In situ x-ray diffraction study of polyamorphism in H2O under isothermal compression and decompression
Abstract
Amorphous-amorphous transformations in H2O have been studied under rapid isothermal compression and decompression in a diamond anvil cell together with in situ x-ray diffraction measurements using brilliant synchrotron radiation. The experimental pathways provide a density-driven approach for studying polyamorphic relations among low-, high-, and very high-density amorphs (LDA, HDA, VHDA) in a pressure range of 0-3.5 GPa at temperatures of 145-160 K. Our approach using rapid (de) compression allows for studying the polyamorphic transformations at higher temperatures than the conditions previously studied under slow (de) compression or isobaric annealing. Multiple compression-decompression cycles can be integrated with in situ x-ray measurements, thus facilitating the study of repeatability and reversibility of the polyamorphic transformations. Fast in situ x-ray diffraction measurements allow for obtaining detailed insight into the structural changes across polyamorphic transformations regarding the (dis) continuity, reversibility, and possible intermediate forms. As demonstrated at isothermal conditions of 145 K and 155 K, the polyamorphic transformations are characterized by a sharp and reversible LDA-VHDA transformation, with an HDA-like form (referred to as HDA' appearing as an intermediate state. The LDA-VHDA transformation is found to occur in two steps: a discontinuous transition between LDA and HDA' and a continuous change within HDA' involving structuralmore »
- Authors:
-
[1];
[1];
[1];
- Argonne National Lab. (ANL), Argonne, IL (United States). X-ray Science Division
- Publication Date:
- Research Org.:
- Argonne National Lab. (ANL), Argonne, IL (United States)
- Sponsoring Org.:
- USDOE National Nuclear Security Administration (NNSA); National Science Foundation (NSF); USDOE Office of Science - Office of Basic Energy Sciences - Scientific User Facilities Division
- OSTI Identifier:
- 1559888
- Alternate Identifier(s):
- OSTI ID: 1529662
- Grant/Contract Number:
- AC02-06CH11357; AC02- 06CH11357; NNSA Office of Experimental Science
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Journal of Chemical Physics
- Additional Journal Information:
- Journal Volume: 150; Journal Issue: 24; Journal ID: ISSN 0021-9606
- Publisher:
- American Institute of Physics (AIP)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Citation Formats
Shen, Guoyin, Smith, Jesse S., Kenney-Benson, Curtis, and Ferry, Richard A. In situ x-ray diffraction study of polyamorphism in H2O under isothermal compression and decompression. United States: N. p., 2019.
Web. doi:10.1063/1.5100958.
Shen, Guoyin, Smith, Jesse S., Kenney-Benson, Curtis, & Ferry, Richard A. In situ x-ray diffraction study of polyamorphism in H2O under isothermal compression and decompression. United States. https://doi.org/10.1063/1.5100958
Shen, Guoyin, Smith, Jesse S., Kenney-Benson, Curtis, and Ferry, Richard A. Fri .
"In situ x-ray diffraction study of polyamorphism in H2O under isothermal compression and decompression". United States. https://doi.org/10.1063/1.5100958. https://www.osti.gov/servlets/purl/1559888.
@article{osti_1559888,
title = {In situ x-ray diffraction study of polyamorphism in H2O under isothermal compression and decompression},
author = {Shen, Guoyin and Smith, Jesse S. and Kenney-Benson, Curtis and Ferry, Richard A.},
abstractNote = {Amorphous-amorphous transformations in H2O have been studied under rapid isothermal compression and decompression in a diamond anvil cell together with in situ x-ray diffraction measurements using brilliant synchrotron radiation. The experimental pathways provide a density-driven approach for studying polyamorphic relations among low-, high-, and very high-density amorphs (LDA, HDA, VHDA) in a pressure range of 0-3.5 GPa at temperatures of 145-160 K. Our approach using rapid (de) compression allows for studying the polyamorphic transformations at higher temperatures than the conditions previously studied under slow (de) compression or isobaric annealing. Multiple compression-decompression cycles can be integrated with in situ x-ray measurements, thus facilitating the study of repeatability and reversibility of the polyamorphic transformations. Fast in situ x-ray diffraction measurements allow for obtaining detailed insight into the structural changes across polyamorphic transformations regarding the (dis) continuity, reversibility, and possible intermediate forms. As demonstrated at isothermal conditions of 145 K and 155 K, the polyamorphic transformations are characterized by a sharp and reversible LDA-VHDA transformation, with an HDA-like form (referred to as HDA' appearing as an intermediate state. The LDA-VHDA transformation is found to occur in two steps: a discontinuous transition between LDA and HDA' and a continuous change within HDA' involving structural reconfigurations and finally converging to VHDA. Published under license by AIP Publishing.},
doi = {10.1063/1.5100958},
journal = {Journal of Chemical Physics},
number = 24,
volume = 150,
place = {United States},
year = {Fri Jun 28 00:00:00 EDT 2019},
month = {Fri Jun 28 00:00:00 EDT 2019}
}
Free Publicly Available Full Text
Publisher's Version of Record
Other availability
Search WorldCat to find libraries that may hold this journal
Cited by: 2 works
Citation information provided by
Web of Science
Web of Science
Figures / Tables:
Figure 1: Sample configuration in a diamond anvil cell for rapid compression and decompression. Small ruby balls and gold grains are used for pressure measurements.
