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Main Authors: Mazza, Alessandro R., Shi, Jia, Vázquez-Lizardi, Gabriel A., Kim, Sangsoo, Bentley, Jackson, Chen, An-Hsi, Kisslinger, Kim, Mallick, Debarghya, Lu, Qiangsheng, Ward, T. Zac, Starchenko, Vitalii, Cucciniello, Nicholas, Moore, Robert G., Eres, Gyula, Cao, Yue, Mukherjee, Debangshu, Collins, Liam, Nelson, Christopher, Hickey, Danielle Reifsnyder, Xue, Fei, Brahlek, Matthew
Format: Preprint
Published: 2025
Subjects:
Online Access:https://arxiv.org/abs/2505.18103
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author Mazza, Alessandro R.
Shi, Jia
Vázquez-Lizardi, Gabriel A.
Kim, Sangsoo
Bentley, Jackson
Chen, An-Hsi
Kisslinger, Kim
Mallick, Debarghya
Lu, Qiangsheng
Ward, T. Zac
Starchenko, Vitalii
Cucciniello, Nicholas
Moore, Robert G.
Eres, Gyula
Cao, Yue
Mukherjee, Debangshu
Collins, Liam
Nelson, Christopher
Hickey, Danielle Reifsnyder
Xue, Fei
Brahlek, Matthew
author_facet Mazza, Alessandro R.
Shi, Jia
Vázquez-Lizardi, Gabriel A.
Kim, Sangsoo
Bentley, Jackson
Chen, An-Hsi
Kisslinger, Kim
Mallick, Debarghya
Lu, Qiangsheng
Ward, T. Zac
Starchenko, Vitalii
Cucciniello, Nicholas
Moore, Robert G.
Eres, Gyula
Cao, Yue
Mukherjee, Debangshu
Collins, Liam
Nelson, Christopher
Hickey, Danielle Reifsnyder
Xue, Fei
Brahlek, Matthew
contents The epitaxial synthesis of high-quality 2D layered materials is an essential driver of both fundamental physics studies and technological applications. Bi$_2$Se$_3$, a prototypical 2D layered topological insulator, is sensitive to defects imparted during the growth, either thermodynamically or due to the film-substrate interaction. In this study, it is shown that step-terminated Al$_2$O$_3$ substrates with a high miscut angle (3°) can effectively suppress a particular hard-to-mitigate defect, the antiphase twin. Systematic investigations across a range of growth temperatures and substrate miscut angles confirm that atomic step edges act as preferential nucleation sites, stabilizing a single twin domain. First-principles calculations suggest that there is a significant energy barrier for twin boundary formation at step edges, supporting the experimental observations. Detailed structural characterization indicates that this twin-selectivity is lost through the mechanism of the 2D layers overgrowing the step edges, leading to higher twin density as the thickness increases. These findings highlight the complex energy landscape unique to 2D materials that is driven by the interplay between substrate properties, nucleation dynamics, and defect formation, and overcoming and controlling these are critical to improve material quality for quantum and electronic applications.
format Preprint
id arxiv_https___arxiv_org_abs_2505_18103
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Nucleation and Antiphase Twin Control in Bi$_2$Se$_3$ via Step-Terminated Al$_2$O$_3$ Substrates
Mazza, Alessandro R.
Shi, Jia
Vázquez-Lizardi, Gabriel A.
Kim, Sangsoo
Bentley, Jackson
Chen, An-Hsi
Kisslinger, Kim
Mallick, Debarghya
Lu, Qiangsheng
Ward, T. Zac
Starchenko, Vitalii
Cucciniello, Nicholas
Moore, Robert G.
Eres, Gyula
Cao, Yue
Mukherjee, Debangshu
Collins, Liam
Nelson, Christopher
Hickey, Danielle Reifsnyder
Xue, Fei
Brahlek, Matthew
Materials Science
Mesoscale and Nanoscale Physics
The epitaxial synthesis of high-quality 2D layered materials is an essential driver of both fundamental physics studies and technological applications. Bi$_2$Se$_3$, a prototypical 2D layered topological insulator, is sensitive to defects imparted during the growth, either thermodynamically or due to the film-substrate interaction. In this study, it is shown that step-terminated Al$_2$O$_3$ substrates with a high miscut angle (3°) can effectively suppress a particular hard-to-mitigate defect, the antiphase twin. Systematic investigations across a range of growth temperatures and substrate miscut angles confirm that atomic step edges act as preferential nucleation sites, stabilizing a single twin domain. First-principles calculations suggest that there is a significant energy barrier for twin boundary formation at step edges, supporting the experimental observations. Detailed structural characterization indicates that this twin-selectivity is lost through the mechanism of the 2D layers overgrowing the step edges, leading to higher twin density as the thickness increases. These findings highlight the complex energy landscape unique to 2D materials that is driven by the interplay between substrate properties, nucleation dynamics, and defect formation, and overcoming and controlling these are critical to improve material quality for quantum and electronic applications.
title Nucleation and Antiphase Twin Control in Bi$_2$Se$_3$ via Step-Terminated Al$_2$O$_3$ Substrates
topic Materials Science
Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2505.18103