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The Mean Inner Potential of Hematite α-Fe2O3 Across the Morin Transition.

作者信息

Auslender Avi, Basha Adham, Grave Daniel A, Rothschild Avner, Diéguez Oswaldo, Kohn Amit

机构信息

Department of Materials Science and Engineering, The Iby and Aladar Fleischman Faculty of Engineering, Tel Aviv University, Ramat Aviv, Tel Aviv 6997801, Israel.

The Raymond and Beverly Sackler Center for Computational Molecular and Materials Science, Tel Aviv University, Ramat Aviv, Tel Aviv 6997801, Israel.

出版信息

Microsc Microanal. 2023 Jun 9;29(3):919-930. doi: 10.1093/micmic/ozad047.

DOI:10.1093/micmic/ozad047
PMID:37749692
Abstract

We measure the mean inner potential (MIP) of hematite, α-Fe2O3, using electron holography and transmission electron microscopy. Since the MIP is sensitive to valence electrons, we propose its use as a chemical bonding parameter for solids. Hematite can test the sensitivity of the MIP as a bonding parameter because of the Morin magnetic phase transition. Across this transition temperature, no change in the corundum crystal structure can be distinguished, while a change in hybridized Fe-3d and O-2p states was reported, affecting ionic bonding. For a given crystallographic phase, the change in the MIP with temperature is expected to be minor due to thermal expansion. Indeed, we measure the temperature dependence in corundum α-Al2O3(112¯0) between 95 and 295 K showing a constant MIP value of ∼16.8 V within the measurement accuracy of 0.45 V. Thus, our objectives are as follows: measure the MIP of hematite as a function of temperature and examine the sensitivity of the MIP as a bonding parameter for crystals. Measured MIPs of α-Fe2O3(112¯0) above the Morin transition are equal, 17.85 ± 0.50 V, 17.93 ± 0.50 V, at 295 K, 230 K, respectively. Below the Morin transition, at 95 K, a significant reduction of ∼1.3 V is measured to 16.56 ± 0.46 V. We show that this reduction follows charge redistribution resulting in increased ionic bonding.

摘要

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