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100 1 _ |a Küpers, Michael
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245 _ _ |a Controlled Crystal Growth of Indium Selenide, In 2 Se 3 , and the Crystal Structures of α-In 2 Se 3
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520 _ _ |a In2Se3 has been known for over 100 years and recently attracted interest as a promising candidate for a variety of applications, such as solar cells, photodiodes, and phase-change memories. Despite the broad concern for possible uses, its polymorphism and structure are poorly characterized. By combining X-ray diffraction, transmission electron microscopy, and quantum-chemical calculations, we present here the crystal structures of two layered room-temperature polytypes: 3R and 2H In2Se3. Both polymorphs are stacking variants of the same Se–In–Se–In–Se layers comprising two coordination environments for the In atoms, one tetrahedral and one octahedral. By using chemical-bonding analysis, we look at the different In positions in α-In2Se3 and compare them to those in the metastable β-phase.
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536 _ _ |a Quantum chemistry of functional chalcogenide for phase-change memories and other applications (jara0033_20171101)
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700 1 _ |a Konze, Philipp M.
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700 1 _ |a Meledin, Alexander
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700 1 _ |a Mayer, Joachim
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700 1 _ |a Englert, Ulli
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700 1 _ |a Wuttig, Matthias
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700 1 _ |a Dronskowski, Richard
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773 _ _ |a 10.1021/acs.inorgchem.8b01950
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