Theoretical Studies on the Structure of Inorganic and Organometallic Compounds.

Abstract

Progress in the following areas is reported: The calculation of molecular properties by semi-empirical MO methods; The development of an approximate non-empirical MO method - The LEDO method; and The development of a noniterative extended Huckel method for calculations of ground state and excited state properties of organo metallic compounds such as Zeises salt. (Author)

Document Details

Document Type
Technical Report
Publication Date
Mar 01, 1971
Accession Number
AD0720868

Entities

People

  • John E. Bloor

Organizations

  • University of Tennessee system

Tags

DTIC Thesaurus Topics

  • Chemical Compounds
  • Ground State
  • Metallic Compounds
  • Organometallic Compounds
  • Semi-Empirical Quantum Chemistry Methods

Fields of Study

  • Chemistry

Readers

  • Quantum Chemistry