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Dear Hung,
<div class="">Thanks for the information, that’s really nice news.</div>
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<div class="">We’ve updated the list of codes on the webpage <a href="http://www.wannier.org/download/" class="">http://www.wannier.org/download/</a></div>
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<div class="">Best,</div>
<div class="">Giovanni</div>
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-- <br class="">
Giovanni Pizzi<br class="">
Theory and Simulation of Materials and MARVEL, EPFL<br class="">
<a href="http://people.epfl.ch/giovanni.pizzi" class="">http://people.epfl.ch/giovanni.pizzi</a><br class="">
http://nccr-marvel.ch/en/people/profile/giovanni-pizzi</div>
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<div class="">On 1 Apr 2019, at 08:43, Hung Pham <<a href="mailto:phamx494@umn.edu" class="">phamx494@umn.edu</a>> wrote:</div>
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<div dir="ltr" class="">Dear Wannier90 users and developers,
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<div class="">I would like to share with you my Wannier90 interface, namely pyWannier90, for PySCF (released as a part of PySCF 1.5 and newer). PySCF is an open-source electronic structure package with many functions and utilities for both molecular and periodic
systems (HF, DFT, post-HF for both molecules and solids, hybrid Gaussian/Planewave, etc). Now one can construct MLWFs from a DFT/HF calculation by PySCF via the pyWannier90 interface. More functions of pyWannier90 is being developed.</div>
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<div class="">I just stopped the wannier90 website and feel like wannier90 users should be aware of the interface for PySCF too besides other electronic structure codes. It would be nice if this info can be updated on the website.</div>
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<div class="">Here is the repositories for the codes mentioned:</div>
<div class="">pyWannier90: <a href="https://github.com/hungpham2017/pyWannier90" class="">https://github.com/hungpham2017/pyWannier90</a></div>
<div class="">PySCF: <a href="https://github.com/pyscf/pyscf" class="">https://github.com/pyscf/pyscf</a></div>
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<div class="">Thank you very much for your attention.</div>
<div class="">Best regards,</div>
<div class="">Hung</div>
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<div class="">Hung Q. Pham</div>
<div class="">Gagliardi Group</div>
<div class="">Office: Smith 101</div>
<div class="">Email: <a href="mailto:phamx494@umn.edu" target="_blank" class="">phamx494@umn.edu</a></div>
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<div dir="ltr" class=""><span style="font-size:12.8px" class="">Department of Chemistry</span><br class="">
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<div dir="ltr" class=""><span style="font-size:12.8000001907349px" class="">University of Minnesota - Twin Cities, </span><span style="font-size:12.8px" class="">Minneapolis, MN 55455</span></div>
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