Pictorial Studies of Molecules 1: Molecular Orbital Density Comparisons of H2, Li2, B2, C2, N2, O2, and F2 (open access)

Pictorial Studies of Molecules 1: Molecular Orbital Density Comparisons of H2, Li2, B2, C2, N2, O2, and F2

From Review of Theory: " In practice, a very close approximation to the molecular orbitals can be obtained in this way. Recent calculations of this type, utilizing analysis and computer programs developed by the author, have resulted in the determination of the molecular orbitals for a large number of diatomic molecules in the form of Eq. (2). These functions, which are thought to be very close to the Hartree-Fock (i.e., the molecular orbitals demanded by theory) result, were used in the pictorial calculations presented in this report."
Date: July 1965
Creator: Wahl, Arnold C.
System: The UNT Digital Library