Tuning Magnetic and Optical Properties in MnxZn1-xPS3 Single Crystals by the Alloying Composition

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Auteurs principaux: Harchol, Adi, Zuri, Shahar, Ritov, Esther, Horani, Faris, Rybak, Miłosz, Woźniak, Tomasz, Eyal, Anna, Amouyal, Yaron, Birowska, Magdalena, Lifshitz, Efrat
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Publié: 2024
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author Harchol, Adi
Zuri, Shahar
Ritov, Esther
Horani, Faris
Rybak, Miłosz
Woźniak, Tomasz
Eyal, Anna
Amouyal, Yaron
Birowska, Magdalena
Lifshitz, Efrat
author_facet Harchol, Adi
Zuri, Shahar
Ritov, Esther
Horani, Faris
Rybak, Miłosz
Woźniak, Tomasz
Eyal, Anna
Amouyal, Yaron
Birowska, Magdalena
Lifshitz, Efrat
contents The exploration of two-dimensional (2D) antiferromagnetic (AFM) materials has shown great promise and interest in tuning the magnetic and electronic properties as well as studying magneto-optical effects. The current work investigates the control of magneto-optical interactions in alloyed MnxZn1-xPS3 lamellar semiconductor single crystals, with the Mn/Zn ratio regulating the coupling strength. Magnetic susceptibility results show a retention of AFM order followed by a decrease in Néel temperatures down to ~ 40% Mn concentration, below which a paramagnetic behavior is observed. Absorption measurements reveal an increase in bandgap energy with higher Zn(II) concentration, and the presence of Mn(II) d-d transition below the absorption edge. DFT+U approach qualitatively explained the origin and the position of the experimentally observed mid band-gap states in pure MnPS3, and corresponding peaks visible in the alloyed systems MnxZn1-xPS3. Accordingly, emission at 1.3 eV in all alloyed compounds results from recombination from a 4T1g Mn(II) excited state to a hybrid p-d state at the valence band. Most significant, temperature-dependent photoluminescence (PL) intensity trends demonstrate strong magneto-optical coupling in compositions with x > 0.65. This study underscores the potential of tailored alloy compositions as a means to control magnetic and optical properties in 2D materials, paving the way for advances in spin-based technologies.
format Preprint
id arxiv_https___arxiv_org_abs_2404_07643
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Tuning Magnetic and Optical Properties in MnxZn1-xPS3 Single Crystals by the Alloying Composition
Harchol, Adi
Zuri, Shahar
Ritov, Esther
Horani, Faris
Rybak, Miłosz
Woźniak, Tomasz
Eyal, Anna
Amouyal, Yaron
Birowska, Magdalena
Lifshitz, Efrat
Materials Science
Chemical Physics
The exploration of two-dimensional (2D) antiferromagnetic (AFM) materials has shown great promise and interest in tuning the magnetic and electronic properties as well as studying magneto-optical effects. The current work investigates the control of magneto-optical interactions in alloyed MnxZn1-xPS3 lamellar semiconductor single crystals, with the Mn/Zn ratio regulating the coupling strength. Magnetic susceptibility results show a retention of AFM order followed by a decrease in Néel temperatures down to ~ 40% Mn concentration, below which a paramagnetic behavior is observed. Absorption measurements reveal an increase in bandgap energy with higher Zn(II) concentration, and the presence of Mn(II) d-d transition below the absorption edge. DFT+U approach qualitatively explained the origin and the position of the experimentally observed mid band-gap states in pure MnPS3, and corresponding peaks visible in the alloyed systems MnxZn1-xPS3. Accordingly, emission at 1.3 eV in all alloyed compounds results from recombination from a 4T1g Mn(II) excited state to a hybrid p-d state at the valence band. Most significant, temperature-dependent photoluminescence (PL) intensity trends demonstrate strong magneto-optical coupling in compositions with x > 0.65. This study underscores the potential of tailored alloy compositions as a means to control magnetic and optical properties in 2D materials, paving the way for advances in spin-based technologies.
title Tuning Magnetic and Optical Properties in MnxZn1-xPS3 Single Crystals by the Alloying Composition
topic Materials Science
Chemical Physics
url https://arxiv.org/abs/2404.07643