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version 2.1.22 with TB09

Elk Users
2013-07-05
2013-09-01
  • Dear All,

    I just report that the example Si-meta-GGA in Elk 2.1.22 linked with libxc 2.0.1 does not converge.

    Regards,
    Vladimir.

     
  • Hi Vladimir,

    Thanks for the report.

    The problem was fixed in version 2.1.25.

    Cheers,
    Kay.

     
  • Hi Kay,

    Thank you very much: It really works in version 2.1.25.

    Cheers,
    Vladimir.