QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: Abe on February 8, 2011, 05:55

Title: pseudopotential
Post by: Abe on February 8, 2011, 05:55

sir,
    while executing the program(GNR) i got pseudopotential error.could you give the information about pseudopotential of carbon in ATK,VASP.

Title: Re: pseudopotential
Post by: Anders Blom on February 8, 2011, 09:54

If you get a pseudopotential error in ATK, for carbon, you must be using some very specific parameters. Please attach the input script.