A New Empirical Potential Hypersurface for Bimolecular Reaction Systems.

Abstract

A fully empirical procedure for generating chemically accurate potential hypersurfaces for triatomic bimolecular reaction systems is described and applied to the H3 system. (Author)

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Document Details

Document Type
Technical Report
Publication Date
Jan 01, 1977
Accession Number
ADA044719

Entities

People

  • Michael J. Berry
  • Oded Kafri

Organizations

  • University of Wisconsin–Madison

Tags

DTIC Thesaurus Topics

  • Air Force
  • Atoms
  • Calibration
  • Chemical Reactions
  • Computations
  • Diatomic Molecules
  • Energy
  • Experimental Data
  • Geometry
  • Ground State
  • Heat Of Activation
  • Molecules
  • Morse Potential
  • New York
  • Numerical Analysis
  • Potential Energy
  • Two Dimensional

Readers

  • Molecular Photonics/Laser Physics
  • Quantum Chemistry