Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films

Woicik, J. C.; Shirley, E. L.; Gilmore, K.; Andersen, K. E.; Hellberg, C. Stephen

doi:10.1103/PhysRevB.96.104111

Title: Local structural distortions in strained ${Ba}_{0.5} {Sr}_{0.5} {TiO}_{3}$ thin films

Authors:: Woicik, J. C.; Shirley, E. L.; Gilmore, K.; Andersen, K. E.; Hellberg, C. Stephen

Publication Date:: Thu Sep 28 00:00:00 EDT 2017

Sponsoring Org.:: USDOE

OSTI Identifier:: 1395392

Grant/Contract Number:: AC02-98CH10886

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review B

Additional Journal Information:: Journal Name: Physical Review B Journal Volume: 96 Journal Issue: 10; Journal ID: ISSN 2469-9950

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

Citation Formats


                    Woicik, J. C., Shirley, E. L., Gilmore, K., Andersen, K. E., and Hellberg, C. Stephen. Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films.  United States: N. p., 2017. 
Web.  doi:10.1103/PhysRevB.96.104111.

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                    Woicik, J. C., Shirley, E. L., Gilmore, K., Andersen, K. E., & Hellberg, C. Stephen. Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films.  United States.  https://doi.org/10.1103/PhysRevB.96.104111

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                    Woicik, J. C., Shirley, E. L., Gilmore, K., Andersen, K. E., and Hellberg, C. Stephen. Thu .  
"Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films".  United States.  https://doi.org/10.1103/PhysRevB.96.104111.

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@article{osti_1395392,

  title        = {Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films},

  author       = {Woicik, J. C. and Shirley, E. L. and Gilmore, K. and Andersen, K. E. and Hellberg, C. Stephen},

  abstractNote = {},

  doi          = {10.1103/PhysRevB.96.104111},

  journal      = {Physical Review B},

  number       = 10,

  volume       = 96,

  place        = {United States},

  year         = {Thu Sep 28 00:00:00 EDT 2017},

  month        = {Thu Sep 28 00:00:00 EDT 2017}

}

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Works referenced in this record:

Pre-edge fine structure of the 3d atom K x-ray absorption spectra and quantitative atomic structure determinations for ferroelectric perovskite structure crystals
journal, October 1998

Vedrinskii, R. V.; Kraizman, V. L.; Novakovich, A. A.
Journal of Physics: Condensed Matter, Vol. 10, Issue 42
DOI: 10.1088/0953-8984/10/42/021

Room-temperature ferroelectricity in strained SrTiO₃
journal, August 2004

Haeni, J. H.; Irvin, P.; Chang, W.
Nature, Vol. 430, Issue 7001, p. 758-761
DOI: 10.1038/nature02773

Spectroscopic determination of phase in tetragonally strained Ba0.5Sr0.5TiO3 films at room temperature
journal, July 2007

Alldredge, L. M. B.; Woicik, J. C.; Chang, Wontae
Applied Physics Letters, Vol. 91, Issue 5
DOI: 10.1063/1.2766668

Generalized Gradient Approximation Made Simple
journal, October 1996

Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
DOI: 10.1103/PhysRevLett.77.3865

Observation of Nanoscale $180 °$ Stripe Domains in Ferroelectric ${P b T i O}_{3}$ Thin Films
journal, July 2002

Streiffer, S. K.; Eastman, J. A.; Fong, D. D.
Physical Review Letters, Vol. 89, Issue 6
DOI: 10.1103/PhysRevLett.89.067601

Applications of Modern Ferroelectrics
journal, February 2007

Scott, J. F.
Science, Vol. 315, Issue 5814
DOI: 10.1126/science.1129564

Projector augmented-wave method
journal, December 1994

Blöchl, P. E.
Physical Review B, Vol. 50, Issue 24, p. 17953-17979
DOI: 10.1103/PhysRevB.50.17953

Effect of Mechanical Boundary Conditions on Phase Diagrams of Epitaxial Ferroelectric Thin Films
journal, March 1998

Pertsev, N. A.; Zembilgotov, A. G.; Tagantsev, A. K.
Physical Review Letters, Vol. 80, Issue 9
DOI: 10.1103/PhysRevLett.80.1988

Core-hole effect on dipolar and quadrupolar transitions of $Sr Ti O_{3}$ and $Ba Ti O_{3}$ at Ti $K$ edge
journal, June 2005

