Matching different symmetries with an atomically sharp interface: Epitaxial Ba2SiO4 on Si(001)

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Original languageEnglish
Article number013401
JournalPhysical Review Materials
Volume4
Issue number1
Publication statusPublished - 9 Jan 2020

Abstract

In this paper, we present a comprehensive investigation of the epitaxial growth of Ba2SiO4 on Si(001), a system in which neither crystal symmetry nor lattice constants match in a simple manner. In addition, it has the potential to become the first crystalline high-k gate dielectric. We combined x-ray photoelectron spectroscopy, low-energy electron diffraction, and aberration-corrected scanning transmission electron microscopy (STEM) in order to optimize the epitaxial growth by molecular beam epitaxy. Our focus was on the formation of a high quality crystalline interface. The films were grown by a co-deposition method that requires no diffusion of Si from the substrate. An annealing temperature of 400°C turned out to be sufficient to form chemically homogeneous films. However, crystalline films require an annealing step to 670-690°C for the formation of the epitaxial interface necessary for breaking Si-O bonds. STEM confirms that the interface is atomically sharp and that a single layer of the silicate is changed to a (2×3) structure at the interface from the (2×1.5) bulk structure. Based on our experimental results, we propose a geometrical model for the epitaxial interface. The growth of films with an understoichiometric Si flux leads to the formation of a near-surface Ba silicide that does not restrict the epitaxial silicate growth.

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Matching different symmetries with an atomically sharp interface: Epitaxial Ba2SiO4 on Si(001). / Koch, Julian; Müller-Caspary, Knut; Pfnür, Herbert.
In: Physical Review Materials, Vol. 4, No. 1, 013401, 09.01.2020.

Research output: Contribution to journalArticleResearchpeer review

Koch J, Müller-Caspary K, Pfnür H. Matching different symmetries with an atomically sharp interface: Epitaxial Ba2SiO4 on Si(001). Physical Review Materials. 2020 Jan 9;4(1):013401. doi: 10.1103/PhysRevMaterials.4.013401
Koch, Julian ; Müller-Caspary, Knut ; Pfnür, Herbert. / Matching different symmetries with an atomically sharp interface : Epitaxial Ba2SiO4 on Si(001). In: Physical Review Materials. 2020 ; Vol. 4, No. 1.
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abstract = "In this paper, we present a comprehensive investigation of the epitaxial growth of Ba2SiO4 on Si(001), a system in which neither crystal symmetry nor lattice constants match in a simple manner. In addition, it has the potential to become the first crystalline high-k gate dielectric. We combined x-ray photoelectron spectroscopy, low-energy electron diffraction, and aberration-corrected scanning transmission electron microscopy (STEM) in order to optimize the epitaxial growth by molecular beam epitaxy. Our focus was on the formation of a high quality crystalline interface. The films were grown by a co-deposition method that requires no diffusion of Si from the substrate. An annealing temperature of 400°C turned out to be sufficient to form chemically homogeneous films. However, crystalline films require an annealing step to 670-690°C for the formation of the epitaxial interface necessary for breaking Si-O bonds. STEM confirms that the interface is atomically sharp and that a single layer of the silicate is changed to a (2×3) structure at the interface from the (2×1.5) bulk structure. Based on our experimental results, we propose a geometrical model for the epitaxial interface. The growth of films with an understoichiometric Si flux leads to the formation of a near-surface Ba silicide that does not restrict the epitaxial silicate growth.",
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AU - Müller-Caspary, Knut

AU - Pfnür, Herbert

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