Atomic Structure, Lattice Properties and Phase Transitions

ORAL · MAR-X32 · ID: 3103370

Presentations

  • Oral: Ab-initio Calculations of Electronic Properties of orthorhombic Tin Sulfide (SnS)

    ORAL

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    Presenters

    • Alle Dioum

      Department of Physics, Materials – Composite Systems and Applications (MASCA), Cheikh Anta Diop University (UCAD), Dakar, Senegal

    Authors

    • Alle Dioum

      Department of Physics, Materials – Composite Systems and Applications (MASCA), Cheikh Anta Diop University (UCAD), Dakar, Senegal

    • Yuriy Malozovsky

      Southern University and A&M College

    • Diola Bagayoko

      Southern University and A&M College

    View abstract →

  • Electrochemically Tunable Bond-Centered Oxygen Hole Polarons in a Layered Transition Metal Oxide

    ORAL

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    Presenters

    • Anirudh Adavi

      Massachusetts Institute of Technology

    Authors

    • Anirudh Adavi

      Massachusetts Institute of Technology

    • Kayahan Saritas

      Oak Ridge National Laboratory

    • Varun S Kamboj

      Massachusetts Institute of Technology

    • Ming Lei

      Massachusetts Institute of Technology

    • Das Pemmaraju

      IBM

    • Iwnetim Abate

      Massachusetts Institute of Technology

    View abstract →

  • Operando Study of Photocatalytically Induced Semiconductor to Metallic Phase Transition in BWO using Bragg Coherent Diffraction Imaging

    ORAL

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    Publication: Planned paper: Operando three-dimensional characterization of nanostructured photocatalysts: strain, defects, and phase transformations

    Presenters

    • Jackson S Anderson

      Rensselaer Polytechnic Institute

    Authors

    • Jackson S Anderson

      Rensselaer Polytechnic Institute

    • Edwin Fohtung

      Rensselaer Polytechnic Institute

    View abstract →

  • First Order Pre-emptive Ising-nematic Transition in K<sub>5</sub>Fe<sub>4</sub>Ag<sub>6</sub>Te<sub>10</sub>

    ORAL

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    Publication: N. Giles-Donovan at al., First Order Preemptive Ising-nematic Transition in K5Fe4Ag6Te10, arXiv:2407.14706 (2024)

    Presenters

    • Nathan Giles-Donovan

      University of California, Berkeley

    Authors

    • Nathan Giles-Donovan

      University of California, Berkeley

    • Youzhe Chen

      University of California, Berkeley

    • Hiroshi Fukui

      Precision Spectroscopy Division, CSRR, SPring-8/JASRI, SPring-8

    • Taishun Manjo

      Precision Spectroscopy Division, CSRR, SPring-8/JASRI, SPring-8

    • Daisuke Ishikawa

      Precision Spectroscopy Division, CSRR, SPring-8/JASRI, RIKEN SPring-8 Center

    • Alfred Q R Baron

      RIKEN SPring-8 Center

    • Songxue Chi

      Oak Ridge National Laboratory

    • Henyang Zhong

      Beijing Normal University

    • Saizheng Cao

      Zhejiang University

    • Yu Tang

      Zhejiang University

    • Yifan Wang

      Zhejiang University

    • Xingye Lu

      Beijing Normal University

    • Yu Song

      Zhejiang University

    • Robert J Birgeneau

      University of California, Berkeley

    View abstract →

  • Formation of Micrometer-Sized Textured Hexagonal Silicon Crystals via Nanoindentation

    ORAL

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    Publication: https://doi.org/10.48550/arXiv.2410.08372

    Presenters

    • Emilio Scalise

      Dept. of Materials Science, University of Milano-Bicocca, Via R. Cozzi 55, 20125, Milano, Italy, University of Milan, Bicocca

    Authors

    • Emilio Scalise

      Dept. of Materials Science, University of Milano-Bicocca, Via R. Cozzi 55, 20125, Milano, Italy, University of Milan, Bicocca

    • Mouad Bikerouin

      University of Milano-Bicocca

    • Anna Marzegalli

      Dept. of Materials Science, University of Milano-Bicocca, Via R. Cozzi 55, 20125, Milano, Italy, University of Milano-Bicocca, University of Milano Bicocca

    • Fabrizio Rovaris

      Dept. of Materials Science, University of Milano-Bicocca, Via R. Cozzi 55, 20125, Milano, Italy, University of Milano-Bicocca