Yamamoto, Tomoyuki; Mizoguchi, Teruyasu; Tanaka, Isao
Physical Review B, Vol. 71, Issue 24
DOI: 10.1103/PhysRevB.71.245113

Polarization rotation mechanism for ultrahigh electromechanical response in single-crystal piezoelectrics
journal, January 2000

Fu, Huaxiang; Cohen, Ronald E.
Nature, Vol. 403, Issue 6767
DOI: 10.1038/35002022

Erratum: First-Principles Study of Piezoelectricity in ${P b T i O}_{3}$ [Phys. Rev. Lett. 80, 004321 (1998)]
journal, February 2005

Wu, Zhigang; Sághi-Szabó, Gotthard; Cohen, Ronald E.
Physical Review Letters, Vol. 94, Issue 6
DOI: 10.1103/PhysRevLett.94.069901

Ferroelectricity at the Nanoscale: Local Polarization in Oxide Thin Films and Heterostructures
journal, January 2004

Ahn, C. H.
Science, Vol. 303, Issue 5657
DOI: 10.1126/science.1092508

Local structure determination in strained-layer semiconductors
journal, March 2014

Woicik, Joseph C.
Surface Science Reports, Vol. 69, Issue 1
DOI: 10.1016/j.surfrep.2013.12.002

Tunability of the dielectric response of epitaxially strained $SrTi O_{3}$ from first principles
journal, January 2005

Antons, Armin; Neaton, J. B.; Rabe, Karin M.
Physical Review B, Vol. 71, Issue 2
DOI: 10.1103/PhysRevB.71.024102

Local structure in perovskite $(Ba, Sr) {TiO}_{3}$ : Reverse Monte Carlo refinements from multiple measurement techniques
journal, January 2014

Levin, Igor; Krayzman, Victor; Woicik, Joseph C.
Physical Review B, Vol. 89, Issue 2
DOI: 10.1103/PhysRevB.89.024106

Bethe–Salpeter treatment of X-ray absorption including core-hole multiplet effects
journal, June 2005

Shirley, Eric L.
Journal of Electron Spectroscopy and Related Phenomena, Vol. 144-147
DOI: 10.1016/j.elspec.2005.01.191

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

Kresse, G.; Furthmüller, J.
Physical Review B, Vol. 54, Issue 16, p. 11169-11186
DOI: 10.1103/PhysRevB.54.11169

From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999

Kresse, G.; Joubert, D.
Physical Review B, Vol. 59, Issue 3, p. 1758-1775
DOI: 10.1103/PhysRevB.59.1758

Structural characterization of BaTiO3 thin films grown by molecular beam epitaxy
journal, March 1998

Yoneda, Yasuhiro; Okabe, Tooru; Sakaue, Kiyoshi
Journal of Applied Physics, Vol. 83, Issue 5
DOI: 10.1063/1.367006

Ab initio study of the phase diagram of epitaxial ${BaTiO}_{3}$
journal, June 2004

Diéguez, Oswaldo; Tinte, Silvia; Antons, A.
Physical Review B, Vol. 69, Issue 21
DOI: 10.1103/PhysRevB.69.212101

Character of Order-Disorder and Displacive Components in Barium Titanate
journal, July 2004

Stern, Edward A.
Physical Review Letters, Vol. 93, Issue 3
DOI: 10.1103/PhysRevLett.93.037601

Ultrahigh strain and piezoelectric behavior in relaxor based ferroelectric single crystals
journal, August 1997

Park, Seung-Eek; Shrout, Thomas R.
Journal of Applied Physics, Vol. 82, Issue 4
DOI: 10.1063/1.365983

NMR Evidence for the Coexistence of Order-Disorder and Displacive Components in Barium Titanate
journal, January 2003

Zalar, Boštjan; Laguta, Valentin V.; Blinc, Robert
Physical Review Letters, Vol. 90, Issue 3
DOI: 10.1103/PhysRevLett.90.037601

Stress induced shift of the Curie point in epitaxial PbTiO ₃ thin films
journal, November 1991

Rossetti, George A.; Cross, L. Eric; Kushida, Keiko
Applied Physics Letters, Vol. 59, Issue 20
DOI: 10.1063/1.105940

