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Autori principali: Attiaoui, Anis, Chen, Shunda, Woicik, Joseph C., Lentz, J. Zach, Vogl, Liliane M., Meyer, Jarod E., Mukherjee, Kunal, Minor, Andrew, Li, Tianshu, McIntyre, Paul C.
Natura: Preprint
Pubblicazione: 2026
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Accesso online:https://arxiv.org/abs/2603.27876
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author Attiaoui, Anis
Chen, Shunda
Woicik, Joseph C.
Lentz, J. Zach
Vogl, Liliane M.
Meyer, Jarod E.
Mukherjee, Kunal
Minor, Andrew
Li, Tianshu
McIntyre, Paul C.
author_facet Attiaoui, Anis
Chen, Shunda
Woicik, Joseph C.
Lentz, J. Zach
Vogl, Liliane M.
Meyer, Jarod E.
Mukherjee, Kunal
Minor, Andrew
Li, Tianshu
McIntyre, Paul C.
contents The functional properties of semiconductors are typically controlled by tailoring their chemical composition and their state of strain, and by controlling their long-range structural order, including the presence of extended defects such as dislocations. In addition to these approaches, theoretical predictions suggest that short-range order (SRO) of atoms in group-IV semiconductor alloys can modify the bandgap, a defining property of any semiconductor. Herein, a new machine learning enabled, computation-guided methodology for extended X-ray absorption fine structure (EXAFS) analysis of SRO is used to quantify the effects of local atomic order on the bandgap of germanium-tin (GeSn) alloy single crystal nanostructures with well-controlled strain and composition. Correlative analysis of EXAFS and photoluminescence (PL) establishes the relationship between bandgap and the Warren-Cowley short-range order (WC-SRO) parameter of the GeSn alloys. It is further demonstrated that SRO can be tuned over a broad range by post-deposition annealing of the alloy crystals. This work establishes control of SRO as an important design parameter for semiconducting properties and suggests the potential for quantitative measurement and tuning of SRO in other semiconductor alloy systems.
format Preprint
id arxiv_https___arxiv_org_abs_2603_27876
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Shining light on short-range atomic ordering in semiconductors alloys
Attiaoui, Anis
Chen, Shunda
Woicik, Joseph C.
Lentz, J. Zach
Vogl, Liliane M.
Meyer, Jarod E.
Mukherjee, Kunal
Minor, Andrew
Li, Tianshu
McIntyre, Paul C.
Materials Science
Computational Physics
The functional properties of semiconductors are typically controlled by tailoring their chemical composition and their state of strain, and by controlling their long-range structural order, including the presence of extended defects such as dislocations. In addition to these approaches, theoretical predictions suggest that short-range order (SRO) of atoms in group-IV semiconductor alloys can modify the bandgap, a defining property of any semiconductor. Herein, a new machine learning enabled, computation-guided methodology for extended X-ray absorption fine structure (EXAFS) analysis of SRO is used to quantify the effects of local atomic order on the bandgap of germanium-tin (GeSn) alloy single crystal nanostructures with well-controlled strain and composition. Correlative analysis of EXAFS and photoluminescence (PL) establishes the relationship between bandgap and the Warren-Cowley short-range order (WC-SRO) parameter of the GeSn alloys. It is further demonstrated that SRO can be tuned over a broad range by post-deposition annealing of the alloy crystals. This work establishes control of SRO as an important design parameter for semiconducting properties and suggests the potential for quantitative measurement and tuning of SRO in other semiconductor alloy systems.
title Shining light on short-range atomic ordering in semiconductors alloys
topic Materials Science
Computational Physics
url https://arxiv.org/abs/2603.27876