Molecular Orbital Calculations on Molecules of Air Force Interest.

Abstract

Quantum mechanical problems of Air Force interest have been studied using available semiempirical molecular orbital programs. Results for NF potential curves were not satisfactory. Studies of molecules involved in TNT thermochemical decomposition, organic electrochemistry, and rocket plumes have yielded promising results. (Author)

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Document Details

Document Type
Technical Report
Publication Date
May 01, 1978
Accession Number
ADA055072

Entities

People

  • Larry P. Davis
  • R. Martin Guidry

Organizations

  • United States Air Force Academy

Tags

Communities of Interest

  • Energy and Power Technologies
  • Materials and Manufacturing Processes
  • Weapons Technologies

DTIC Thesaurus Topics

  • Air Force
  • Chemical Compounds
  • Chemical Reaction Properties
  • Chemical Reactions
  • Chemistry
  • Colorado
  • Decomposition
  • Electronic States
  • Elements
  • Energy
  • Explosives
  • Geometry
  • Heat Of Activation
  • Heat Of Formation
  • Molecules
  • Security
  • United States

Fields of Study

  • Chemistry

Readers

  • Explosive Engineering.
  • Molecular Photonics/Laser Physics
  • Quantum Chemistry

Technology Areas

  • Quantum Computing
  • Space