All figures and tables
(7 total)
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.
Works referenced in this record:
The laser micro-machining system for diamond anvil cell experiments and general precision machining applications at the High Pressure Collaborative Access Team
journal, July 2015
- Hrubiak, Rostislav; Sinogeikin, Stanislav; Rod, Eric
- Review of Scientific Instruments, Vol. 86, Issue 7
How many amorphous ices are there?
journal, January 2011
- Loerting, Thomas; Winkel, Katrin; Seidl, Markus
- Physical Chemistry Chemical Physics, Vol. 13, Issue 19
Developments in time-resolved high pressure x-ray diffraction using rapid compression and decompression
journal, July 2015
- Smith, Jesse S.; Sinogeikin, Stanislav V.; Lin, Chuanlong
- Review of Scientific Instruments, Vol. 86, Issue 7
‘Melting ice’ I at 77 K and 10 kbar: a new method of making amorphous solids
journal, August 1984
- Mishima, O.; Calvert, L. D.; Whalley, E.
- Nature, Vol. 310, Issue 5976
In situ neutron diffraction studies of high density amorphous ice under pressure
journal, March 2005
- Klotz, Stefan; Strässle, Th; Saitta, A. M.
- Journal of Physics: Condensed Matter, Vol. 17, Issue 11
Recrystallisation of HDA ice under pressure by in-situ neutron diffraction to 3.9 GPa
journal, January 2003
- Klotz, S.; Hamel, G.; Loveday, J. S.
- Zeitschrift für Kristallographie - Crystalline Materials, Vol. 218, Issue 2
Structure of a New Dense Amorphous Ice
journal, October 2002
- Finney, J. L.; Bowron, D. T.; Soper, A. K.
- Physical Review Letters, Vol. 89, Issue 20
Phase behaviour of metastable water
journal, November 1992
- Poole, Peter H.; Sciortino, Francesco; Essmann, Ulrich
- Nature, Vol. 360, Issue 6402
An apparently first-order transition between two amorphous phases of ice induced by pressure
journal, March 1985
- Mishima, O.; Calvert, L. D.; Whalley, E.
- Nature, Vol. 314, Issue 6006
Relationship between melting and amorphization of ice
journal, December 1996
- Mishima, Osamu
- Nature, Vol. 384, Issue 6609
A second distinct structural “state” of high-density amorphous ice at 77 K and 1 bar
journal, December 2001
- Loerting, Thomas; Salzmann, Christoph; Kohl, Ingrid
- Physical Chemistry Chemical Physics, Vol. 3, Issue 24
Neutron diffraction observations of interstitial protons in dense ice
journal, June 2013
- Guthrie, M.; Boehler, R.; Tulk, C. A.
- Proceedings of the National Academy of Sciences, Vol. 110, Issue 26
Online remote control systems for static and dynamic compression and decompression using diamond anvil cells
journal, July 2015
- Sinogeikin, Stanislav V.; Smith, Jesse S.; Rod, Eric
- Review of Scientific Instruments, Vol. 86, Issue 7
Evolution of the structure of amorphous ice: From low-density amorphous through high-density amorphous to very high-density amorphous ice
journal, April 2005
- Martoňák, R.; Donadio, D.; Parrinello, M.
- The Journal of Chemical Physics, Vol. 122, Issue 13
X-ray Scattering and O–O Pair-Distribution Functions of Amorphous Ices
journal, July 2018
- Mariedahl, Daniel; Perakis, Fivos; Späh, Alexander
- The Journal of Physical Chemistry B, Vol. 122, Issue 30
Experimental evidence of low-density liquid water upon rapid decompression
journal, February 2018
- Lin, Chuanlong; Smith, Jesse S.; Sinogeikin, Stanislav V.
- Proceedings of the National Academy of Sciences, Vol. 115, Issue 9
Direct transformation of ice VII′ to low-density amorphous ice
journal, March 2006
- Yoshimura, Yukihiro; Mao, Ho-kwang; Hemley, Russell J.
- Chemical Physics Letters, Vol. 420, Issue 4-6
The glass–liquid transition of hyperquenched water
journal, December 1987
- Johari, G. P.; Hallbrucker, Andreas; Mayer, Erwin
- Nature, Vol. 330, Issue 6148
Structural Studies of Several Distinct Metastable Forms of Amorphous Ice
journal, August 2002
- Tulk, C. A.
