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Reliability evaluation of thermophysical properties from first-principles calculations

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Körmann,  Fritz
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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Palumbo, M., Fries, S. G., Corso, A. D., Körmann, F., Hickel, T., & Neugebauer, J. (2014). Reliability evaluation of thermophysical properties from first-principles calculations. Journal of Physics: Condensed Matter, 26(33): 335401. doi:10.1088/0953-8984/26/33/335401.


Cite as: http://hdl.handle.net/11858/00-001M-0000-0024-A6C1-9
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