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On the role of Mg atoms in calcite crystals: An ab initio study

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Elstnerová,  Pavlína
Ab Initio Thermodynamics, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Friák,  Martin
Ab Initio Thermodynamics, 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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Fabritius,  Helge-Otto
Biological Composites, Microstructure Physics and Alloy Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society;

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Raabe,  Dierk
Microstructure Physics and Alloy 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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Elstnerová, P., Friák, M., Hickel, T., Fabritius, H.-O., Raabe, D., Ziegler, A. S., et al. (2012). On the role of Mg atoms in calcite crystals: An ab initio study. Talk presented at DPG Frühjahrstagung. Berlin, Germany. 2012-03-26 - 2012-03-30.


Cite as: https://hdl.handle.net/11858/00-001M-0000-0027-BD37-5
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