Large isotropic negative thermal expansion above a structural quantum phase transition

Handunkanda, Sahan U.; Curry, Erin B.; Voronov, Vladimir; Said, Ayman H.; Guzmán-Verri, Gian G.; Brierley, Richard T.; Littlewood, Peter B.; Hancock, Jason N.

doi:10.1103/PhysRevB.92.134101

Title: Large isotropic negative thermal expansion above a structural quantum phase transition

Authors:: Handunkanda, Sahan U.; Curry, Erin B.; Voronov, Vladimir; Said, Ayman H.; Guzmán-Verri, Gian G.; Brierley, Richard T.; Littlewood, Peter B.; Hancock, Jason N.

Publication Date:: 2015-10-01

Sponsoring Org.:: USDOE

OSTI Identifier:: 1222518

Grant/Contract Number:: AC02-06CH11357

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review B

Additional Journal Information:: Journal Name: Physical Review B Journal Volume: 92 Journal Issue: 13; Journal ID: ISSN 1098-0121

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

Citation Formats


                    Handunkanda, Sahan U., Curry, Erin B., Voronov, Vladimir, Said, Ayman H., Guzmán-Verri, Gian G., Brierley, Richard T., Littlewood, Peter B., and Hancock, Jason N. Large isotropic negative thermal expansion above a structural quantum phase transition.  United States: N. p., 2015. 
        Web.  doi:10.1103/PhysRevB.92.134101.

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                    Handunkanda, Sahan U., Curry, Erin B., Voronov, Vladimir, Said, Ayman H., Guzmán-Verri, Gian G., Brierley, Richard T., Littlewood, Peter B., & Hancock, Jason N. Large isotropic negative thermal expansion above a structural quantum phase transition.  United States.  doi:https://doi.org/10.1103/PhysRevB.92.134101

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                    Handunkanda, Sahan U., Curry, Erin B., Voronov, Vladimir, Said, Ayman H., Guzmán-Verri, Gian G., Brierley, Richard T., Littlewood, Peter B., and Hancock, Jason N. Thu .  
        "Large isotropic negative thermal expansion above a structural quantum phase transition".  United States.  doi:https://doi.org/10.1103/PhysRevB.92.134101.

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@article{osti_1222518,

  title        = {Large isotropic negative thermal expansion above a structural quantum phase transition},

  author       = {Handunkanda, Sahan U. and Curry, Erin B. and Voronov, Vladimir and Said, Ayman H. and Guzmán-Verri, Gian G. and Brierley, Richard T. and Littlewood, Peter B. and Hancock, Jason N.},

  abstractNote = {},

  doi          = {10.1103/PhysRevB.92.134101},

  journal      = {Physical Review B},

  number       = 13,

  volume       = 92,

  place        = {United States},

  year         = {2015},

  month        = {10}

}

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DOI: https://doi.org/10.1103/PhysRevB.92.134101

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Works referenced in this record:

Two Decades of Negative Thermal Expansion Research: Where Do We Stand?
journal, June 2012

Lind, Cora
Materials, Vol. 5, Issue 12
DOI: 10.3390/ma5061125

Solid solubility, phase transitions, thermal expansion, and compressibility in Sc1−Al F3
journal, February 2015

Morelock, Cody R.; Gallington, Leighanne C.; Wilkinson, Angus P.
Journal of Solid State Chemistry, Vol. 222
DOI: 10.1016/j.jssc.2014.11.007

Structure–property relations in doped perovskite oxides
journal, December 2001

Attfield, J. P.
International Journal of Inorganic Materials, Vol. 3, Issue 8
DOI: 10.1016/S1466-6049(01)00110-6

The heat capacities of thermomiotic ScF3 and ScF3–YF3 solid solutions
journal, February 2015

Romao, Carl P.; Morelock, Cody R.; Johnson, Michel B.
Journal of Materials Science, Vol. 50, Issue 9
DOI: 10.1007/s10853-015-8899-y

Pressure-induced elastic softening of monocrystalline zirconium tungstate at $300 K$
journal, June 2006

