Theoretical Studies of Gas Phase Elementary Reactions

Abstract

This final technical report begins with the objective the project, followed by summary reports on new accomplishments and findings obtained in the project. They are presented in four sections: A. Potential Energy Surfaces of Ion-Molecule Reactions and Ionic Species, B. Potential Energy Surfaces for Elementary Reactions of Atmospheric Importance, C. Potential Energy Surfaces for Electronic Spectroscopy, Photochemical Reactions and Nonadiabatic Processes. D. Interaction of Oxygen and Other Small Molecules with Electron and Other Molecules.

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Document Details

Document Type
Technical Report
Publication Date
Jun 01, 2007
Accession Number
ADA469625

Entities

People

  • Keiji Morokuma

Organizations

  • Emory University

Tags

Communities of Interest

  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Air Force
  • Air Force Research Laboratories
  • Charge Transfer
  • Chemical Reaction Properties
  • Chemical Reactions
  • Chemistry
  • Dissociation
  • Electronic States
  • Electrons
  • Energy
  • First Principles Calculations
  • Molecules
  • Photochemical Reactions
  • Photodissociation
  • Potential Energy
  • Small Molecules
  • Spectra

Fields of Study

  • Physics

Readers

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

Technology Areas

  • Microelectronics