS

    Usage: LMAX=P LOC=S ECUT=60 Ry

  2. BLYP MT

    Usage: LMAX=D LOC=S ECUT=60 Ry

    References: [59]
    Author: Giannozzi 

  3. BLYP MT NLCC

    Usage: NLCC LMAX=D LOC=S ECUT=60 Ry

    References: [59]
    Author: Giannozzi 

  4. PW91 MT

    Usage: LMAX=P LOC=S ECUT=80 Ry 

    References: [36]
    Author: Brazdova 

  5. GGA MT

    Usage: LMAX=P LOC=S ECUT=80 Ry

    Author: Boero 

  6. HCTH MT

    Usage: LMAX=P LOC=S ECUT=80 Ry

    Author: Boero 

  7. XLYP MT

    Usage: LMAX=P LOC=S ECUT=80 Ry

    Author: Boero

  8. PBE MT

    Usage: LMAX=P LOC=S ECUT=80 Ry

    Author: Seitsonen

  9. revPBE MT

    Usage: LMAX=D LOC=D ECUT=80 Ry

    References: [5]
    Author: Boero-Ikeda 

  10. LDA GO

    Usage: LMAX=P LOC=P ECUT=80 Ry

    References: [6]
    Author: Goedecker 

  11. BLYP GO

    Usage: LMAX=P LOC=P ECUT=80 Ry

    References: [6]
    Author: Goedecker 

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