skip to main content
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

This content will become publicly available on November 18, 2020

Title: Smallest water clusters supporting the ice I structure

Abstract

This paper is a commentary on the article "The end of ice i., by D. R. Moberg et al., Proc. Natl. Academy Sci. U. S. A. 116, 24413-24419 (2019) which addresses the question as to how many water molecules must be in a finite water cluster for the cluster to display ice I character.

Authors:
 [1]
  1. Univ. of Pittsburgh, PA (United States)
Publication Date:
Research Org.:
Univ. of Pittsburgh, PA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22); National Science Foundation (NSF)
OSTI Identifier:
1598508
Alternate Identifier(s):
OSTI ID: 1577401
Grant/Contract Number:  
[FG02-00ER15066; CHE-1762337]
Resource Type:
Accepted Manuscript
Journal Name:
Proceedings of the National Academy of Sciences of the United States of America
Additional Journal Information:
[ Journal Volume: 116; Journal Issue: 49]; Journal ID: ISSN 0027-8424
Publisher:
National Academy of Sciences
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; ice I; water clusters; melting behavior

Citation Formats

Jordan, Kenneth D. Smallest water clusters supporting the ice I structure. United States: N. p., 2019. Web. doi:10.1073/pnas.1918178116.
Jordan, Kenneth D. Smallest water clusters supporting the ice I structure. United States. doi:10.1073/pnas.1918178116.
Jordan, Kenneth D. Mon . "Smallest water clusters supporting the ice I structure". United States. doi:10.1073/pnas.1918178116.
@article{osti_1598508,
title = {Smallest water clusters supporting the ice I structure},
author = {Jordan, Kenneth D.},
abstractNote = {This paper is a commentary on the article "The end of ice i., by D. R. Moberg et al., Proc. Natl. Academy Sci. U. S. A. 116, 24413-24419 (2019) which addresses the question as to how many water molecules must be in a finite water cluster for the cluster to display ice I character.},
doi = {10.1073/pnas.1918178116},
journal = {Proceedings of the National Academy of Sciences of the United States of America},
number = [49],
volume = [116],
place = {United States},
year = {2019},
month = {11}
}

Journal Article:
Free Publicly Available Full Text
This content will become publicly available on November 18, 2020
Publisher's Version of Record

Save / Share:

Works referenced in this record:

The end of ice I
journal, November 2019

  • Moberg, Daniel R.; Becker, Daniel; Dierking, Christoph W.
  • Proceedings of the National Academy of Sciences, Vol. 116, Issue 49
  • DOI: 10.1073/pnas.1914254116

Crystallization, Melting, and Structure of Water Nanoparticles at Atmospherically Relevant Temperatures
journal, April 2012

  • Johnston, Jessica C.; Molinero, Valeria
  • Journal of the American Chemical Society, Vol. 134, Issue 15
  • DOI: 10.1021/ja210878c

Structure of solid water clusters formed in a free jet expansion
journal, December 1983

  • Torchet, G.; Schwartz, P.; Farges, J.
  • The Journal of Chemical Physics, Vol. 79, Issue 12
  • DOI: 10.1063/1.445803

A Fully Size-Resolved Perspective on the Crystallization of Water Clusters
journal, September 2012


Delayed Onset of Crystallinity in Ion-Containing Aqueous Nanodrops
journal, December 2015

  • Cooper, Richard J.; DiTucci, Matthew J.; Chang, Terrence M.
  • Journal of the American Chemical Society, Vol. 138, Issue 1
  • DOI: 10.1021/jacs.5b11880

Solid water clusters in the size range of tens–thousands of H 2 O: a combined computational/spectroscopic outlook
journal, July 2004

  • Buch *, Victoria; Sigurd, Bauerecker; Paul Devlin, J.
  • International Reviews in Physical Chemistry, Vol. 23, Issue 3
  • DOI: 10.1080/01442350412331316124

Larger Water Clusters with Edges and Corners on Their Way to Ice:  Structural Trends Elucidated with an Improved Parallel Evolutionary Algorithm
journal, May 2006

  • Bandow, Bernhard; Hartke, Bernd
  • The Journal of Physical Chemistry A, Vol. 110, Issue 17
  • DOI: 10.1021/jp060512l

Development of a “First Principles” Water Potential with Flexible Monomers. II: Trimer Potential Energy Surface, Third Virial Coefficient, and Small Clusters
journal, March 2014

  • Babin, Volodymyr; Medders, Gregory R.; Paesani, Francesco
  • Journal of Chemical Theory and Computation, Vol. 10, Issue 4
  • DOI: 10.1021/ct500079y

Water Modeled As an Intermediate Element between Carbon and Silicon
journal, April 2009

  • Molinero, Valeria; Moore, Emily B.
  • The Journal of Physical Chemistry B, Vol. 113, Issue 13
  • DOI: 10.1021/jp805227c

Freezing, melting, spinodals, and clusters
journal, September 1989


Melting and freezing of small argon clusters
journal, April 1990

  • Wales, David J.; Berry, R. Stephen
  • The Journal of Chemical Physics, Vol. 92, Issue 7
  • DOI: 10.1063/1.457788

Dynamical Aspects of Isomerization and Melting Transitions in [H 2 O] 8
journal, March 2001

  • Laria, Daniel; Rodriguez, Javier; Dellago, Christoph
  • The Journal of Physical Chemistry A, Vol. 105, Issue 12
  • DOI: 10.1021/jp003955c

Parallel-Tempering Monte Carlo Study of (H 2 O) n = 6 - 9
journal, September 2003

  • Tharrington, Arnold N.; Jordan, Kenneth D.
  • The Journal of Physical Chemistry A, Vol. 107, Issue 38
  • DOI: 10.1021/jp030355f

Molecular complexes in close and far away
journal, June 2006

  • Klemperer, W.; Vaida, V.
  • Proceedings of the National Academy of Sciences, Vol. 103, Issue 28
  • DOI: 10.1073/pnas.0508231103

Nucleation and particle formation in the upper atmosphere
journal, October 1989


Water properties under nano-scale confinement
journal, June 2019


Ice–Liquid Oscillations in Nanoconfined Water
journal, July 2018