2021 MRS Spring Meeting

Meeting content will be available through May 31
at https://mrs2021.cd.pathable.com/.


All times listed are Eastern Daylight Time.

Symposium EL03 : Emerging Ionic Semiconductors—Research and Applications

2021-04-22   Show All Abstracts

Symposium Organizers

Hao Zeng, SUNY-Buffalo
Elif Ertekin, University of Illinois at Urbana-Champaign
Rafael Jaramillo, Massachusetts Institute of Technology
Yi-Yang Sun, Shanghai Institute of Ceramics, Chinese Academy of Sciences

Symposium Support

Bronze
Army Research Office
EL03.01: Theory and Design of Ionic Semiconductors I
Session Chairs
Matthias Wuttig
Hao Zeng
Thursday PM, April 22, 2021
EL03

10:30 AM - *EL03.01.01
Chalcogenide Perovskites for Electronics and Optoelectronics

Shengbai Zhang1

Rensselaer Polytechnic Institute1

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10:55 AM - *EL03.01.02
Electron Count and Ferroelectricity in Complex Oxides From First Principles

Karin Rabe1

Rutgers, The State University of New Jersey1

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11:20 AM - *EL03.01.03
Prediction of Novel Quinary Layered Oxychalcogenides

David Scanlon1,Daniel Davies1,Benjamin Williamson1

University College London1

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11:45 AM - *EL03.01.04
Data-Enabled Discovery of New Semiconductors for Energy Generation and Energy Storage

Joseph Bennett1

University of Maryland Baltimore County1

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12:10 PM - EL03.01.05
Search for Inorganic Ternary Oxide-Nitrides

Abhishek Sharan1,2,Stephan Lany1

National Renewable Energy Laboratory1,Khalifa University2

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12:25 PM - EL03.01
Discussion Time


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EL03.02: Theory and Design of Ionic Semiconductors II
Session Chairs
Jayakanth Ravichandran
Shengbai Zhang
Thursday PM, April 22, 2021
EL03

1:00 PM - *EL03.02.01
Metavalent Bonding in Solids—Provocation or Promise?

Matthias Wuttig1,2

RWTH Aachen University1,FZ Jülich2

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1:25 PM - *EL03.02.02
Computational Screening of Light-Absorbing Materials for Tandem Devices

Karsten Jacobsen1

Technical University of Denmark1

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1:50 PM - EL03.02.03
K1-xNaxAsSe2—New Low-Melting Noncentrosymmetric AAsQ2 Semiconductors

Abishek Iyer1,Hye Ryung Byon2,Jingyang He3,Shiqiang Hao1,Benjamin Oxley1,Christopher Wolverton1,Venkatraman Gopalan3,Mercouri Kanatzidis1,Joon Jang2

Northwestern University1,Songang University2,The Pennsylvania State University3

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2:05 PM - *EL03.02.04
Surface Structure, Defects and Reactivity of Perovskite Oxynitrides

Ulrich Aschauer1

University of Bern1

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2:30 PM - EL03.02.05
A Theoretical Exploration of Earth-Abundant Bismuth Oxyhalides for Thermoelectric Applications

Maud Einhorn1,David Scanlon1

University College London1

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2:45 PM - EL03.02
Discussion Time


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EL03.03: Progress in Ionic Semiconductor Thin Films
Session Chairs
Karsten Jacobsen
Rafael Jaramillo
Thursday PM, April 22, 2021
EL03

4:00 PM - *EL03.03.01
Thin Film Growth of Chalcogenide Perovskites by Pulsed Laser Deposition

Jayakanth Ravichandran1

University of Southern California1

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4:25 PM - EL03.03.02
Combinatorial Development of CaCuP Thin Films as P-Type Transparent Conductors

Andrea Crovetto1,2,Thomas Unold2,Andriy Zakutayev1

National Renewable Energy Laboratory1,Helmholtz-Zentrum Berlin für Materialien und Energie2