Structure of ${SrTiO}_{3}$ Films on Si
journal, April 2012

Hellberg, C. Stephen; Andersen, Kristopher E.; Li, Hao
Physical Review Letters, Vol. 108, Issue 16
DOI: 10.1103/PhysRevLett.108.166101

First-principles calculations of piezoelectricity and polarization rotation in $Pb ({Zr}_{0.5} {Ti}_{0.5}) O_{3}$
journal, July 2003

Wu, Zhigang; Krakauer, Henry
Physical Review B, Vol. 68, Issue 1
DOI: 10.1103/PhysRevB.68.014112

Unit cell of strained GeSi
journal, June 1997

Woicik, J. C.; Bouldin, C. E.; Miyano, K. E.
Physical Review B, Vol. 55, Issue 23
DOI: 10.1103/PhysRevB.55.15386

Physics of thin-film ferroelectric oxides
journal, October 2005

Dawber, M.; Rabe, K. M.; Scott, J. F.
Reviews of Modern Physics, Vol. 77, Issue 4
DOI: 10.1103/RevModPhys.77.1083

Angular dependence of X-ray absorption spectra
journal, January 1990

Brouder, C.
Journal of Physics: Condensed Matter, Vol. 2, Issue 3
DOI: 10.1088/0953-8984/2/3/018

Enhancement of Ferroelectricity in Strained BaTiO₃ Thin Films
journal, November 2004

Choi, K. J.; Biegalski, M.; Li, Y. L.
Science, Vol. 306, Issue 5698, p. 1005-1009
DOI: 10.1126/science.1103218

Ferroelectric distortion in ${SrTiO}_{3}$ thin films on $Si (001)$ by x-ray absorption fine structure spectroscopy: Experiment and first-principles calculations
journal, April 2007

Woicik, J. C.; Shirley, E. L.; Hellberg, C. S.
Physical Review B, Vol. 75, Issue 14
DOI: 10.1103/PhysRevB.75.140103

Effects of local atomic order on the pre-edge structure in the $Ti K$ x-ray absorption spectra of perovskite ${CaTi}_{1 - x} {Zr}_{x} O_{3}$
journal, December 2006

Krayzman, V.; Levin, I.; Woicik, J. C.
Physical Review B, Vol. 74, Issue 22
DOI: 10.1103/PhysRevB.74.224104

Epitaxially strained $[001] - ({PbTiO}_{3})_{1} ({PbZrO}_{3})_{1}$ superlattice and ${PbTiO}_{3}$ from first principles
journal, May 2004

Bungaro, Claudia; Rabe, K. M.
Physical Review B, Vol. 69, Issue 18
DOI: 10.1103/PhysRevB.69.184101

Local structure and the phase transitions of BaTiO ₃
journal, February 1998

Ravel, B.; Stern, E. A.; Vedrinskii, R. I.
Ferroelectrics, Vol. 206, Issue 1
DOI: 10.1080/00150199808009173

Local screening of a core hole: A real-space approach applied to hafnium oxide
journal, October 2006

Shirley, Eric L.
Ultramicroscopy, Vol. 106, Issue 11-12
DOI: 10.1016/j.ultramic.2006.05.008

Phase diagrams and physical properties of single-domain epitaxial $Pb ({Zr}_{1 - x} {Ti}_{x}) O_{3}$ thin films
journal, February 2003

Pertsev, N. A.; Kukhar, V. G.; Kohlstedt, H.
Physical Review B, Vol. 67, Issue 5
DOI: 10.1103/PhysRevB.67.054107

Structures of the ferroelectric phases of barium titanate
journal, March 1993

Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.
The Journal of Physical Chemistry, Vol. 97, Issue 10
DOI: 10.1021/j100112a043

First-principles study of epitaxial strain in perovskites
journal, October 2005

Diéguez, Oswaldo; Rabe, Karin M.; Vanderbilt, David
Physical Review B, Vol. 72, Issue 14
DOI: 10.1103/PhysRevB.72.144101

Ti 1s pre-edge features in rutile: a Bethe-Salpeter calculation
journal, May 2004

Shirley, Eric L.
Journal of Electron Spectroscopy and Related Phenomena, Vol. 136, Issue 1-2
DOI: 10.1016/j.elspec.2004.02.134

Strain Tuning of Ferroelectric Thin Films
journal, August 2007

Schlom, Darrell G.; Chen, Long-Qing; Eom, Chang-Beom
Annual Review of Materials Research, Vol. 37, Issue 1
DOI: 10.1146/annurev.matsci.37.061206.113016

