Alloy-Free Band Gap Tuning across the Visible Spectrum

Makin, Robert A.; York, Krystal; Durbin, Steven M.; Senabulya, Nancy; Mathis, James; Clarke, Roy; Feldberg, Nathaniel; Miska, Patrice; Jones, Christina M.; Deng, Zihao; Williams, Logan; Kioupakis, Emmanouil; Reeves, Roger J.

doi:10.1103/PhysRevLett.122.256403

Title: Alloy-Free Band Gap Tuning across the Visible Spectrum

Authors:

; York, Krystal; Durbin, Steven M.; Senabulya, Nancy; Mathis, James; Clarke, Roy; Feldberg, Nathaniel; Miska, Patrice; Jones, Christina M.; Deng, Zihao; Williams, Logan; Kioupakis, Emmanouil; Reeves, Roger J.

Publication Date:: Thu Jun 27 00:00:00 EDT 2019

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

OSTI Identifier:: 1529704

Grant/Contract Number:: DEAC0205CH11231; FG02-94ER14466; AC02-06CH11357

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review Letters

Additional Journal Information:: Journal Name: Physical Review Letters Journal Volume: 122 Journal Issue: 25; Journal ID: ISSN 0031-9007

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

Citation Formats


                    Makin, Robert A., York, Krystal, Durbin, Steven M., Senabulya, Nancy, Mathis, James, Clarke, Roy, Feldberg, Nathaniel, Miska, Patrice, Jones, Christina M., Deng, Zihao, Williams, Logan, Kioupakis, Emmanouil, and Reeves, Roger J. Alloy-Free Band Gap Tuning across the Visible Spectrum.  United States: N. p., 2019. 
Web.  doi:10.1103/PhysRevLett.122.256403.

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                    Makin, Robert A., York, Krystal, Durbin, Steven M., Senabulya, Nancy, Mathis, James, Clarke, Roy, Feldberg, Nathaniel, Miska, Patrice, Jones, Christina M., Deng, Zihao, Williams, Logan, Kioupakis, Emmanouil, & Reeves, Roger J. Alloy-Free Band Gap Tuning across the Visible Spectrum.  United States.  https://doi.org/10.1103/PhysRevLett.122.256403

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                    Makin, Robert A., York, Krystal, Durbin, Steven M., Senabulya, Nancy, Mathis, James, Clarke, Roy, Feldberg, Nathaniel, Miska, Patrice, Jones, Christina M., Deng, Zihao, Williams, Logan, Kioupakis, Emmanouil, and Reeves, Roger J. Thu .  
"Alloy-Free Band Gap Tuning across the Visible Spectrum".  United States.  https://doi.org/10.1103/PhysRevLett.122.256403.

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@article{osti_1529704,

  title        = {Alloy-Free Band Gap Tuning across the Visible Spectrum},

  author       = {Makin, Robert A. and York, Krystal and Durbin, Steven M. and Senabulya, Nancy and Mathis, James and Clarke, Roy and Feldberg, Nathaniel and Miska, Patrice and Jones, Christina M. and Deng, Zihao and Williams, Logan and Kioupakis, Emmanouil and Reeves, Roger J.},

  abstractNote = {},

  doi          = {10.1103/PhysRevLett.122.256403},

  journal      = {Physical Review Letters},

  number       = 25,

  volume       = 122,

  place        = {United States},

  year         = {Thu Jun 27 00:00:00 EDT 2019},

  month        = {Thu Jun 27 00:00:00 EDT 2019}

}

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Title: Alloy-Free Band Gap Tuning across the Visible Spectrum

Citation Formats

Generalized Gradient Approximation Made Simple journal, October 1996

Order–Disorder Phenomena and Their Effects on Bandgap in ZnSnP 2 journal, January 2017

First-principles calculation of the order-disorder transition in chalcopyrite semiconductors journal, February 1992

Vibrational modes in ZnGeN 2 : Raman study and theory journal, June 2008

Band alignment and p -type doping of ZnSnN 2 journal, May 2017

Hybrid functionals based on a screened Coulomb potential journal, May 2003

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Electronic band structure of Mg − IV − N 2 compounds in the quasiparticle-self-consistent G W approximation journal, September 2016