    • Corrado Bongiorno

      IMM-CNR Catania

    • Mohamed Zaghloul

      IMM-CNR Catania

    • Gerald Schaffar

      Montanuniversität Leoben

    • Davide Spirito

      IHP GmbH

    • Agnieszka Anna Corley-Wiciak

      IHP GmbH

    • Leonida Miglio

      University of Milan

    • Giovanni Capellini

      IHP GmbH

    • Verena Maier-Kiener

      Montanuniversität Leoben

    • Antonio M Mio

      IMM-CNR Catania

    View abstract →

  • In Situ Measurement of Crystallization and Volatile Phase Transition in Niobium Dioxide Memristive Materials

    ORAL

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    Publication: Measurement of the Crystallization and Phase Transition of Niobium Dioxide Thin-Films Using a Tube Furnace Optical Transmission System. Accepted for publication with AIP Advances.
    Arxiv submission: https://arxiv.org/abs/2406.13523

    Presenters

    • Zachary R Robinson

      University of Rochester

    Authors

    • Zachary R Robinson

      University of Rochester

    • Karsten Beckmann

      NYCreates, NYcreats

    • James H. Michels

      SUNY Brockport

    • Vincent Daviero

      SUNY Brockport

    • Fiona Lorenzen

      Ithaca College

    • Matthew C Sullivan

      Ithaca College

    • Nathaniel Cady

      SUNY Albany, University at Albany

    • Alexander C Kozen

      University of Vermont

    • Jeffrey M Woodward

      U.S. Naval Research Laboratory

    • Marc Currie

      U.S. Naval Research Laboratory

    View abstract →

  • Azimuthal dependence of Γ-point LO-TO phonons in polar semiconductors

    ORAL

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    Presenters

    • Deliang Bao

      Vanderbilt University

    Authors

    • Deliang Bao

      Vanderbilt University

    • Ryan A Kowalski

      Vanderbilt University

    • Jordan Hachtel

      Oak Ridge National Laboratory

    • Joshua D Caldwell

      Vanderbilt University

    • Alexander Paarmann

      Fritz Haber Institute of the Max Planck Society

    • Sokrates T Pantelides

      Vanderbilt University, Department of Physics and Astronomy, Vanderbilt University

