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pseudopotential problem

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Abe:
sir,
     while executing the program i got the pseudopotential error.i try to reproduce one paper result they are using Ultrasoft pseudopotential.The pseudo was generated with Non-Relativistic Calculation.But in the case of ATK Norm-conserving pseudopotential was used.That pseudopotential was generated using Scalar-Relativistic Calculation.Could you tell me the difference between these two method .

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