Physical Chemistry Third Edition

(C. Jardin) #1

20


The Electronic States


of Diatomic Molecules


PRINCIPAL FACTS AND IDEAS


  1. In the Born–Oppenheimer approximation, the nuclei of a molecule are
    assumed to be stationary when the electronic states are studied.

  2. The Schrödinger equation for the hydrogen molecule ion, H+ 2 , can be
    solved in the Born–Oppenheimer approximation without additional
    approximations. The solutions are molecular orbitals that represent
    motion of the electron around both nuclei.

  3. Molecular orbitals can be represented approximately as linear
    combinations of atomic orbitals (LCAOMOs).

  4. The electronic wave functions of homonuclear diatomic molecules can
    be approximated as products of LCAOMOs.

  5. The valence-bond method is an alternative to the molecular orbital
    method.

  6. Molecular orbitals of heteronuclear diatomic molecules correspond to
    unequal sharing of electrons.


823
Free download pdf