Final Report on Contract N00014-92-C-0173 (Office of Naval Research)

Abstract

The primary objective of the proposal was the design and execution of computer experiments designed to provide the first detailed picture of the dynamics of adsorption of ions and small neutrals on metal electrode surfaces as well as any concomitant changes in the electric double layer. Using molecular dynamic (MD) and Monte Carlo (MC) statistical techniques video movies of these simulations became an integral part of the effort, since visual aids sharpen our perceptions and allow us to visualize the dynamics of these processes better than charts and graphs.

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Document Details

Document Type
Technical Report
Publication Date
Jan 10, 2001
Accession Number
ADA387912

Entities

People

  • Michael Philpott

Organizations

  • International Business Machines Corporation (Armonk, NY)

Tags

Communities of Interest

  • Advanced Electronics
  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Birds
  • Chemical Reactions
  • Chemical Synthesis
  • Chemistry
  • Computational Science
  • Computer Simulations
  • Crystal Structure
  • Dielectric Permittivity
  • Electrodes
  • Electromagnetic Fields
  • Energy Bands
  • Material Degradation Processes
  • Materials Laboratories
  • Materials Science
  • Molecular Dynamics
  • Monte Carlo Method
  • Three Dimensional

Readers

  • Computational Modeling and Simulation
  • Electrochemical Engineering/ Fuel Cell Technologies
  • Technical Research and Report Writing.