Theoretical Studies of Gas Phase Elementary Reactions

Abstract

This final technical report begins with the objective, followed by detailed reports on new accomplishments and new findings obtained in the project. They are presented in six sections: (A) Potential Energy Surfaces of Ion-Molecule Reactions, (B) Potential Energy Surfaces of Ions, (C) Potential Energy Surfaces for Photochemical Reactions and Nonadiabatic Processes, (D) Potential Energy Surfaces of Open-Shell Molecules, (E) Dynamics and Kinetics in the Ground Electronic State, and (F) Potential Energy Surfaces for the Dynamics of Chemical Laser Systems. The Publication List and Interactions/Transactions conclude the report.

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Document Details

Document Type
Technical Report
Publication Date
Aug 17, 2001
Accession Number
ADA395002

Entities

People

  • Keiji Morokuma

Organizations

  • Emory University

Tags

Communities of Interest

  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Air Force Research Laboratories
  • Chemical Lasers
  • Chemical Reaction Properties
  • Chemical Reactions
  • Chemistry
  • Dissociation
  • Dynamics
  • Electronic States
  • Electrons
  • Energy
  • Energy Transfer
  • First Principles Calculations
  • Ionization
  • Kinetics
  • Photochemical Reactions
  • Potential Energy
  • Spin-Orbit Interaction

Fields of Study

  • Physics

Readers

  • Molecular Photonics/Laser Physics
  • Technical Research and Report Writing.

Technology Areas

  • Directed Energy
  • Microelectronics