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Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron

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Janßen,  Jan
Computational Phase Studies, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Hickel,  Tilmann
Computational Phase Studies, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Neugebauer,  Jörg
Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Janßen, J., Hickel, T., & Neugebauer, J. (2020). Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron. Talk presented at NIST Workshop, virtual. Rockville, MD, USA. 2020-08-06.


Cite as: http://hdl.handle.net/21.11116/0000-0009-1691-A
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