Correlation between temperature variations of static and dynamic properties in glass-forming liquids

Voylov, D. N.; Griffin, P. J.; Mercado, B.; Keum, J. K.; Nakanishi, M.; Novikov, V. N.; Sokolov, A. P.

doi:10.1103/PhysRevE.94.060603

Title: Correlation between temperature variations of static and dynamic properties in glass-forming liquids

Abstract

In this detailed analysis of the static structure factor S(Q) in several glass-forming liquids we show that the temperature variations of the width of the main diffraction peak Q(T ) correlate with the fragility of these liquids. Our observation suggests a direct connection between rather subtle structural changes and sharp slowing down of structural relaxation in glass-forming liquids. We also show that this observation can be rationalized using the Adam-Gibbs approach, through a connection between temperature variations of structural correlation length, lc 2 /Q, and the size of cooperatively rearranging regions.

Authors:

Voylov, D. N. ^[1]; Griffin, P. J. ^[2]; Mercado, B. ^[3]; Keum, J. K. ^[4]; Nakanishi, M. ^[5]; Novikov, V. N. ^[1]; Sokolov, A. P. ^[1]; Oak Ridge National Lab. ^[6]

Univ. of Tennessee, Knoxville, TN (United States). Dept. of Chemistry
Univ. of Pennsylvania, Philadelphia, PA (United States). Dept. of Materials Science and Engineering
Yale Univ., New Haven, CT (United States). Chemistry Dept.
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Spallation Neutron Source
Fukuoka Inst. of Technology (Japan). Dept. of Electrical Engineering
(ORNL), Oak Ridge, TN (United States). Chemical Sciences Division

Publication Date:: Thu Dec 29 00:00:00 EST 2016

Research Org.:: Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Spallation Neutron Source (SNS)

Sponsoring Org.:: USDOE; National Science Foundation (NSF)

OSTI Identifier:: 1347331

Grant/Contract Number:: AC05-00OR22725; DMR-1408811

Resource Type:: Accepted Manuscript

Journal Name:: Physical Review E

Additional Journal Information:: Journal Volume: 94; Journal Issue: 6; Journal ID: ISSN 2470-0045

Publisher:: American Physical Society (APS)

Country of Publication:: United States

Language:: English

Subject:: 36 MATERIALS SCIENCE

Citation Formats


                    Voylov, D. N., Griffin, P. J., Mercado, B., Keum, J. K., Nakanishi, M., Novikov, V. N., Sokolov, A. P., and Oak Ridge National Lab. Correlation between temperature variations of static and dynamic properties in glass-forming liquids.  United States: N. p., 2016. 
Web.  doi:10.1103/PhysRevE.94.060603.

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                    Voylov, D. N., Griffin, P. J., Mercado, B., Keum, J. K., Nakanishi, M., Novikov, V. N., Sokolov, A. P., & Oak Ridge National Lab. Correlation between temperature variations of static and dynamic properties in glass-forming liquids.  United States.  https://doi.org/10.1103/PhysRevE.94.060603

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                    Voylov, D. N., Griffin, P. J., Mercado, B., Keum, J. K., Nakanishi, M., Novikov, V. N., Sokolov, A. P., and Oak Ridge National Lab. Thu .  
"Correlation between temperature variations of static and dynamic properties in glass-forming liquids".  United States.  https://doi.org/10.1103/PhysRevE.94.060603.  https://www.osti.gov/servlets/purl/1347331.

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@article{osti_1347331,

  title        = {Correlation between temperature variations of static and dynamic properties in glass-forming liquids},

  author       = {Voylov, D. N. and Griffin, P. J. and Mercado, B. and Keum, J. K. and Nakanishi, M. and Novikov, V. N. and Sokolov, A. P. and Oak Ridge National Lab.},

  abstractNote = {In this detailed analysis of the static structure factor S(Q) in several glass-forming liquids we show that the temperature variations of the width of the main diffraction peak Q(T ) correlate with the fragility of these liquids. Our observation suggests a direct connection between rather subtle structural changes and sharp slowing down of structural relaxation in glass-forming liquids. We also show that this observation can be rationalized using the Adam-Gibbs approach, through a connection between temperature variations of structural correlation length, lc 2 /Q, and the size of cooperatively rearranging regions.},

  doi          = {10.1103/PhysRevE.94.060603},

  journal      = {Physical Review E},

  number       = 6,

  volume       = 94,

  place        = {United States},

  year         = {Thu Dec 29 00:00:00 EST 2016},

  month        = {Thu Dec 29 00:00:00 EST 2016}

}

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Title: Correlation between temperature variations of static and dynamic properties in glass-forming liquids

Abstract

Citation Formats

Structure of vitreous and molten B2O3 measured by pulsed neutron total scattering journal, June 1990

