Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides

Niu, Shanyuan; Huyan, Huaixun; Liu, Yang; Yeung, Matthew; Ye, Kevin; Blankemeier, Louis; Orvis, Thomas; Sarkar, Debarghya; Singh, David J.; Kapadia, Rehan; Ravichandran, Jayakanth

doi:10.1002/adma.201604733

Title: Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides

Authors:

Niu, Shanyuan ^[1]; Huyan, Huaixun ^[1]; Liu, Yang ^[1]; Yeung, Matthew ^[2]; Ye, Kevin ^[1]; Blankemeier, Louis ^[2]; Orvis, Thomas ^[1]; Sarkar, Debarghya ^[2]; Singh, David J. ^[3]; Kapadia, Rehan ^[2]; Ravichandran, Jayakanth ^[1]

Mork Family Department of Chemical Engineering and Materials Science University of Southern California 925 Bloom Walk, HED 216 Los Angeles CA 90089 USA
Ming Hsieh Department of Electrical Engineering University of Southern California 3740 McClintock Avenue, EEB 102 Los Angeles CA 90089 USA
Department of Physics and Astronomy University of Missouri Columbia MO 65211‐7010 USA

Publication Date:: Thu Dec 22 00:00:00 EST 2016

Sponsoring Org.:: USDOE

OSTI Identifier:: 1401502

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Advanced Materials

Additional Journal Information:: Journal Name: Advanced Materials Journal Volume: 29 Journal Issue: 9; Journal ID: ISSN 0935-9648

Publisher:: Wiley Blackwell (John Wiley & Sons)

Country of Publication:: Germany

Language:: English

Citation Formats


                    Niu, Shanyuan, Huyan, Huaixun, Liu, Yang, Yeung, Matthew, Ye, Kevin, Blankemeier, Louis, Orvis, Thomas, Sarkar, Debarghya, Singh, David J., Kapadia, Rehan, and Ravichandran, Jayakanth. Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides.  Germany: N. p., 2016. 
Web.  doi:10.1002/adma.201604733.

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                    Niu, Shanyuan, Huyan, Huaixun, Liu, Yang, Yeung, Matthew, Ye, Kevin, Blankemeier, Louis, Orvis, Thomas, Sarkar, Debarghya, Singh, David J., Kapadia, Rehan, & Ravichandran, Jayakanth. Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides.  Germany.  https://doi.org/10.1002/adma.201604733

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                    Niu, Shanyuan, Huyan, Huaixun, Liu, Yang, Yeung, Matthew, Ye, Kevin, Blankemeier, Louis, Orvis, Thomas, Sarkar, Debarghya, Singh, David J., Kapadia, Rehan, and Ravichandran, Jayakanth. Thu .  
"Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides".  Germany.  https://doi.org/10.1002/adma.201604733.

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@article{osti_1401502,

  title        = {Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides},

  author       = {Niu, Shanyuan and Huyan, Huaixun and Liu, Yang and Yeung, Matthew and Ye, Kevin and Blankemeier, Louis and Orvis, Thomas and Sarkar, Debarghya and Singh, David J. and Kapadia, Rehan and Ravichandran, Jayakanth},

  abstractNote = {},

  doi          = {10.1002/adma.201604733},

  journal      = {Advanced Materials},

  number       = 9,

  volume       = 29,

  place        = {Germany},

  year         = {Thu Dec 22 00:00:00 EST 2016},

  month        = {Thu Dec 22 00:00:00 EST 2016}

}

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Title: Bandgap Control via Structural and Chemical Tuning of Transition Metal Perovskite Chalcogenides

Citation Formats

Chalcogenide perovskites – an emerging class of ionic semiconductors journal, April 2016

Strong Internal and External Luminescence as Solar Cells Approach the Shockley–Queisser Limit journal, July 2012

Protons in Oxysulfides, Oxysulfates, and Sulfides: A First-Principles Study of La 2 O 2 S, La 2 O 2 SO 4 , SrZrS 3 , and BaZrS 3 journal, October 2015