Pantea, C.; Migliori, A.; Littlewood, P. B.
Physical Review B, Vol. 73, Issue 21
DOI: 10.1103/PhysRevB.73.214118

Structural Phase Transitions
journal, November 2006

A. Cowley, R.; M. Shapiro, S.
Journal of the Physical Society of Japan, Vol. 75, Issue 11
DOI: 10.1143/JPSJ.75.111001

Evolution of Negative Thermal Expansion and Phase Transitions in Sc _1-x Ti _x F ₃
journal, February 2014

Morelock, Cody R.; Gallington, Leighanne C.; Wilkinson, Angus P.
Chemistry of Materials, Vol. 26, Issue 5
DOI: 10.1021/cm5002048

Negative thermal expansion and compressibility of Sc _1– _x Y _x F ₃ (x≤0.25)
journal, December 2013

Morelock, Cody R.; Greve, Benjamin K.; Gallington, Leighanne C.
Journal of Applied Physics, Vol. 114, Issue 21
DOI: 10.1063/1.4836855

Critical behaviour of SrTiO3 near the 105°K phase transition
journal, September 1971

Riste, T.; Samuelsen, E. J.; Otnes, K.
Solid State Communications, Vol. 9, Issue 17
DOI: 10.1016/0038-1098(71)90155-4

Dynamics and statistical mechanics of a one-dimensional model Hamiltonian for structural phase transitions
journal, May 1975

Krumhansl, J. A.; Schrieffer, J. R.
Physical Review B, Vol. 11, Issue 9
DOI: 10.1103/PhysRevB.11.3535

New developments in fabrication of high-energy-resolution analyzers for inelastic X-ray spectroscopy
journal, March 2011

Said, Ayman H.; Sinn, Harald; Divan, Ralu
Journal of Synchrotron Radiation, Vol. 18, Issue 3
DOI: 10.1107/S0909049511001828

Structure and lattice dynamics of the high-pressure phase in the ScF3 crystal
journal, March 2011

Aleksandrov, K. S.; Voronov, N. V.; Vtyurin, A. N.
Physics of the Solid State, Vol. 53, Issue 3
DOI: 10.1134/S1063783411030036

Structural Relationship between Negative Thermal Expansion and Quartic Anharmonicity of Cubic ${ScF}_{3}$
journal, November 2011

Li, Chen W.; Tang, Xiaoli; Muñoz, J. A.
Physical Review Letters, Vol. 107, Issue 19
DOI: 10.1103/PhysRevLett.107.195504

Pronounced Negative Thermal Expansion from a Simple Structure: Cubic ScF ₃
journal, November 2010

Greve, Benjamin K.; Martin, Kenneth L.; Lee, Peter L.
Journal of the American Chemical Society, Vol. 132, Issue 44
DOI: 10.1021/ja106711v

Octahedral tilt instability of ${ReO}_{3}$ -type crystals
journal, May 2006

Allen, Philip B.; Chen, Yiing-Rei; Chaudhuri, Santanu
Physical Review B, Vol. 73, Issue 17
DOI: 10.1103/PhysRevB.73.172102

Magnetostriction in a simple trivalent manganese perovskite
journal, January 2004

Hunter, Brett A.; Kennedy, Brendan J.; Vogt, Tom
Physical Review B, Vol. 69, Issue 2
DOI: 10.1103/PhysRevB.69.020410

Quantum Critical Elasticity
journal, July 2015

Zacharias, Mario; Paul, Indranil; Garst, Markus
Physical Review Letters, Vol. 115, Issue 2
DOI: 10.1103/PhysRevLett.115.025703

Study of the Nature and Mechanism of the Rhombohedral-to-Cubic Phase Transition in α-AlF ₃ with Molecular Dynamics Simulations
journal, March 2004

Chaudhuri, Santanu; Chupas, Peter J.; Wilson, Mark
The Journal of Physical Chemistry B, Vol. 108, Issue 11
DOI: 10.1021/jp034533g

Negative thermal expansion materials: technological key for control of thermal expansion
journal, February 2012