X-ray scattering study and molecular simulation of glass forming liquids: Propylene carbonate and salol journal, September 2000

Translational diffusion in sucrose benzoate near the glass transition: Probe size dependence in the breakdown of the Stokes-Einstein equation journal, June 2007

The liquid-glass transition in a strong network glass former investigated by neutron scattering journal, July 1999

Dynamics of glass‐forming liquids. I. Temperature‐derivative analysis of dielectric relaxation data journal, April 1995

Temperature dependence of local segmental motion in polystyrene and its variation with molecular weight journal, July 2003

Structure of liquid and glassy ZnCl 2 journal, September 2010

Universal relation between viscous flow and fast dynamics in glass-forming materials journal, March 2010

Liquid structure: Is it directly correlative to glass-forming ability? journal, July 2007

Anomalous structural evolution and liquid fragility signatures in Cu–Zr and Cu–Hf liquids and glasses journal, November 2013

Structural changes in sodium tetrasilicate glass around the liquid-glass transition: a neutron diffraction study journal, December 1998

Intermediate-range order in binary chalcogenide glasses: The first sharp diffraction peak journal, December 1988

Neutron scattering studies of the model glass former ortho -terphenyl journal, October 2001

A structural signature of liquid fragility journal, August 2014

Theoretical perspective on the glass transition and amorphous materials journal, June 2011

Correlation between dynamic fragility and glass transition temperature for different classes of glass forming liquids journal, August 2006

Structure and Dynamics of Poly( n -decyl methacrylate) below and above the Glass Transition journal, October 1998

A neutron diffraction study of Ca0.4K0.6(NO3)1.4 from the glass to liquid state journal, June 1997

Structural studies of an organic liquid through the glass transition journal, November 1996

Thermodynamic signature of growing amorphous order in glass-forming liquids journal, August 2008

Topological versus chemical ordering in network glasses at intermediate and extended length scales journal, May 2005

Temperature-dependent structure of methyltributylammonium bis(trifluoromethylsulfonyl)amide: X ray scattering and simulations journal, February 2011

Supercooled liquids and the glass transition journal, March 2001

Elements of Modern X-ray Physics book, March 2011

Network Topology and the Fragility of Tetrahedral Glass-Forming Liquids journal, October 2009

Molecular Weight Dependence of Fragility in Polystyrene journal, July 1998

Structural evolution in Ni–Nb and Ni–Nb–Ta liquids and glasses — A measure of liquid fragility? journal, February 2013

The structure of vitreous and liquid GeSe2: a neutron diffraction study journal, November 1990

Viscous flow in silica and binary liquid silicates journal, January 1955

Through the Glass Lightly journal, March 1995

Spectroscopy simulation and scattering, and the medium range order problem in glass journal, August 1985

Medium-Range Order in Silica, the Canonical Network Glass journal, January 1996

Thermodynamics, Structure, and Dynamics in Room Temperature Ionic Liquids: The Case of 1-Butyl-3-methyl Imidazolium Hexafluorophosphate ([bmim][PF 6 ]) journal, October 2006

On the Temperature Dependence of Cooperative Relaxation Properties in Glass‐Forming Liquids journal, July 1965

Fifth-order susceptibility unveils growth of thermodynamic amorphous order in glass-formers journal, June 2016

Medium-range order in glasses: Comparison of Raman and diffraction measurements journal, September 1992

Nonexponential relaxations in strong and fragile glass formers journal, September 1993

Cooperativity and the Freezing of Molecular Motion at the Glass Transition journal, November 2013

Are polymers standard glass-forming systems? The role of intramolecular barriers on the glass-transition phenomena of glass-forming polymers journal, January 2015

Evolution of the dynamic susceptibility in molecular glass formers: Results from light scattering, dielectric spectroscopy, and NMR journal, March 2013

Formation of Glasses from Liquids and Biopolymers journal, March 1995

Anomalous structural evolution in Cu 50 Zr 50 glass-forming liquids journal, July 2013

Glassy Aging Dynamics journal, July 2005

Through the Glass Lightly journal, March 1995

Through the Glass Lightly journal, March 1995

Through the Glass Lightly journal, March 1995

Non-exponential relaxations in strong and fragile glass-formers text, January 1993

Through the Glass Lightly journal, March 1995

Through the Glass Lightly journal, March 1995

Thermodynamic signature of growing amorphous order in glass-forming liquids text, January 2008

Theoretical perspective on the glass transition and amorphous materials text, January 2010

Glassy Aging Dynamics text, January 2005

The role of local-geometrical-orders on the growth of dynamic-length-scales in glass-forming liquids journal, January 2018

Local Density Correlations in Liquids journal, February 2020

Structure of vitreous and molten B2O3 measured by pulsed neutron total scattering
journal, June 1990