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4:40 PM - EL03.03.03
Realization of BaZrS3 Chalcogenide Perovskite Thin Films for Optoelectronics

Xiucheng Wei1,Haolei Hui1,Mengjiao Han2,Junhao Lin2,Yi-Yang Sun3,Shengbai Zhang4,Hao Zeng1

University at Buffalo, The State University of New York1,Southern University of Science and Technology2,Shanghai Institute of Ceramics, Chinese Academy of Sciences3,Rensselaer Polytechnic Institute4

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4:55 PM - EL03.03.04
Late News: Growth of BaZrS3 Thin Films by Molecular Beam Epitaxy

Ida Sadeghi1,Kevin Ye1,Rafael Jaramillo1

Massachusetts Institute of Technology1

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5:10 PM - EL03.03.05
SrHfS3 Thin Films with Green Light Emission

Haolei Hui1,Xiucheng Wei1,Zhonghai Yu2,Yi-Yang Sun3,Sen Yang2,Hao Zeng1

University at Buffalo, The State University of New York1,Xi’an Jiaotong University2,Rensselaer Polytechnic Institute3

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5:25 PM - EL03.03.06
Structure and Electronic Properties of Mixed-Bonded PbSe Epitaxial Thin Films on III-V Substrates

Kunal Mukherjee1,2,Brian Haidet2,Eamonn Hughes2,Leland Nordin3,Aaron Muhowski3,Kevin Vallejo4,Paul Simmonds4,Daniel Wasserman3

Stanford University1,University of California, Santa Barbara2,The University of Texas at Austin3,Boise State University4

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5:40 PM - EL03.03.07
Exploring the Piezoelectric Response in WO3-x Enhanced by Oxygen Vacancies and Aluminum Addition

Pamela Pineda-Domínguez1,Manuel Ramos1,John Nogan2,Oscar Alberto López Galán1,Héctor Camacho-Montes1,Abel Macías-Hurtado3,Torben Boll4,Martin Heilmaier4,Jorge Lopez5,Yahir Garay5

Universidad Autónoma de Ciudad Juárez1,Center for Integrated Nanotechnologies2,Laboratorio Nacional de Nanotecnología3,Karlsruher Institut für Technologie4,The University of Texas at El Paso5

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5:45 PM - EL03.03
Discussion Time


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EL03.04: Progress in Ionic Semiconductors/Theory and Design of Ionic Semiconductors III
Session Chairs
Chen Ming
Yi-Yang Sun
Friday AM, April 23, 2021
EL03

8:55 PM - EL03.04.03
Characteristics of Silicon Nitride Thin Film with Plasma Treatment

Chanwon Jung1,Seokhwi Song1,Suhyeon Park1,Byunguk Kim1,Youngjoon Kim1,Eunjong Lee1,Sunggwon Lee1,Taehun Park1,Hyeongtag Jeon1

Hanyang University1

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9:00 PM - *EL03.04.04
Investigation on the Stability of Liquid-Like Thermoelectric Materials and Modules

Pengfei Qiu1

Shanghai Institute of Ceramics, Chinese Academy of Sciences1

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9:25 PM - EL03.04.06
Octahedron Rotation Evolution in 2D Perovskites and Its Impact on Optoelectronic Properties—The Case of Ba–Zr–S Chalcogenides

Chen Ming1,Ke Yang2,3,Hao Zeng4,Shengbai Zhang2,Yi-Yang Sun1

Shanghai Institute of Ceramics, Chinese Academy of Sciences1,Rensselaer Polytechnic Institute2,Hunan University3,University at Buffalo, The State University of New York4

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9:40 PM - EL03.04.07
Chalcogenide Perovskite YScS3 as a Potential p-Type Transparent Conducting Material