Effect of substituting of S for O: The sulfide perovskite BaZrS 3 investigated with density functional theory journal, June 2009

Merits and limits of the modified Becke-Johnson exchange potential journal, May 2011

Synthesis of BaZrS3 by short time reaction at lower temperatures journal, August 2001

Synthesis of BaZrS3 in the presence of excess sulfur journal, October 2000

Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells journal, May 2009

The synthesis and crystal structures of some alkaline earth titanium and zirconium sulfides journal, February 1963

Preparation and crystal structures of some complex sulphides at high pressures journal, November 1988

Structural Evolutions in the Sr1−xBaxZrSe3Series journal, April 1997

Connecting Thermoelectric Performance and Topological-Insulator Behavior: Bi 2 Te 3 and Bi 2 Te 2 Se from First Principles journal, January 2015

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Chalcogenide Perovskites for Photovoltaics journal, December 2014

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Electron-Hole Diffusion Lengths Exceeding 1 Micrometer in an Organometal Trihalide Perovskite Absorber journal, October 2013

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Structure and optical properties of high light output halide scintillators journal, October 2010

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Radiative efficiency of state-of-the-art photovoltaic cells journal, September 2011

Synthesis, structure, and electronic and physical properties of the two SrZrS3 modifications journal, September 2005

Sulphides with the GdFeO 3 structure journal, October 1980

Limits on the open-circuit voltage and efficiency of silicon solar cells imposed by intrinsic Auger processes journal, May 1984

Detailed Balance Limit of Efficiency of p‐n Junction Solar Cells journal, March 1961

Compositional engineering of perovskite materials for high-performance solar cells journal, January 2015

Unique Properties of Halide Perovskites as Possible Origins of the Superior Solar Cell Performance journal, May 2014

Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential journal, June 2009

High Charge Carrier Mobilities and Lifetimes in Organolead Trihalide Perovskites journal, December 2013

Magnetic and electrical properties of BaVS3 and BaVxTi1−xS3 journal, January 1979

Importance of non-parabolic band effects in the thermoelectric properties of semiconductors journal, November 2013

Synthesis of BaxTiSy in Sulfur Melt. journal, January 1999

Chalcogenide perovskites – an emerging class of ionic semiconductors
journal, April 2016

Strong Internal and External Luminescence as Solar Cells Approach the Shockley–Queisser Limit
journal, July 2012

Protons in Oxysulfides, Oxysulfates, and Sulfides: A First-Principles Study of La ₂ O ₂ S, La ₂ O ₂ SO ₄ , SrZrS ₃ , and BaZrS ₃
journal, October 2015

Effect of substituting of S for O: The sulfide perovskite ${BaZrS}_{3}$ investigated with density functional theory
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Merits and limits of the modified Becke-Johnson exchange potential
journal, May 2011

Synthesis of BaZrS3 by short time reaction at lower temperatures
journal, August 2001

Synthesis of BaZrS3 in the presence of excess sulfur
journal, October 2000

Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells
journal, May 2009

The synthesis and crystal structures of some alkaline earth titanium and zirconium sulfides
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Preparation and crystal structures of some complex sulphides at high pressures
journal, November 1988

Structural Evolutions in the Sr1−xBaxZrSe3Series
journal, April 1997

Connecting Thermoelectric Performance and Topological-Insulator Behavior: ${Bi}_{2} {Te}_{3}$ and ${Bi}_{2} {Te}_{2} Se$ from First Principles
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Perspective: n-type oxide thermoelectrics via visual search strategies
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Long-Range Balanced Electron- and Hole-Transport Lengths in Organic-Inorganic CH₃NH₃PbI₃
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Limits on the open-circuit voltage and efficiency of silicon solar cells imposed by intrinsic Auger processes
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journal, March 1961

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journal, May 2014

Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential
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journal, December 2013

Magnetic and electrical properties of BaVS3 and BaVxTi1−xS3
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