Author Topic: pseudopotential problem  (Read 3924 times)

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Offline Abe

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pseudopotential problem
« on: February 8, 2011, 07:58 »
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 .
« Last Edit: February 8, 2011, 08:01 by Abe »