Han Zhang1,Chen Ming2,Ke Yang3,4,Hao Zeng5,Shengbai Zhang3,Yi-Yang Sun2

Shandong University1,Shanghai Institute of Ceramics, Chinese Academy of Sciences2,Rensselaer Polytechnic Institute3,Hunan University4,University at Buffalo, The State University of New York5

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9:55 PM - EL03.04.08
Late News: Single-Site of Pervoskite Unit Cell with d-d Transition in Electronic States

Cong Wang1

Beijing University of Technology1

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10:10 PM - EL03.04
Discussion Time


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2021-04-23   Show All Abstracts

Symposium Organizers

Hao Zeng, SUNY-Buffalo
Elif Ertekin, University of Illinois at Urbana-Champaign
Rafael Jaramillo, Massachusetts Institute of Technology
Yi-Yang Sun, Shanghai Institute of Ceramics, Chinese Academy of Sciences

Symposium Support

Bronze
Army Research Office
EL03.05: Progress in Ionic Oxide and Nitride Semiconductors I
Session Chairs
Megan Butala
Ann Greenaway
Friday AM, April 23, 2021
EL03

11:45 AM - *EL03.05.01
Structure and Physical Properties of Complex Chalcogenides—Fundamental Research with an Eye Towards Applications

George Nolas1

University of South Florida1

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12:10 PM - EL03.05.02
Configurational Order-Disorder Transitions in ZnGeN2

Jacob Cordell1,2,Jie Pan2,Adele Tamboli2,1,Garritt Tucker1,Stephan Lany2

Colorado School of Mines1,National Renewable Energy Laboratory2

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12:25 PM - EL03.05.03
Tuning the Electronic Properties of LaFeO3 Thin-Films Photoelectrodes via Partial Cation Replacement

David Fermin1,Xin Sun1,Devendra Tiwari2

University of Bristol1,Northumbria University2

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12:40 PM - *EL03.05.04
Challenges and Opportunities in Ionic Chalcogenide Semiconductors

Mercouri Kanatzidis1,2

Northwestern University1,Argonne National Laboratry2

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1:05 PM - EL03.05.05
Late News: Structure and Bonding of AM2Pn2 (A=Ca, Mg, Yb; Pn=Bi, Sb) Compounds at High Pressure

Mario Calderon Cueva1,Wanyue Peng1,Clarke Samantha2,Megan Rylko1,Jingxuan Ding3,Allison Pease1,Gill Levental1,Benjamin Brugman1,Susannah Dorfman1,Alexandra Zevalkink1

Michigan State University1,Lawrence Livermore National Laboratory2,Duke University3

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1:10 PM - EL03.05
Discussion Time


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EL03.06: Progress in Ionic Oxide and Nitride Semiconductors II
Session Chairs
George Nolas
Kimberly See
Friday PM, April 23, 2021
EL03

2:15 PM - *EL03.06.01
Structure-Property Relationships in Complex Early Transition Metal Oxides for High-Rate Energy Storage

Megan Butala1,Kit McColl2,Kent Griffith3,Rebecca Dally4,Igor Levin4

University of Florida1,University College London2,Northwestern University3,National Institute of Standards and Technology4

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2:40 PM - *EL03.06.02
Materials Chemistry of Ternary Nitride Semiconductors

Andriy Zakutayev1

National Renewable Energy Laboratory1

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3:05 PM - EL03.06.03
Exploring the Nitride Perovskites Composition Space with Chemical Heuristics and First-Principles Calculations

Daniel Davies1,Aron Walsh2,David Scanlon1

University College London1,Imperial College London2

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3:20 PM - *EL03.06.04
Mg-IV-N2 Semiconductors—Polymorphism and Cation Disorder

Ann Greenaway1,Amanda Loutris1,Rekha Schnepf1,2,Karen Heinselman1,Allison Mis1,2,Rachel Woods-Robinson1,3,Celeste Melamed1,2,Jesse Adamczyk2,M Brooks Tellekamp1,Rachel Sherbondy1,2,Dylan Bardgett1,Sage Bauers1,Andriy Zakutayev1,Steven Christensen1,Stephan Lany1,Adele Tamboli1