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Title: Local structural distortions in strained Ba 0.5 Sr 0.5 TiO 3 thin films

Citation Formats

Pre-edge fine structure of the 3d atom K x-ray absorption spectra and quantitative atomic structure determinations for ferroelectric perovskite structure crystals journal, October 1998

Room-temperature ferroelectricity in strained SrTiO3 journal, August 2004

Spectroscopic determination of phase in tetragonally strained Ba0.5Sr0.5TiO3 films at room temperature journal, July 2007

Generalized Gradient Approximation Made Simple journal, October 1996

Observation of Nanoscale 180 ° Stripe Domains in Ferroelectric P b T i O 3 Thin Films journal, July 2002

Applications of Modern Ferroelectrics journal, February 2007

Projector augmented-wave method journal, December 1994

Effect of Mechanical Boundary Conditions on Phase Diagrams of Epitaxial Ferroelectric Thin Films journal, March 1998

Core-hole effect on dipolar and quadrupolar transitions of Sr Ti O 3 and Ba Ti O 3 at Ti K edge journal, June 2005

Polarization rotation mechanism for ultrahigh electromechanical response in single-crystal piezoelectrics journal, January 2000

Erratum: First-Principles Study of Piezoelectricity in P b T i O 3 [Phys. Rev. Lett. 80, 004321 (1998)] journal, February 2005

Ferroelectricity at the Nanoscale: Local Polarization in Oxide Thin Films and Heterostructures journal, January 2004

Local structure determination in strained-layer semiconductors journal, March 2014

Tunability of the dielectric response of epitaxially strained SrTi O 3 from first principles journal, January 2005

Local structure in perovskite ( Ba , Sr ) TiO 3 : Reverse Monte Carlo refinements from multiple measurement techniques journal, January 2014

Bethe–Salpeter treatment of X-ray absorption including core-hole multiplet effects journal, June 2005

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

From ultrasoft pseudopotentials to the projector augmented-wave method journal, January 1999

Structural characterization of BaTiO3 thin films grown by molecular beam epitaxy journal, March 1998

Ab initio study of the phase diagram of epitaxial BaTiO 3 journal, June 2004

Character of Order-Disorder and Displacive Components in Barium Titanate journal, July 2004

Ultrahigh strain and piezoelectric behavior in relaxor based ferroelectric single crystals journal, August 1997

NMR Evidence for the Coexistence of Order-Disorder and Displacive Components in Barium Titanate journal, January 2003

Stress induced shift of the Curie point in epitaxial PbTiO 3 thin films journal, November 1991

Structure of SrTiO 3 Films on Si journal, April 2012

First-principles calculations of piezoelectricity and polarization rotation in Pb ( Zr 0.5 Ti 0.5 ) O 3 journal, July 2003

Unit cell of strained GeSi journal, June 1997

Physics of thin-film ferroelectric oxides journal, October 2005

Angular dependence of X-ray absorption spectra journal, January 1990

Enhancement of Ferroelectricity in Strained BaTiO3 Thin Films journal, November 2004

Ferroelectric distortion in SrTiO 3 thin films on Si ( 001 ) by x-ray absorption fine structure spectroscopy: Experiment and first-principles calculations journal, April 2007

Effects of local atomic order on the pre-edge structure in the Ti K x-ray absorption spectra of perovskite CaTi 1 − x Zr x O 3 journal, December 2006

Epitaxially strained [ 001 ] − ( PbTiO 3 ) 1 ( PbZrO 3 ) 1 superlattice and PbTiO 3 from first principles journal, May 2004

Local structure and the phase transitions of BaTiO 3 journal, February 1998

Local screening of a core hole: A real-space approach applied to hafnium oxide journal, October 2006

Phase diagrams and physical properties of single-domain epitaxial Pb ( Zr 1 − x Ti x ) O 3 thin films journal, February 2003

Structures of the ferroelectric phases of barium titanate journal, March 1993

First-principles study of epitaxial strain in perovskites journal, October 2005

Ti 1s pre-edge features in rutile: a Bethe-Salpeter calculation journal, May 2004

Strain Tuning of Ferroelectric Thin Films journal, August 2007

Title: Local structural distortions in strained ${Ba}_{0.5} {Sr}_{0.5} {TiO}_{3}$ thin films

