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  1. Oct 12, 2017
  2. Sep 05, 2017
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  12. Sep 16, 2016
  13. Sep 14, 2016
    • Richard Berger's avatar
      Make thermo output accessable through PyLammps · 0ec8fa02
      Richard Berger authored
      Thermo data of the last run is now accessable through the `last_run.thermo`
      property. This is a dictionary containing the data columns of thermo output.
      All run data is kept as list and can be found in the `runs` property.
      See issue #144
      0ec8fa02
    • Richard Berger's avatar
      Allow writing input script from Python session · 6e3705f3
      Richard Berger authored
      This implements the requested feature in issue #145. The `write_script`
      method now gives you a way of dumping out all used commands into a
      LAMMPS input script file.
      
      Note: this also dumps all commands which are indirectly issued by PyLammps
      6e3705f3
  14. Sep 01, 2016
  15. Aug 31, 2016
  16. Aug 30, 2016
  17. Aug 24, 2016
    • Richard Berger's avatar
      Implemented optional C++ exceptions in Error class · e5c37bc7
      Richard Berger authored
      These can be activated using the -DLAMMPS_EXCEPTIONS compiler flag.
      It has no effect for regular execution. However, while using
      it as a library, any issued command will capture the exception
      and save its error message. This can be queried using the
      lammps_has_error() and lammps_get_last_error_message() methods.
      
      The Python wrapper checks these in order to rethrow these errors
      as Python exceptions. See issue #146.
      
      (cherry picked from commit 6c154bb0b67a13d38968bc42d31013b97f87db75)
      e5c37bc7
  18. Jul 22, 2016
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