Accession Number:

AD0274631

Title:

CORRELATION SPLITTING IN THE HYDROGEN MOLECULE

Descriptive Note:

Corporate Author:

WISCONSIN UNIV MADISON THEORETICAL CHEMISTRY INST

Personal Author(s):

Report Date:

1962-03-14

Pagination or Media Count:

1.0

Abstract:

The difference between the energy of the best open shell and best closed shell wave functions for the H molecule were calculated for various values of the internuclear distance. Both left-right and in-out correlated functions were considered. The relative importance of the type of correlation reverses at an internuclear distance of 0.8 Bohrs. Author

Subject Categories:

Distribution Statement:

APPROVED FOR PUBLIC RELEASE