Molecular dynamics simulations of consolidation processes during fabrication of nanophase palladium

C. L. Liu, James Adams, R. W. Siegel

Research output: Contribution to journalArticle

22 Citations (Scopus)

Abstract

Consolidation processes during fabrication of nanophase palladium from atom clusters are simulated using molecular statics (MS), molecular dynamics (MD), and a potential from the emebedded atom,ethod (EAM). The MD simulations are conducte3d under conditions similar experimental conditions, i.e., at room temperature (300 K) and under compressive pressures of 10-50 kbar (1-5 GPa). Several dynamic phenomena have been observed during the simulations, such as "neck" formation, surface rounding, void formation and shrinking, and cluster extrusion. The effect of applied compressive pressures on the final structures of nanophase materials during considation is demonstrated.

Original languageEnglish (US)
Pages (from-to)265-274
Number of pages10
JournalNanostructured Materials
Volume4
Issue number3
DOIs
StatePublished - 1994
Externally publishedYes

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consolidation
Palladium
Consolidation
Molecular dynamics
palladium
molecular dynamics
Fabrication
Atoms
fabrication
Computer simulation
Nanostructured materials
Extrusion
atoms
voids
simulation
room temperature
Temperature

ASJC Scopus subject areas

  • Materials Science(all)
  • Condensed Matter Physics

Cite this

Molecular dynamics simulations of consolidation processes during fabrication of nanophase palladium. / Liu, C. L.; Adams, James; Siegel, R. W.

In: Nanostructured Materials, Vol. 4, No. 3, 1994, p. 265-274.

Research output: Contribution to journalArticle

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