Pre-edge fine structure of the 3d atom K x-ray absorption spectra and quantitative atomic structure determinations for ferroelectric perovskite structure crystals
journal, October 1998

Room-temperature ferroelectricity in strained SrTiO₃
journal, August 2004

Spectroscopic determination of phase in tetragonally strained Ba0.5Sr0.5TiO3 films at room temperature
journal, July 2007

Generalized Gradient Approximation Made Simple
journal, October 1996

Observation of Nanoscale $180 °$ Stripe Domains in Ferroelectric ${P b T i O}_{3}$ Thin Films
journal, July 2002

Applications of Modern Ferroelectrics
journal, February 2007

Projector augmented-wave method
journal, December 1994

Effect of Mechanical Boundary Conditions on Phase Diagrams of Epitaxial Ferroelectric Thin Films
journal, March 1998

Core-hole effect on dipolar and quadrupolar transitions of $Sr Ti O_{3}$ and $Ba Ti O_{3}$ at Ti $K$ edge
journal, June 2005

Polarization rotation mechanism for ultrahigh electromechanical response in single-crystal piezoelectrics
journal, January 2000

Erratum: First-Principles Study of Piezoelectricity in ${P b T i O}_{3}$ [Phys. Rev. Lett. 80, 004321 (1998)]
journal, February 2005

Ferroelectricity at the Nanoscale: Local Polarization in Oxide Thin Films and Heterostructures
journal, January 2004

Local structure determination in strained-layer semiconductors
journal, March 2014

Tunability of the dielectric response of epitaxially strained $SrTi O_{3}$ from first principles
journal, January 2005

Local structure in perovskite $(Ba, Sr) {TiO}_{3}$ : Reverse Monte Carlo refinements from multiple measurement techniques
journal, January 2014

Bethe–Salpeter treatment of X-ray absorption including core-hole multiplet effects
journal, June 2005

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

From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999

Structural characterization of BaTiO3 thin films grown by molecular beam epitaxy
journal, March 1998

Ab initio study of the phase diagram of epitaxial ${BaTiO}_{3}$
journal, June 2004

Character of Order-Disorder and Displacive Components in Barium Titanate
journal, July 2004

Ultrahigh strain and piezoelectric behavior in relaxor based ferroelectric single crystals
journal, August 1997

NMR Evidence for the Coexistence of Order-Disorder and Displacive Components in Barium Titanate
journal, January 2003

Stress induced shift of the Curie point in epitaxial PbTiO ₃ thin films
journal, November 1991

Structure of ${SrTiO}_{3}$ Films on Si
journal, April 2012

First-principles calculations of piezoelectricity and polarization rotation in $Pb ({Zr}_{0.5} {Ti}_{0.5}) O_{3}$
journal, July 2003

Unit cell of strained GeSi
journal, June 1997

Physics of thin-film ferroelectric oxides
journal, October 2005

Angular dependence of X-ray absorption spectra
journal, January 1990

Enhancement of Ferroelectricity in Strained BaTiO₃ Thin Films
journal, November 2004

Ferroelectric distortion in ${SrTiO}_{3}$ thin films on $Si (001)$ by x-ray absorption fine structure spectroscopy: Experiment and first-principles calculations
journal, April 2007

Effects of local atomic order on the pre-edge structure in the $Ti K$ x-ray absorption spectra of perovskite ${CaTi}_{1 - x} {Zr}_{x} O_{3}$
journal, December 2006

Epitaxially strained $[001] - ({PbTiO}_{3})_{1} ({PbZrO}_{3})_{1}$ superlattice and ${PbTiO}_{3}$ from first principles
journal, May 2004

Local structure and the phase transitions of BaTiO ₃
journal, February 1998

Local screening of a core hole: A real-space approach applied to hafnium oxide
journal, October 2006

Phase diagrams and physical properties of single-domain epitaxial $Pb ({Zr}_{1 - x} {Ti}_{x}) O_{3}$ thin films
journal, February 2003

Structures of the ferroelectric phases of barium titanate
journal, March 1993

First-principles study of epitaxial strain in perovskites
journal, October 2005

Ti 1s pre-edge features in rutile: a Bethe-Salpeter calculation
journal, May 2004

Strain Tuning of Ferroelectric Thin Films
journal, August 2007