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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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Ma,  Duancheng
Theory and Simulation, 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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Citation

Elstnerová, P., Friák, M., Hickel, T., Fabritius, H.-O., Ma, D., Raabe, D., et al. (2012). On the Role of Mg Atoms in Calcite Crystals: An Ab Initio Study. Talk presented at EURO Bio-inspired Materials, International School and Conference on Biological Materials Science. Potsdam, Germany. 2012-03-20 - 2012-03-23.


Cite as: http://hdl.handle.net/11858/00-001M-0000-0027-BD3A-0
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