Personal tools
You are here: Home Downloadable Files No Authentication Pseudo-Potentials Selenium
Log in


Forgot your password?
 

Pseudopotentials for Selenium

  1. LDA SGS

    Usage: LMAX=D LOC=D ECUT=20 Ry

    References: [29]
  2. PW CVB

    Usage: LMAX=D LOC=D ECUT=20 Ry

    References: [44]
    Author: Pasquarello-DalCorso 

  3. LDA MT

    Usage: LMAX=D LOC=D ECUT=20 Ry

    Author: Boero
  4. PBE MT

    Usage: LMAX=D LOC=D ECUT=20 Ry

    Author: Boero-Bouzid 
  5. BLYP MT

    Usage: LMAX=D LOC=D ECUT=20 Ry

    Author: Boero
  6. BLYP MT

    Usage: LMAX=P LOC=P ECUT=20 Ry

    References: [49]
    Author: Vuillumier-Massobrio 

  7. HCTH MT

    Usage: LMAX=D LOC=D ECUT=20 Ry

    Author: Boero
  8. PBE GO

    Usage: LMAX=D LOC=D ECUT=20 Ry

    Author: Goedecker
                          Document Actions
                          « March 2017 »
                          March
                          MoTuWeThFrSaSu
                          12345
                          6789101112
                          13141516171819
                          20212223242526
                          2728293031