National Renewable Energy Laboratory1,Colorado School of Mines2,University of California, Berkeley3

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3:45 PM - EL03.06.05
Controlled Synthesis and Electronic Structure Engineering of Metastable Ta2N3 via Oxygen Incorporation

Chang-Ming Jiang1,Laura Wagner1,Johanna Eichhorn1,Ian Sharp1

Technische Universität München1

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4:00 PM - EL03.06.06
Cation Disorder in Zn-IV-N2—Does Intrinsic Disorder Exist Besides Effects of Composition and Oxygen Content?

Joachim Breternitz1,Zhenyu Wang1,2,Susan Schorr1,2

Helmholtz-Zentrum Berlin für Materialien und Energie1,Freie Universität Berlin2

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EL03.07: Progress in Ionic Semiconductor—Transport
Session Chairs
Elif Ertekin
Andriy Zakutayev
Friday PM, April 23, 2021
EL03

5:15 PM - *EL03.07.01
Origin of Unexpectedly Low Thermal Conductivity in Mg3Sb2 and Mg3Bi2 Thermoelectric Materials

Alexandra Zevalkink1

Michigan State University1

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5:40 PM - EL03.07.02
The Effect of Multi-Band Transport on Thermal Conductivity Seen in Yb14Mg1-xAlxSb11

Max Wood1,2,Chris Perez3,Francesco Ricci4,Geoffroy Hautier4,G. Snyder2,Susan Kauzlarich3

NASA Jet Propulsion Laboratory1,Northwestern University2,University of California, Davis3,Université Catholique de Louvain4

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5:55 PM - EL03.07.03
Conversion of Electrospun Layered Perovskite Nanofibers to Perovskite Oxynitrides for Visible Light Absorption

Roland Marschall1,Anja Hofmann1

University of Bayreuth1

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6:10 PM - *EL03.07.04
Divalent Ion Conductors

Kimberly See1

California Institute of Technology1

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6:35 PM - EL03.07.05
Investigation of Thermoelectric Properties of Yb14-xNaxMgSb11

Naomi Pieczulewski1,Max Wood1,Michael Toriyama1,James Male1,G. Snyder1

Northwestern University1

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6:50 PM - EL03.07.06
Interplay Between Phononic and Electronic Properties in Determining Carrier Mobility in Heavily Donor-Doped CdO Thin-Films

Zachary Piontkowski1,Evan Runnerstrom2,3,Angela Cleri4,Anthony McDonald1,Jon Ihlefeld5,Jon-Paul Maria4,Thomas Beechem1

Sandia National Laboratories1,North Carolina State University2,U.S. Army Research Office—Materials Science Division3,The Pennsylvania State University4,University of Virginia5

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7:05 PM - EL03.07
Discussion Time


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EL03.08: Progress in Ionic Oxide and Nitride Semiconductors III/Panel Discussion: Why New semiconductors?
Session Chairs
Yi-Yang Sun
Hao Zeng
Saturday AM, April 24, 2021
EL03

8:15 PM - *EL03.08.01
Efficient Photocatalysts for Water Splitting to Produce Solar Hydrogen

Kazunari Domen1,2

Shinshu University1,The University of Tokyo2

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8:40 PM - *EL03.08.02
Progress in Wide Gap Ionic Oxide Semicoinductors

Hideo Hosono1,2

Tokyo Institute of Technology1,National Institute for Materials Science2

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9:05 PM - EL03.08
Break


9:20 PM - *EL03.08.03
Panel Discussion: Why New Semiconductors?

Hideo Hosono1,George Nolas2,Shengbai Zhang3,Andriy Zakutayev4

Tokyo Institute of Technology1,University of South Florida2,Rensselear Polytechnic University3,National Renewable Energy Laboratory4

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