    View abstract →

  • Pressure-Induced Phase Transitions of ZnTe(en)<sub>0.5</sub>

    ORAL

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    Publication: This work is part of a paper we hope to submit prior to the March meeting
    Other references:
    1 M. Wright, and A. Uddin, "Organic—inorganic hybrid solar cells: A comparative review," Sol. Energy Mater. Sol. Cells 107, 87–111 (2012).
    2 W. Liu, W.P. Lustig, and J. Li, "Luminescent inorganic-organic hybrid semiconductor materials for energy-saving lighting applications," EnergyChem 1(2), 100008 (2019).
    3 Kickelbick, G., Hybrid Materials: Synthesis, Characterization, and Applications (Wiley-VCH Verlag GmbH & Co. KGaA, New York, 2007).
    4 T. Ye, M. Kocherga, Y.-Y. Sun, A. Nesmelov, F. Zhang, W. Oh, X.-Y. Huang, J. Li, D. Beasock, D.S. Jones, T.A. Schmedake, and Y. Zhang, "II–VI Organic–inorganic hybrid nanostructures with greatly enhanced optoelectronic properties, perfectly ordered structures, and shelf stability of over 15 years," ACS Nano 15(6), 10565–10576 (2021).
    5 X. Huang, J. Li, Y. Zhang, and A. Mascarenhas, "From 1D chain to 3D network: tuning hybrid II-VI nanostructures and their optical properties," J. Am. Chem. Soc. 125(23), 7049–7055 (2003).
    6 B. Fluegel, Y. Zhang, A. Mascarenhas, X. Huang, and J. Li, "Electronic properties of hybrid organic–inorganic semiconductors," Phys. Rev. B 70(20), 205308 (2004).
    7 Y. Zhang, "II-VI based organic-inorganic hybrid structures: Brief review and perspective," J. Lumin. 248, 118936 (2022).
    8 A. Poglitsch, and D. Weber, "Dynamic disorder in methylammoniumtrihalogenoplumbates (II) observed by millimeter-wave spectroscopy," J. Chem. Phys. 87(11), 6373–6378 (1987).
    9 R.J. Elliott, J.A. Krumhansl, and P.L. Leath, "The theory and properties of randomly disordered crystals and related physical systems," Rev. Mod. Phys. 46(3), 465–543 (1974).
    10 A.M. Rasmussen, S.T. Teklemichael, E. Mafi, Y. Gu, and M.D. McCluskey, "Pressure-induced phase transformation of In2Se3," Appl. Phys. Lett. 102(6), 062105 (2013).
    11 B. Gupta, J. Bhalavi, S. Sharma, and A. Bisen, "Phase change materials in solar energy applications: A review," Mater. Today Proc. 46, 5550–5554 (2021).
    12 T. Ye, M. Kocherg, Y.-Y. Sun, A. Nesmelov, F. Zhang, W. Oh, X.-Y. Huang, J. Li, D. Beasock, D.S. Jones, T.A. Schmedake, and Y. Zhang, "Highly ordered II-VI based organic-inorganic hybrids with over 15-year shelf life," ACS Nano 15, (2021).
    13 X. Huang, J. Li, and H. Fu, "The first covalent organic−inorganic networks of hybrid chalcogenides: structures that may lead to a new type of quantum wells," J. Am. Chem. Soc. 122(36), 8789–8790 (2000).
    14 X. Qian, X. Gu, and R. Yang, "Anisotropic thermal transport in organic−inorganic hybrid crystal β‑ZnTe(en)0.5," J Phys Chem C, (2015).
    15 G. Shen, Y. Wang, A. Dewaele, C. Wu, D.E. Fratanduono, J. Eggert, S. Klotz, K.F. Dziubek, P. Loubeyre, O.V. Fat'yanov, P.D. Asimow, T. Mashimo, R.M.M. Wentzcovitch, and other members of the IPPS task group, "Toward an international practical pressure scale: A proposal for an IPPS ruby gauge (IPPS-Ruby2020)," High Press. Res. 40(3), 299–314 (2020).
    16 L.M. Barmore, J. Jesenovec, J.S. McCloy, and M.D. McCluskey, "Photoluminescence of Cr3+ in β-Ga2O3 and (Al0.1Ga0.9)2 O3 under pressure," J. Appl. Phys. 133(17), 175703 (2023).
    17 Jayaraman, A., "Diamond anvil cell and high-pressure physical investigations," Am. Phys. Soc. 55(1), 65–108 (1983).
    18 R.J. Angel, M. Bujak, J. Zhao, G.D. Gatta, and S.D. Jacobsen, "Effective hydrostatic limits of pressure media for high-pressure crystallographic studies," J. Appl. Crystallogr. 40(1), 26–32 (2007).
    19 S. Klotz, J.-C. Chervin, P. Munsch, and G. Le Marchand, "Hydrostatic limits of 11 pressure transmitting media," J. Phys. Appl. Phys. 42(7), 075413 (2009).
    20 A. Hybl, and Richard E. Marsh, "Structure factor and least-squares calculation for orthorhombic systems with anisotropic vibrations," Acta Crystallogr. 14(10), 1046–1051 (1961).
    21 P. Indelicato, and E. Lindroth, "Relativistic effects, correlation, and QED corrections on K α transitions in medium to very heavy atoms," Phys. Rev. A 46(5), 2426–2436 (1992).
    22 J.A. Bearden, "X-ray wavelengths," Rev. Mod. Phys. 39(1), (1967).
    23 P. Karil, N. Karma, H.S. Dager, and N. Kaurav, "Study of structural phase transition and elastic properties of ZnTe semiconducting compound under high pressure," Mater. Today Proc. 54, 782–785 (2022).
    24 L. Segal, and F.V. Eggerton, "Infrared spectra of ethylenediamine and the dimethylethylenediamines," Appl. Spectrosc. 15(4), 116–117 (1961).
    25 J. Hudecová, V. Profant, P. Novotná, V. Baumruk, M. Urbanová, and P. Bouř, "CH stretching region: computational modeling of vibrational optical activity," J. Chem. Theory Comput. 9(7), 3096–3108 (2013).
    26 A.M. Rasmussen, E. Mafi, W. Zhu, Y. Gu, and M.D. McCluskey, "High pressure γ-to-β phase transition in bulk and nanocrystalline In2Se3," High Press. Res. 36(4), 549–556 (2016).

    Presenters

    • Julianne Miller

      Washington State University

    Authors

    • Julianne Miller

      Washington State University

    • Yong Zhang

      University of North Carolina at Charlotte

    • Matthew Douglas McCluskey

      Washington State University

    View abstract →