Cohesive Energy of the Lithium Metal by the AMO Method

  • Gunnar Sperber
  • Jean-Louis Calais
Conference paper
Part of the The IBM Research Symposia Series book series (IRSS)

Abstract

The total energy per atom of the lithium metal has been calculated as a function of the internuclear distance with several versions of the alternant molecular orbital method (AMO). This method is applicable to alternant systems like the body-centered cubic lattice of the alkali metals. The purpose of the method is to allow electrons with different spins to occupy different orbitals in order to account at least partially for correlation.

Keywords

Lithium 

Copyright information

© Plenum Press, New York 1972

Authors and Affiliations

  • Gunnar Sperber
    • 1
  • Jean-Louis Calais
    • 1
  1. 1.Quantum Chemistry GroupUniversity of UppsalaUppsalaSweden

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