eDFTpy
======

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      eDFTpy combines Kohn-Sham Density Functional Theory (KS-DFT) and orbital-free DFT (OF-DFT) in an embedding framework that distills the best of both worlds whereby only weak intermolecular interactions are left to OF-DFT, and strong intramolecular interactions 
      are left to KS-DFT. The code achieves near ideal linear-scaling with system size. eDFTpy is based on `DFTpy <http://dftpy.rutgers.edu/>`_ which is developed by `PRG <https://sites.rutgers.edu/prg>`_ at Rutgers University-Newark.

      .. button-link:: https://github.com/Quantum-MultiScale/eDFTpy
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         GITHUB REPO

      .. button-link:: https://edftpy.rutgers.edu/
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         edftpy.rutgers.edu

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.. _edftpy-developers:

eDFTpy developers
-----------------
Feel free to contact the developers:
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^

- `Xuecheng Shao <https://sites.rutgers.edu/prg/people/xuecheng-shao/>`_
- `Michele Pavanello <https://sasn.rutgers.edu/about-us/faculty-staff/michele-pavanello>`_

On-line
-------
To find out more about the `Pavanello Research Group <http://sites.rutgers.edu/prg>`_. Or simply send us an email.

.. _edftpy-learn:

Learn about it
--------------

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   Official site: `https://edftpy.rutgers.edu/contact.html <https://edftpy.rutgers.edu/contact.html>`_ 


YouTube videos
--------------

`eDFTpy Youtube playlist <https://www.youtube.com/playlist?list=PLDgw3fS4ncAGkutxhtfiPmZUI1ttMlR4T>`_

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