Phase transitions and dynamics of bulk and interfacial water

J Phys Condens Matter. 2010 Jul 21;22(28):284103. doi: 10.1088/0953-8984/22/28/284103. Epub 2010 Jun 21.

Abstract

New experiments on water at the surface of proteins at very low temperature display intriguing dynamic behaviors. The extreme conditions of these experiments make it difficult to explore the wide range of thermodynamic state points needed to offer a suitable interpretation. Detailed simulations suffer from the same problem, where equilibration times at low temperature become extremely long. We show how Monte Carlo simulations and mean field calculations using a tractable model of water help interpret the experimental results. Here we summarize the results for bulk water and investigate the thermodynamic and dynamic properties of supercooled water at an interface.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Cold Temperature
  • Computer Simulation
  • Models, Chemical*
  • Solutions / chemistry*
  • Surface Properties*
  • Water / chemistry*

Substances

  • Solutions
  • Water