Takenaka, Koshi
Science and Technology of Advanced Materials, Vol. 13, Issue 1
DOI: 10.1088/1468-6996/13/1/013001

Ferroelectric quantum criticality
journal, March 2014

Rowley, S. E.; Spalek, L. J.; Smith, R. P.
Nature Physics, Vol. 10, Issue 5
DOI: 10.1038/nphys2924

Structural phase transitions I. Landau theory
journal, February 1980

Cowley, R. A.
Advances in Physics, Vol. 29, Issue 1
DOI: 10.1080/00018738000101346

Critical Neutron Scattering in SrTi $O_{3}$ and KMn $F_{3}$
journal, December 1972

Shapiro, S. M.; Axe, J. D.; Shirane, G.
Physical Review B, Vol. 6, Issue 11
DOI: 10.1103/PhysRevB.6.4332

Ferroelastic properties of TF3 compounds (T = Ti, V, Cr, Fe, Ga)
journal, January 1985

Mogus-Milankovic, A.; Ravez, J.; Chaminade, J. P.
Materials Research Bulletin, Vol. 20, Issue 1
DOI: 10.1016/0025-5408(85)90021-2

Pressure-induced phase transition in the cubic ScF3 crystal
journal, April 2009

Aleksandrov, K. S.; Voronov, V. N.; Vtyurin, A. N.
Physics of the Solid State, Vol. 51, Issue 4
DOI: 10.1134/S1063783409040295

The role of static disorder in negative thermal expansion in ReO3
journal, June 2009

Rodriguez, Efrain E.; Llobet, Anna; Proffen, Thomas
Journal of Applied Physics, Vol. 105, Issue 11
DOI: 10.1063/1.3120783

Raman-scattering study of crystallized M $F_{3}$ compounds ( M =Al,Cr,Ga,V,Fe,In): An approach to the short-range-order force constants
journal, December 1990

Daniel, P.; Bulou, A.; Rousseau, M.
Physical Review B, Vol. 42, Issue 16
DOI: 10.1103/PhysRevB.42.10545

Cation disorder and size effects in magnetoresistive manganese oxide perovskites
journal, December 1996

Rodriguez-Martinez, Lide M.; Attfield, J. Paul
Physical Review B, Vol. 54, Issue 22
DOI: 10.1103/PhysRevB.54.R15622

Why Are There So Few Perovskite Ferroelectrics?
journal, May 2013

Benedek, Nicole A.; Fennie, Craig J.
The Journal of Physical Chemistry C, Vol. 117, Issue 26
DOI: 10.1021/jp402046t

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Title: Large isotropic negative thermal expansion above a structural quantum phase transition

Citation Formats

Two Decades of Negative Thermal Expansion Research: Where Do We Stand? journal, June 2012

Solid solubility, phase transitions, thermal expansion, and compressibility in Sc1−Al F3 journal, February 2015

Structure–property relations in doped perovskite oxides journal, December 2001

The heat capacities of thermomiotic ScF3 and ScF3–YF3 solid solutions journal, February 2015

Pressure-induced elastic softening of monocrystalline zirconium tungstate at 300 K journal, June 2006

Structural Phase Transitions journal, November 2006

Evolution of Negative Thermal Expansion and Phase Transitions in Sc 1-x Ti x F 3 journal, February 2014

Negative thermal expansion and compressibility of Sc 1– x Y x F 3 (x≤0.25) journal, December 2013

Critical behaviour of SrTiO3 near the 105°K phase transition journal, September 1971

Dynamics and statistical mechanics of a one-dimensional model Hamiltonian for structural phase transitions journal, May 1975

New developments in fabrication of high-energy-resolution analyzers for inelastic X-ray spectroscopy journal, March 2011

Structure and lattice dynamics of the high-pressure phase in the ScF3 crystal journal, March 2011

Structural Relationship between Negative Thermal Expansion and Quartic Anharmonicity of Cubic ScF 3 journal, November 2011