- Science, Vol. 297, Issue 5585
Experimental study of the polyamorphism of water. II. The isobaric transitions between HDA and VHDA at intermediate and high pressures
journal, March 2018
- Handle, Philip H.; Loerting, Thomas
- The Journal of Chemical Physics, Vol. 148, Issue 12
The structural origin of anomalous properties of liquid water
journal, December 2015
- Nilsson, Anders; Pettersson, Lars G. M.
- Nature Communications, Vol. 6, Issue 1
Annealed high-density amorphous ice under pressure
journal, May 2006
- Nelmes, Richard J.; Loveday, John S.; Strässle, Thierry
- Nature Physics, Vol. 2, Issue 6
Glass-liquid transition and the enthalpy of devitrification of annealed vapor-deposited amorphous solid water: a comparison with hyperquenched glassy water
journal, June 1989
- Hallbrucker, Andreas; Mayer, Erwin; Johari, G. P.
- The Journal of Physical Chemistry, Vol. 93, Issue 12
Polyamorphism of Ice at Low Temperatures from Constant-Pressure Simulations
journal, June 2004
- Martoňák, R.; Donadio, D.; Parrinello, M.
- Physical Review Letters, Vol. 92, Issue 22
Water polyamorphism: Reversibility and (dis)continuity
journal, January 2008
- Winkel, Katrin; Elsaesser, Michael S.; Mayer, Erwin
- The Journal of Chemical Physics, Vol. 128, Issue 4
Dielectric properties of high-density amorphous ice under pressure
journal, November 2006
- Andersson, Ove; Inaba, Akira
- Physical Review B, Vol. 74, Issue 18
Polarized Raman spectroscopic study of relaxed high density amorphous ices under pressure
journal, October 2010
- Suzuki, Yoshiharu; Tominaga, Yasunori
- The Journal of Chemical Physics, Vol. 133, Issue 16
Amorphous Ice: Stepwise Formation of Very-High-Density Amorphous Ice from Low-Density Amorphous Ice at 125 K
journal, January 2006
- Loerting, Thomas; Schustereder, Werner; Winkel, Katrin
- Physical Review Letters, Vol. 96, Issue 2
Bulk moduli and equations of state of ice VII and ice VIII
journal, May 2017
- Klotz, S.; Komatsu, K.; Kagi, H.
- Physical Review B, Vol. 95, Issue 17
Nature of the Polyamorphic Transition in Ice under Pressure
journal, January 2005
- Klotz, S.; Strässle, Th.; Nelmes, R. J.
- Physical Review Letters, Vol. 94, Issue 2
Diffusive dynamics during the high-to-low density transition in amorphous ice
journal, June 2017
- Perakis, Fivos; Amann-Winkel, Katrin; Lehmkühler, Felix
- Proceedings of the National Academy of Sciences, Vol. 114, Issue 31
Structural transitions in amorphous H 2 O and D 2 O: the effect of temperature
journal, November 2008
- Winkel, Katrin; Bauer, Marion; Mayer, Erwin
- Journal of Physics: Condensed Matter, Vol. 20, Issue 49
Relation between the High Density Phase and the Very-High Density Phase of Amorphous Solid Water
journal, March 2005
- Giovambattista, Nicolas; Stanley, H. Eugene; Sciortino, Francesco
- Physical Review Letters, Vol. 94, Issue 10
Structure of High-Density Amorphous Ice under Pressure
journal, December 2002
- Klotz, S.; Hamel, G.; Loveday, J. S.
- Physical Review Letters, Vol. 89, Issue 28
Diffusive dynamics during the high-to-low density transition in amorphous ice
text, January 2017
- Perakis, Fivos; Amann-Winkel, Katrin; Lehmkühler, Felix
- Deutsches Elektronen-Synchrotron, DESY, Hamburg
Evolution of the structure of amorphous ice - from low-density amorphous (LDA) through high-density amorphous (HDA) to very high-density amorphous (VHDA) ice
text, January 2005
- Martonak, R.; Donadio, D.; Parrinello, M.
- arXiv
Works referencing / citing this record:
Supercooled water: A polymorphic liquid with a cornucopia of behaviors
journal, December 2019
- Gallo, Paola; Loerting, Thomas; Sciortino, Francesco
- The Journal of Chemical Physics, Vol. 151, Issue 21
Nature of polyamorphic transformations in under isothermal compression and decompression
journal, July 2019
- Shen, Guoyin; Smith, Jesse S.; Kenney-Benson, Curtis
- Physical Review Materials, Vol. 3, Issue 7
Figures / Tables found in this record:
Figures/Tables have been extracted from DOE-funded journal article accepted manuscripts.