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                                  Pynta

             An automated workflow for reaction path exploration on
                            metallic surfaces

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    Copyright 2021 National Technology & Engineering Solutions of Sandia,
    LLC (NTESS). Under the terms of Contract DE-NA0003525 with NTESS, the
    U.S. Government retains certain rights in this software.

    Authors:
        Maciej Gierada @mgierada,
        Eric D. Hermes @ehermes,
        David H. Bross @dbross

    This program is free software: you can redistribute it and/or modify
    it under the terms of the GNU General Public License as published by
    the Free Software Foundation, either version 3 of the License, or
    (at your option) any later version.

    This program is distributed in the hope that it will be useful,
    but WITHOUT ANY WARRANTY; without even the implied warranty of
    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
    GNU General Public License for more details.

    You should have received a copy of the GNU General Public License
    along with this program.  If not, see <https://www.gnu.org/licenses/>.

    This code implements modified version of the 3rd party software Catkit.
    All modification were made based on the version as avaiable on Apr 18, 2020
    (master branch; git hash d5aa508eefcbeb3065b4ece0740d695e0787a0b7).
    
    All Catkit's code integrated into Pynta is located here:
    
    /Users/mgierad/00_SANDIA_WORK/05_rmgcat_to_stella/pynta/excatkit
    
    For a Catkit's source code, check
    <https://github.com/SUNCAT-Center/CatKit>

    For a Catkit's documentations, check
    <https://catkit.readthedocs.io/en/latest/>

    If you have questions, feel free to contact.
    email: maciek.gierada@gmail.com
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