Molecular dynamics study on cluster structure of 2-D LJ fluid and water

Taku Ohara, Toru Watanabe

Research output: Contribution to journalArticlepeer-review

Abstract

A molecular dynamics simulation has been performed for the two-dimensional Lennard-Jones (12-6) fluid. Saturated liquid at low temperature, compressed liquid, and fluid at supercritical temperatures with various densities were analyzed. Number of bonds per molecule, lifetime of bonds, connectivity of molecules to form clusters, stability of clusters, and their responces to temperature and density are compared with those of hydrogen bond in water.

Original languageEnglish
Pages (from-to)3414-3422
Number of pages9
JournalNihon Kikai Gakkai Ronbunshu, B Hen/Transactions of the Japan Society of Mechanical Engineers, Part B
Volume64
Issue number626
DOIs
Publication statusPublished - 1998 Oct

Keywords

  • 2-D LJ fluid
  • Cluster
  • Hydrogen bond
  • Molecular dynamics
  • Network
  • Water

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Mechanical Engineering

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