Enhancing mechanical properties of calcite by Mg substitutions: A 
quantum-mechanical study

Elstnerová, P.; Friák, M.; Fabritius, H. O.; Hickel, T.; Lymperakis, L.; Petrov, M.; Nikolov, S.; Hild, S.; Ziegler, A.; Neugebauer, J.

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Enhancing mechanical properties of calcite by Mg substitutions: A quantum-mechanical study

Elstnerová, P., Friák, M., Fabritius, H. O., Hickel, T., Lymperakis, L., Petrov, M., et al. (2010). Enhancing mechanical properties of calcite by Mg substitutions: A quantum-mechanical study. Talk presented at Multiscale design modeling 2010. Brno, Czech Republic. 2010-12-02.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-0019-3551-B Version Permalink: https://hdl.handle.net/11858/00-001M-0000-0019-3553-7

Genre: Talk

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Creators:
Elstnerová, P.¹, Author
Friák, M.¹, Author
Fabritius, H. O.², Author
Hickel, T.³, Author
Lymperakis, L.⁴, Author
Petrov, M.¹, Author
Nikolov, S.⁵, Author
Hild, S.⁵, Author
Ziegler, A., Author
Neugebauer, J.⁶, Author

Affiliations:
1Ab Initio Thermodynamics, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863338
2Biological Composites, Microstructure Physics and Alloy Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863385
3Computational Phase Studies, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863341
4Microstructure, Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863344
5External Organizations, ou_persistent22
6Computational Materials Design, Max-Planck-Institut für Eisenforschung GmbH, Max Planck Society, ou_1863337

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Language(s): eng - English

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Identifiers: eDoc: 528619

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Title: Multiscale design modeling 2010

Place of Event: Brno, Czech Republic

Start-/End Date: 2010-12-02

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