molecular orbital
Noun
Meaning
molecular orbital (plural molecular orbitals)
(quantum mechanics, chemistry) The quantum mechanical behaviour of an electron in a molecule describing the probability of the electron's particular position and energy; approximated by a linear combination of atomic orbitals.
Examples
My monograph on visible spectroscopy using molecular orbital notations eventually resulted into a book in 1960.
Molecular orbital examples Homonuclear diatomics Homonuclear diatomic MOs contain equal contributions from each atomic orbital in the basis set.
More sophisticated models embrace covalency, and this approach is described by ligand field theory (LFT) and Molecular orbital theory (MO).
Molecular orbital theory predicts a stable "curocene" complex (η 8 -C 8 H 8 ) 2 Cm, but it has not been reported experimentally yet.