Computational Design of Carbon Nanocomposite Conductors

Abstract

Computational materials design offers important opportunities for the development of improved naval platforms. New multiphysics simulation methods can strongly complement experimental research in the Power and Energy focus area. This grant developed and validated a new multiscale modeling approach to nanocomposite conductor design, including a novel nonholonomic Hamiltonian method for ab initio molecular dynamics.

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Document Details

Document Type
Technical Report
Publication Date
Dec 31, 2018
Accession Number
AD1067128

Entities

People

  • Eric P Fahrenthold

Organizations

  • University of Texas at Austin

Tags

Communities of Interest

  • Advanced Electronics

DTIC Thesaurus Topics

  • Band Structures
  • Carbon Nanotubes
  • Composite Material Fabrication
  • Composite Materials
  • Computational Science
  • Density Functional Theory
  • Department Of Defense
  • Electrical Conductivity
  • Fullerenes
  • Graphene
  • Materials
  • Materials Processing
  • Materials Science
  • Materials Testing
  • Mechanical Engineering
  • Molecular Dynamics
  • Payload

Fields of Study

  • Physics

Readers

  • Computational Fluid Dynamics (CFD)
  • Integrated Circuit Design and Technology.
  • Quantum Chemistry