Emergent Phenomena in Molecular Materials

FOCUS · F21 · ID: 2155604

Presentations

  • ORAL · Invited

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    Publication: [1] W. Tian et al., Phys. Rev. B 94, 214405 (2016).
    [2] W. Tian et al., Phys. Rev. B 98, 054407 (2018).
    [3] A. Clune et al., NPJ Quantum Mat. 4, 44 (2019).
    [4] X. Bai, W. Tian et al, Phys. Rev. B 103, 224411 (2021).
    [5] Kendall D. Hughey et al, Inorg. Chem. 61, 3434−3442 (2022)

    Presenters

    • Wei Tian

      • Oak Ridge National Laboratory

    Authors

    • Wei Tian

      • Oak Ridge National Laboratory

    View abstract →

  • ORAL · Invited

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    Publication: 1) Transition Temperature for Spin-Crossover Materials with the Mean Value Ensemble Hubbard-U Correction
    Angel Albavera-Mata, Richard G. Hennig, and S.B. Trickey [J. Phys. Chem. A 127, 7646 (2023)]
    2) Mean Value Ensemble Hubbard-U Correction for Spin-Crossover Molecules
    Angel Albavera-Mata, S.B. Trickey and Richard G. Hennig [J. Phys. Chem. Lett. 13, 12049-12054 (2022)]
    3) Barriers to Predictive High-throughput Screening for Spin-crossover
    Daniel Mejía-Rodríguez, Angel Albavera-Mata, Eric Fonseca, Dianteng Chen, H-P. Cheng, Richard G. Hennig, and S.B. Trickey [Comput. Mat. Sci 206, 111161 (2022).]
    Spin-Crossover From a Well-Behaved, Low-Cost meta-GGA Density Functional
    Daniel Mejía-Rodríguez and S.B. Trickey [J. Phys. Chem. A 124, 9889 (2020)]
    5) Cooperativity in the Spin Transition for [Fe(tBu2qsal)2], A. Albavera-Mata,
    S.B. Trickey, and Richard G. Hennig (in preparation)

    Presenters

    • Samuel B Trickey

      • University of Florida

    Authors

    • Samuel B Trickey

      • University of Florida

    View abstract →

  • ORAL

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    Publication: J. Singleton, PA. Goddard, J.M. Blawat et al., preprint.

    Presenters

    • John Singleton

      • NHMFL/ LANL
      • NHMFL, Los Alamos National Laboratory
      • Los Alamos National Laboratory

    Authors

    • John Singleton

      • NHMFL/ LANL
      • NHMFL, Los Alamos National Laboratory
      • Los Alamos National Laboratory

    • Paul A Goddard

      • University of Warwick

    • Joanna Blawat

      • NHMFL, Los Alamos National Laboratory
      • Los Alamos National Laboratory

    • Sam Curley

      • Warwick University

    • Robert Williams

      • Warwick University

    • Akira Matsuo

      • ISSP

    • Yoshimitsu Kohama

      • The Institute for Solid State Physics, The University of Tokyo
      • University of Tokyo
      • ISSP
      • Institute for Solid State Physics, University of Tokyo

    • Kyla Duggan

      • Eastern Washington University

    • Madison Greer

      • Eastern Washington University

    • Jackie Villa

      • Eastern Washington University

    • Zachary E Manson

      • Eastern Washington University

    • Jamie L Manson

      • Eastern Washington University

    View abstract →

  • ORAL

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    Publication: Christopher Lane, Yixuan Huang, and Jian-Xin Zhu. arXiv:2305.03867 (2023)

    Presenters

    • Christopher A Lane

      • Los Alamos National Laboratory

    Authors

    • Christopher A Lane

      • Los Alamos National Laboratory

    • Yixuan Huang

      • Los Alamos National Laboratory

    • Jian-Xin Zhu

      • Los Alamos National Laboratory
      • Los Alamos Natl Lab
      • Theoretical Division, Los Alamos National Laboratory, Los Alamos,NM87545, USA
      • Theoretical Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA

    View abstract →

  • ORAL

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    Publication: H. Yamaguchi et al., Phys. Rev. B 107, L161111 (2023)

    Presenters

    • Hironori Yamaguchi

      • Osaka Metropolitan University

    Authors

    • Hironori Yamaguchi

      • Osaka Metropolitan University

    • Hiroki Takahashi

      • Osaka Metropolitan University

    • Takashi Kawakami

      • Osaka University

    • Kiyomi Okamoto

      • University of Hyogo

    • Toru Sakai

      • Univ of Hyogo

    • Takeshi Yajima

      • Nagoya University

    • Yoshiki Iwasaki

      • Nihon University

    View abstract →

  • ORAL

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    Presenters

    • Niccolo Fontana

      • University of Oxford

    Authors

    • Niccolo Fontana

      • University of Oxford

    • Mikhail Vaganov

      • CAESR, Department of Physics, University of Oxford

    • Gabriel Moise

      • CAESR, Department of Physics, University of Oxford

    • William Myers

      • CAESR, Department of Chemistry, University of Oxford

    • Junjie Liu

      • CAESR, Department of Physics, University of Oxford

    • Arzhang Ardavan

      • CAESR, Department of Physics, University of Oxford

    View abstract →

  • ORAL

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    Publication: Peter H. Jacobse, Mamun Sarker, Anshul Saxena, Percy Zahl, Ziyi Wang, Emma Berger, Narayana Aluru, Alexander Sinitskii, Michael F. Crommie, Tunable Magnetic Coupling in Graphene Nanoribbon Quantum Dots, in review.

    Presenters

    • Ziyi Wang

      • University of California, Berkeley

    Authors

    • Ziyi Wang

      • University of California, Berkeley

    • Peter H Jacobse

      • University of California, Berkeley

    • Mamun Sarker

      • University of Nebraska-Lincoln
      • University of Nebraska - Lincoln

    • Anshul Saxena

      • The University of Texas at Austin
      • University of Texas at Austin

    • Percy Zahl

      • Brookhaven National Laboratory

    • Emma Berger

      • University of California, Berkeley

    • Narayana R Aluru

      • The University of Texas at Austin

    • Alexander Sinitskii

      • University of Nebraska - Lincoln

    • Michael F Crommie

      • University of California, Berkeley

    View abstract →

  • ORAL

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    Presenters

    • UCHENNA V CHINAEGBOMKPA

      • Department of Chemistry, Clemson University

    Authors

    • UCHENNA V CHINAEGBOMKPA

      • Department of Chemistry, Clemson University

    • Michal J Winiarski

      • Advanced Materials Center, Faculty of Applied Physics and Mathematics, Gdansk University of Technology ul. Narutowicza 11/12, 80-233 Gdansk
      • Faculty of Applied Physics and Mathematics and Advanced Materials Center, Gdansk University of Technology, 80-233,Gdansk, Poland

    • Hugo Sanabria

      • Department of Physics and Astronomy, Clemson University

    • Thao T Tran

      • Department of Chemistry, Clemson University
      • Clemson University

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  • ORAL

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    Presenters

    • DaVonne Henry

      • Georgetown University

    Authors

    • DaVonne Henry

      • Georgetown University

    • Amjad Alqahtani

      • Georgetown University

    • Morgan Hale

      • Roanoke College

    • Lubomir Havlicek

      • Central European Institute of Technology

    • Ivan Nemec

      • Central European Institute of Technology

    • Petr Neugebauer

      • Central European Institute of Technology

    • Paola Barbara

      • Georgetown University

    • Amy Y Liu

      • Georgetown University

    View abstract →