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Monte Carlo simulations of disorder in ZnSn N 2 and the effects on the electronic structure journal, August 2017

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Long‐Range Order in Beta‐Brass and Cu 3 Au journal, March 1951

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal, October 1996

Theory of the optical properties of phonon systems with disordered force constants, with application to NH4Cl journal, May 1973

Synthesis and Properties of ZnGeN[sub 2] journal, January 1974

Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium journal, May 1994

Band Theory for Ground-State Properties and Excitation Spectra of Perovskite La M O 3 ( M = Mn, Fe, Co, Ni) journal, August 1995

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Origin of the failed ensemble average rule for the band gaps of disordered nonisovalent semiconductor alloys journal, September 2014

Generalized Gradient Approximation Made Simple
journal, October 1996

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journal, January 2017

First-principles calculation of the order-disorder transition in chalcopyrite semiconductors
journal, February 1992

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journal, June 2008

Band alignment and $p$ -type doping of ${ZnSnN}_{2}$
journal, May 2017

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journal, May 2003

Prospective investigations of orthorhombic ZnGeN2: synthesis, lattice dynamics and optical properties
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journal, September 2016

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journal, October 2011

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journal, April 1993

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journal, December 2004

Growth of ordered and disordered ZnSnN ₂
journal, March 2017

Order-disorder phenomenon in sodium nitrate studied by low-frequency Raman scattering
journal, November 1975

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journal, January 1993

Synthesis and characterization of ZnGeN2 grown from elemental Zn and Ge sources
journal, March 2008

Direct Observation of Electrostatically Driven Band Gap Renormalization in a Degenerate Perovskite Transparent Conducting Oxide
journal, January 2016

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journal, September 2013

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journal, October 2013

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journal, July 2013

X‐Ray Measurement of Order in the Alloy Cu ₃ Au
journal, December 1944

Structural and electronic properties of MgGe _x Sn _{(1- x )} N ₂ semiconductors: The density functional theory investigation
journal, December 2018

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journal, December 1992

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996

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Long‐Range Order in Beta‐Brass and Cu ₃ Au
journal, March 1951

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
journal, October 1996

Theory of the optical properties of phonon systems with disordered force constants, with application to NH4Cl
journal, May 1973

Synthesis and Properties of ZnGeN[sub 2]
journal, January 1974

Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
journal, May 1994

Band Theory for Ground-State Properties and Excitation Spectra of Perovskite $La M O_{3}$ ( $M =$ Mn, Fe, Co, Ni)
journal, August 1995

Band Gap and Edge Engineering via Ferroic Distortion and Anisotropic Strain: The Case of ${SrTiO}_{3}$
journal, September 2011

Synthesis and Characterization of Nanostructured Wurtzite CuInS ₂ : A New Cation Disordered Polymorph of CuInS ₂
journal, February 2009

Special quasirandom structures
journal, July 1990

Growth of CuGaS ₂ Single Crystals by Chemical Vapor Transport and Characterization
journal, April 2007

Structural and Optoelectronic Characterization of RF Sputtered ZnSnN ₂
journal, February 2013

X‐Ray Measurement of Order in Single Crystals of Cu ₃ Au
journal, January 1950

Effects of Electronic and Lattice Polarization on the Band Structure of Delafossite Transparent Conductive Oxides
journal, March 2010

Stabilization of orthorhombic phase in single-crystal ZnSnN ₂ films
journal, July 2016

Charge-neutral disorder and polytypes in heterovalent wurtzite-based ternary semiconductors: The importance of the octet rule
journal, May 2015

Vapor-liquid-solid synthesis of ZnSnN ₂ : Vapor-liquid-solid synthesis of ZnSnN
journal, March 2017

Semiconducting ZnSnN ₂ thin films for Si/ZnSnN ₂ p-n junctions
journal, April 2016

Synthesis of ZnSnN ₂ crystals via a high-pressure metathesis reaction : Synthesis of ZnSnN
journal, February 2016

Origin of the failed ensemble average rule for the band gaps of disordered nonisovalent semiconductor alloys
journal, September 2014