Focus Session: Ferroic Materials by Design

Presentations

• Revealing and understanding the behavior of structural domain walls from first principles

  COFFEE_KLATCH · Invited

  March 3, 2015, 11:15 AM – March 3, 2015, 11:51 AM

  Authors

  • Jorge Iniguez

    • Institut de Ci\`encia de Materials de Barcelona (ICMAB-CSIC), Campus UAB, E-08193 Bellaterra, Spain
    • ICMAB-CSIC

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• Magnetic charge and magnetoelectricity in hexagonal manganites and ferrites

  ORAL

  March 3, 2015, 11:51 AM – March 3, 2015, 12:03 PM

  Authors

  • Meng Ye

    • Rutgers Univ

  • David Vanderbilt

    • Rutgers University
    • Department of Physics and Astrnomy, Rutgers University
    • Rutgers Univ

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• Ferroelectrics with a trilinear coupling of three lattice modes: Response to electrical boundary conditions from first principles

  ORAL

  March 3, 2015, 12:03 PM – March 3, 2015, 12:15 PM

  Authors

  • Andrew T. Mulder

    • School of Applied and Engineering Physics, Cornell University

  • Craig J. Fennie

    • School of Applied and Engineering Physics, Cornell University

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• Epitaxial-strain-induced insulating phase in 1:1 SrCrO$_3$/SrTiO$_3$ superlattices: A first-principles study

  ORAL

  March 3, 2015, 12:15 PM – March 3, 2015, 12:27 PM

  Authors

  • Yuanjun Zhou

    • Rutgers University

  • Karin Rabe

    • Rutgers University

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• Trilinear couplings and the multi-mode anti-ferroelectric transition of PbZrO$_{3}$: a first-principles investigation

  ORAL

  March 3, 2015, 12:27 PM – March 3, 2015, 12:39 PM

  Authors

  • Jorge Iniguez

    • Institut de Ci\`encia de Materials de Barcelona (ICMAB-CSIC), Campus UAB, E-08193 Bellaterra, Spain
    • ICMAB-CSIC

  • Massimiliano Stengel

    • Institut de Ci\`encia de Materials de Barcelona (ICMAB-CSIC) Campus UAB, E-08193 Bellaterra, Barcelona, Spain
    • ICREA and ICMAB-CSIC

  • Sergey Prosandeev

    • University of Arkansas
    • Univ of Arkansas-Fayetteville

  • Laurent Bellaiche

    • Institute for Nanoscience and Engineering and Physics Department, University of Arkansas, Fayetteville, Arkansas 72701, USA
    • University of Arkansas
    • Physics Department and Institute for Nanoscience and Engineering - University of Arkansas

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• A new class of in-plane Ferroelectric Mott insulators via oxide hetorostructuring

  ORAL

  March 3, 2015, 12:39 PM – March 3, 2015, 12:51 PM

  Authors

  • Chanul Kim

    • Columbia Univ

  • Hyowon Park

    • University of Illinois at Chicago

  • Chris Marianetti

    • Department of Applied Physics and Applied Mathematics, Columbia University
    • Departemtn of Applied Physics and Applied Math, Columbia University
    • Columbia University
    • Columbia Univ

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• Why is the electrocaloric effect so small in ferroelectrics?

  ORAL

  March 3, 2015, 12:51 PM – March 3, 2015, 1:03 PM

  Authors

  • Gian G. Guzman-Verri

    • Argonne National Laboratory

  • Peter Littlewood

    • Univ of Chicago
    • Argonne Natl Lab
    • Argonne National Laboratory and The University of Chicago
    • Argonne National Laboratory

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• Strain{\textendash}Induced Geometric Ferroelectricity in Perovskite{\textendash}structured Fluoroscandates

  ORAL

  March 3, 2015, 1:03 PM – March 3, 2015, 1:15 PM

  Authors

  • Nenian Charles

    • Drexel University

  • James Rondinelli

    • Northwestern University

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• Tuning the structure of oxide thin films with strain

  ORAL

  March 3, 2015, 1:15 PM – March 3, 2015, 1:27 PM

  Authors

  • Elizabeth Nowadnick

    • Cornell University

  • Andrew Mulder

    • Cornell University

  • Craig Fennie

    • Cornell University

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• First-principles studies of lone-pair-induced distortions in epitaxial phases of perovskite SnTiO$_3$ and PbTiO$_3$

  ORAL

  March 3, 2015, 1:27 PM – March 3, 2015, 1:39 PM

  Authors

  • Krishna Pitike

    • University of Connecticut - Storrs

  • Lydie Louis

    • University of Connecticut - Storrs

  • William Parker

    • Purdue University

  • Serge Nakhmanson

    • Institute of Materials Science, University of Connecticut, Storrs, CT, United States
    • University of Connecticut
    • University of Connecticut - Storrs

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• Tuning ferroelectric polarization in $AA^{\prime}$MnWO$_6$ double perovskites through $A$ cation substitution

  ORAL

  March 3, 2015, 1:39 PM – March 3, 2015, 1:51 PM

  Authors

  • Joshua Young

    • Drexel University

  • James Rondinelli

    • Northwestern University

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• First principles study of the band gaps and edges of (111) epitaxially strained SrTiO$_3$

  ORAL

  March 3, 2015, 1:51 PM – March 3, 2015, 2:03 PM

  Authors

  • Sebastian E. Reyes-Lillo

    • Molecular Foundry, Lawrence Berkeley National Laboratory

  • Robert F. Berger

    • Department of Chemistry, Western Washington University

  • Jeffrey Neaton

    • Univ of California - Berkeley
    • Molecular Foundry, Lawrence Berkeley National Laboratory
    • Physics Department, UC Berkeley \& Molecular Foundry, LBNL \& Kavli Energy NanoSciences Institute at Berkeley, Berkeley
    • University of California at Berkeley
    • University of California, Berkeley; Lawrence Berkeley National Laboratory
    • Dept. of Physics, UC Berkeley
    • Molecular Foundry, Lawrence Berkeley National Laboratory; Department of Physics, University of California-Berkeley
    • University of California, Berkeley and Lawrence Berkeley National Lab
    • Molecular Foundry, Lawrence Berkeley National Laboratory, and Department of Physics, UC-Berkeley
    • Lawrence Berkeley National Laboratory

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• First principles investigations of structural, elastic, dielectric and piezoelectric properties of \{Ba,Sr,Pb\}TiO$_3$, \{Ba,Sr,Pb\}ZrO$_3$ and \{Ba,Sr,Pb\}\{Zr,Ti\}O$_3$ ceramics

  ORAL

  March 3, 2015, 2:03 PM – March 3, 2015, 2:15 PM

  Authors

  • Berna Akgenc

    • Kirklareli University Department of Physics, Faculty of Science, Kavakli, 39060, Kirklareli, Turkey

  • Cetin Tasseven

    • Department of Physics, Faculty of Science, Yildiz Technical University, Davutpasa Campus, Esenler, 34210, Istanbul, Turkey

  • Tahir Cagin

    • Department of Materials Science and Engineering, Texas A\&M University, College Station, TX 77843-3003, USA

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