Pronounced Negative Thermal Expansion from a Simple Structure: Cubic ScF 3 journal, November 2010

Octahedral tilt instability of ReO 3 -type crystals journal, May 2006

Magnetostriction in a simple trivalent manganese perovskite journal, January 2004

Quantum Critical Elasticity journal, July 2015

Study of the Nature and Mechanism of the Rhombohedral-to-Cubic Phase Transition in α-AlF 3 with Molecular Dynamics Simulations journal, March 2004

Negative thermal expansion materials: technological key for control of thermal expansion journal, February 2012

Ferroelectric quantum criticality journal, March 2014

Structural phase transitions I. Landau theory journal, February 1980

Critical Neutron Scattering in SrTi O 3 and KMn F 3 journal, December 1972

Ferroelastic properties of TF3 compounds (T = Ti, V, Cr, Fe, Ga) journal, January 1985

Pressure-induced phase transition in the cubic ScF3 crystal journal, April 2009

The role of static disorder in negative thermal expansion in ReO3 journal, June 2009

Raman-scattering study of crystallized M F 3 compounds ( M =Al,Cr,Ga,V,Fe,In): An approach to the short-range-order force constants journal, December 1990

Cation disorder and size effects in magnetoresistive manganese oxide perovskites journal, December 1996

Why Are There So Few Perovskite Ferroelectrics? journal, May 2013

Two Decades of Negative Thermal Expansion Research: Where Do We Stand?
journal, June 2012

Solid solubility, phase transitions, thermal expansion, and compressibility in Sc1−Al F3
journal, February 2015

Structure–property relations in doped perovskite oxides
journal, December 2001

The heat capacities of thermomiotic ScF3 and ScF3–YF3 solid solutions
journal, February 2015

Pressure-induced elastic softening of monocrystalline zirconium tungstate at $300 K$
journal, June 2006

Structural Phase Transitions
journal, November 2006

Evolution of Negative Thermal Expansion and Phase Transitions in Sc _1-x Ti _x F ₃
journal, February 2014

Negative thermal expansion and compressibility of Sc _1– _x Y _x F ₃ (x≤0.25)
journal, December 2013

Critical behaviour of SrTiO3 near the 105°K phase transition
journal, September 1971

Dynamics and statistical mechanics of a one-dimensional model Hamiltonian for structural phase transitions
journal, May 1975

New developments in fabrication of high-energy-resolution analyzers for inelastic X-ray spectroscopy
journal, March 2011

Structure and lattice dynamics of the high-pressure phase in the ScF3 crystal
journal, March 2011

Structural Relationship between Negative Thermal Expansion and Quartic Anharmonicity of Cubic ${ScF}_{3}$
journal, November 2011

Pronounced Negative Thermal Expansion from a Simple Structure: Cubic ScF ₃
journal, November 2010

Octahedral tilt instability of ${ReO}_{3}$ -type crystals
journal, May 2006

Magnetostriction in a simple trivalent manganese perovskite
journal, January 2004

Quantum Critical Elasticity
journal, July 2015

Study of the Nature and Mechanism of the Rhombohedral-to-Cubic Phase Transition in α-AlF ₃ with Molecular Dynamics Simulations
journal, March 2004

Negative thermal expansion materials: technological key for control of thermal expansion
journal, February 2012

Ferroelectric quantum criticality
journal, March 2014

Structural phase transitions I. Landau theory
journal, February 1980

Critical Neutron Scattering in SrTi $O_{3}$ and KMn $F_{3}$
journal, December 1972

Ferroelastic properties of TF3 compounds (T = Ti, V, Cr, Fe, Ga)
journal, January 1985

Pressure-induced phase transition in the cubic ScF3 crystal
journal, April 2009

The role of static disorder in negative thermal expansion in ReO3
journal, June 2009

Raman-scattering study of crystallized M $F_{3}$ compounds ( M =Al,Cr,Ga,V,Fe,In): An approach to the short-range-order force constants
journal, December 1990

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journal, December 1996

Why Are There So Few Perovskite Ferroelectrics?
journal, May 2013