X-ray scattering study and molecular simulation of glass forming liquids: Propylene carbonate and salol
journal, September 2000

Translational diffusion in sucrose benzoate near the glass transition: Probe size dependence in the breakdown of the Stokes-Einstein equation
journal, June 2007

The liquid-glass transition in a strong network glass former investigated by neutron scattering
journal, July 1999

Dynamics of glass‐forming liquids. I. Temperature‐derivative analysis of dielectric relaxation data
journal, April 1995

Temperature dependence of local segmental motion in polystyrene and its variation with molecular weight
journal, July 2003

Structure of liquid and glassy ${ZnCl}_{2}$
journal, September 2010

Universal relation between viscous flow and fast dynamics in glass-forming materials
journal, March 2010

Liquid structure: Is it directly correlative to glass-forming ability?
journal, July 2007

Anomalous structural evolution and liquid fragility signatures in Cu–Zr and Cu–Hf liquids and glasses
journal, November 2013

Structural changes in sodium tetrasilicate glass around the liquid-glass transition: a neutron diffraction study
journal, December 1998

Intermediate-range order in binary chalcogenide glasses: The first sharp diffraction peak
journal, December 1988

Neutron scattering studies of the model glass former ortho -terphenyl
journal, October 2001

A structural signature of liquid fragility
journal, August 2014

Theoretical perspective on the glass transition and amorphous materials
journal, June 2011

Correlation between dynamic fragility and glass transition temperature for different classes of glass forming liquids
journal, August 2006

Structure and Dynamics of Poly( n -decyl methacrylate) below and above the Glass Transition
journal, October 1998

A neutron diffraction study of Ca0.4K0.6(NO3)1.4 from the glass to liquid state
journal, June 1997

Structural studies of an organic liquid through the glass transition
journal, November 1996

Thermodynamic signature of growing amorphous order in glass-forming liquids
journal, August 2008

Topological versus chemical ordering in network glasses at intermediate and extended length scales
journal, May 2005

Temperature-dependent structure of methyltributylammonium bis(trifluoromethylsulfonyl)amide: X ray scattering and simulations
journal, February 2011

Supercooled liquids and the glass transition
journal, March 2001

Elements of Modern X-ray Physics
book, March 2011

Network Topology and the Fragility of Tetrahedral Glass-Forming Liquids
journal, October 2009

Molecular Weight Dependence of Fragility in Polystyrene
journal, July 1998

Structural evolution in Ni–Nb and Ni–Nb–Ta liquids and glasses — A measure of liquid fragility?
journal, February 2013

The structure of vitreous and liquid GeSe2: a neutron diffraction study
journal, November 1990

Viscous flow in silica and binary liquid silicates
journal, January 1955

Through the Glass Lightly
journal, March 1995

Spectroscopy simulation and scattering, and the medium range order problem in glass
journal, August 1985

Medium-Range Order in Silica, the Canonical Network Glass
journal, January 1996

Thermodynamics, Structure, and Dynamics in Room Temperature Ionic Liquids: The Case of 1-Butyl-3-methyl Imidazolium Hexafluorophosphate ([bmim][PF ₆ ])
journal, October 2006

On the Temperature Dependence of Cooperative Relaxation Properties in Glass‐Forming Liquids
journal, July 1965

Fifth-order susceptibility unveils growth of thermodynamic amorphous order in glass-formers
journal, June 2016

Medium-range order in glasses: Comparison of Raman and diffraction measurements
journal, September 1992

Nonexponential relaxations in strong and fragile glass formers
journal, September 1993

Cooperativity and the Freezing of Molecular Motion at the Glass Transition
journal, November 2013

Are polymers standard glass-forming systems? The role of intramolecular barriers on the glass-transition phenomena of glass-forming polymers
journal, January 2015

Evolution of the dynamic susceptibility in molecular glass formers: Results from light scattering, dielectric spectroscopy, and NMR
journal, March 2013

Formation of Glasses from Liquids and Biopolymers
journal, March 1995

Anomalous structural evolution in Cu ₅₀ Zr ₅₀ glass-forming liquids
journal, July 2013

Glassy Aging Dynamics
journal, July 2005

Through the Glass Lightly
journal, March 1995

Through the Glass Lightly
journal, March 1995

Through the Glass Lightly
journal, March 1995

Non-exponential relaxations in strong and fragile glass-formers
text, January 1993

Through the Glass Lightly
journal, March 1995

Through the Glass Lightly
journal, March 1995

Thermodynamic signature of growing amorphous order in glass-forming liquids
text, January 2008

Theoretical perspective on the glass transition and amorphous materials
text, January 2010

Glassy Aging Dynamics
text, January 2005

The role of local-geometrical-orders on the growth of dynamic-length-scales in glass-forming liquids
journal, January 2018

Local Density Correlations in Liquids
journal, February 2020