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Mg2MnGa3 – An orthorhombically distorted superstructure variant of the hexagonal Laves phase MgZn2

  • Nazar Pavlyuk , Ihor Chumak , Volodymyr Pavlyuk , Helmut Ehrenberg , Sylvio Indris , Viktor Hlukhyy and Rainer Pöttgen EMAIL logo
Published/Copyright: August 29, 2022
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Abstract

The Laves phase Mg2MnGa3 was synthesized from the elements by arc-melting and subsequent annealing in a silica ampoule at T = 670 K. The structure of Mg2MnGa3 was refined from single-crystal X-ray diffractometer data: URe2 type, Cmcm, a = 543.24(1), b = 869.59(3), c = 858.58(2) pm, wR2 = 0.0556, 273 F 2 values and 24 variables. The manganese and gallium atoms form a three-dimensional network of corner- and face-sharing MnGa3 tetrahedra that derive as a ternary ordering variant from the hexagonal Laves phase MgZn2. The structures of the distortion and coloring variants, i.e., MgZn2, URe2, Mg2Cu3Si and Mg2MnGa3 are discussed on the basis of a Bärnighausen tree. The electronic structure calculation data indicate that in addition to the metallic type of bonding an additional covalent interaction appears between the Ga–Ga and Mn–Ga atoms.


Corresponding author: Rainer Pöttgen, Institut für Anorganische und Analytische Chemie, Universität Münster, Corrensstrasse 30, 48149 Münster, Germany, E-mail:

Acknowledgements

We thank Dipl.-Ing. U. Ch. Rodewald for the intensity data collection.

  1. Author contributions: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.

  2. Research funding: None declared.

  3. Conflict of interest statement: The authors declare no conflicts of interest regarding this article.

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Received: 2022-07-18
Accepted: 2022-08-02
Published Online: 2022-08-29
Published in Print: 2022-10-26

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